An algorithm for calculating the contour Voigt and its improvement and refinement for some ranges of parameters

NASA Astrophysics Data System (ADS)

Sukhanov, AY

2017-02-01

We present an approximation Voigt contour for some parameters intervals such as the interval with y less than 0.02 and absolute value x less than 1.6 gives a simple formula for calculating and relative error less than 0.1%, and for some of the intervals suggetsted to use Hermite quadrature.

Deconvolution of Stark broadened spectra for multi-point density measurements in a flow Z-pinch

DOE PAGES

Vogman, G. V.; Shumlak, U.

2011-10-13

Stark broadened emission spectra, once separated from other broadening effects, provide a convenient non-perturbing means of making plasma density measurements. A deconvolution technique has been developed to measure plasma densities in the ZaP flow Z-pinch experiment. The ZaP experiment uses sheared flow to mitigate MHD instabilities. The pinches exhibit Stark broadened emission spectra, which are captured at 20 locations using a multi-chord spectroscopic system. Spectra that are time- and chord-integrated are well approximated by a Voigt function. The proposed method simultaneously resolves plasma electron density and ion temperature by deconvolving the spectral Voigt profile into constituent functions: a Gaussian functionmore » associated with instrument effects and Doppler broadening by temperature; and a Lorentzian function associated with Stark broadening by electron density. The method uses analytic Fourier transforms of the constituent functions to fit the Voigt profile in the Fourier domain. The method is discussed and compared to a basic least-squares fit. The Fourier transform fitting routine requires fewer fitting parameters and shows promise in being less susceptible to instrumental noise and to contamination from neighboring spectral lines. The method is evaluated and tested using simulated lines and is applied to experimental data for the 229.69 nm C III line from multiple chords to determine plasma density and temperature across the diameter of the pinch. As a result, these measurements are used to gain a better understanding of Z-pinch equilibria.« less

Deconvolution of Stark broadened spectra for multi-point density measurements in a flow Z-pinch

DOE Office of Scientific and Technical Information (OSTI.GOV)

Vogman, G. V.; Shumlak, U.

2011-10-15

Stark broadened emission spectra, once separated from other broadening effects, provide a convenient non-perturbing means of making plasma density measurements. A deconvolution technique has been developed to measure plasma densities in the ZaP flow Z-pinch experiment. The ZaP experiment uses sheared flow to mitigate MHD instabilities. The pinches exhibit Stark broadened emission spectra, which are captured at 20 locations using a multi-chord spectroscopic system. Spectra that are time- and chord-integrated are well approximated by a Voigt function. The proposed method simultaneously resolves plasma electron density and ion temperature by deconvolving the spectral Voigt profile into constituent functions: a Gaussian functionmore » associated with instrument effects and Doppler broadening by temperature; and a Lorentzian function associated with Stark broadening by electron density. The method uses analytic Fourier transforms of the constituent functions to fit the Voigt profile in the Fourier domain. The method is discussed and compared to a basic least-squares fit. The Fourier transform fitting routine requires fewer fitting parameters and shows promise in being less susceptible to instrumental noise and to contamination from neighboring spectral lines. The method is evaluated and tested using simulated lines and is applied to experimental data for the 229.69 nm C III line from multiple chords to determine plasma density and temperature across the diameter of the pinch. These measurements are used to gain a better understanding of Z-pinch equilibria.« less

Magneto-optical studies of ensembles of semimagnetic self-organized Cd(Mn)Se/Zn(Mn)Se Quantum Dots

DOE Office of Scientific and Technical Information (OSTI.GOV)

Reshina, I. I.; Ivanov, S. V.; Toropov, A. A.

2013-12-04

Ensembles of Cd(Mn)Se/ZnSe and CdSe/Zn(Mn)Se semimagnetic self-organized quantum dots with different Mn content have been studied by photoluminescence and resonant Raman scattering under strong magnetic fields in Faraday and Voigt geometries and with spectral and polarization selective excitation. Electron spin-flip Raman scattering has been observed in Voigt geometry in the structures with large Mn content. Narrow exciton peaks completely σ{sup −}σ{sup +} polarized have been observed under selective excitation in Faraday geometry in the structures with medium and small Mn content. A number of specific effects manifested themselves in the structures with a smallest Mn content where no Zeeman shiftmore » of the photoluminescence bands was observed.« less

Raman Spectra of Crystalline Double Calcium Orthovanadates Ca10M(VO4)7 (M = Li, K, Na) and Their Interpretation Based on Deconvolution Into Voigt Profiles

NASA Astrophysics Data System (ADS)

Khodasevich, I. A.; Voitikov, S. V.; Orlovich, V. A.; Kosmyna, M. B.; Shekhovtsov, A. N.

2016-09-01

Unpolarized spontaneous Raman spectra of crystalline double calcium orthovanadates Ca10M(VO4)7 (M = Li, K, Na) in the range 150-1600 cm-1 were measured. Two vibrational bands with full-width at half-maximum (FWHM) of 37-50 cm-1 were found in the regions 150-500 and 700-1000 cm-1. The band shapes were approximated well by deconvolution into Voigt profiles. The band at 700-1000 cm-1 was stronger and deconvoluted into eight Voigt profiles. The frequencies of two strong lines were ~848 and ~862 cm-1 for Ca10Li(VO4)7; ~850 and ~866 cm-1 for Ca10Na(VO4)7; and ~844 and ~866 cm-1 for Ca10K(VO4)7. The Lorentzian width parameters of these lines in the Voigt profiles were ~5 times greater than those of the Gaussian width parameters. The FWHM of the Voigt profiles were ~18-42 cm-1. The two strongest lines had widths of 21-25 cm-1. The vibrational band at 300-500 cm-1 was ~5-6 times weaker than that at 700-1000 cm-1 and was deconvoluted into four lines with widths of 25-40 cm-1. The large FWHM of the Raman lines indicated that the crystal structures were disordered. These crystals could be of interest for Raman conversion of pico- and femtosecond laser pulses because of the intense vibrations with large FWHM in the Raman spectra.

The implementation of non-Voigt line profiles in the HITRAN database: H2 case study

NASA Astrophysics Data System (ADS)

Wcisło, P.; Gordon, I. E.; Tran, H.; Tan, Y.; Hu, S.-M.; Campargue, A.; Kassi, S.; Romanini, D.; Hill, C.; Kochanov, R. V.; Rothman, L. S.

2016-07-01

Experimental capabilities of molecular spectroscopy and its applications nowadays require a sub-percent or even sub-per mille accuracy of the representation of the shapes of molecular transitions. This implies the necessity of using more advanced line-shape models which are characterized by many more parameters than a simple Voigt profile. It is a great challenge for modern molecular spectral databases to store and maintain the extended set of line-shape parameters as well as their temperature dependences. It is even more challenging to reliably retrieve these parameters from experimental spectra over a large range of pressures and temperatures. In this paper we address this problem starting from the case of the H2 molecule for which the non-Voigt line-shape effects are exceptionally pronounced. For this purpose we reanalyzed the experimental data reported in the literature. In particular, we performed detailed line-shape analysis of high-quality spectra obtained with cavity-enhanced techniques. We also report the first high-quality cavity-enhanced measurement of the H2 fundamental vibrational mode. We develop a correction to the Hartmann-Tran profile (HTP) which adjusts the HTP to the particular model of the velocity-changing collisions. This allows the measured spectra to be better represented over a wide range of pressures. The problem of storing the HTP parameters in the HITRAN database together with their temperature dependences is also discussed.

Speed dependence of CH335Cl-O2 line-broadening parameters probed on rotational transitions: Measurements and semi-classical calculations

NASA Astrophysics Data System (ADS)

Buldyreva, J.; Margulès, L.; Motiyenko, R. A.; Rohart, F.

2013-11-01

Relaxation parameters for K-components (K≤6) of six J→J+1 rotational transitions (J=6, 10, 17, 22, 31 and 33) of CH335Cl perturbed by O2 are measured at room temperature with Voigt, speed-dependent Voigt and Galatry profiles in order to probe the speed-dependence effects. With respect to the previous study of CH335Cl-N2 system [Guinet et al., J Quant Spectrosc Radiat Transfer 2012;113:1113], higher active-gas pressures are reached, providing better signal-to-noise ratios, and the exact expression of the Beer-Lambert law is introduced in the fitting procedure, leading, among other advantages, to much more realistic low-pressure results. The broadening parameters of the considered lines are also computed by a semi-classical method for various relative velocities of colliders and the powers characterizing the dependence of the collisional cross-sections on relative speeds are deduced as functions of the rotational numbers J and K. Additional calculations performed with the Maxwell-Boltzmann distribution of velocities show no significant difference with the earlier results [Buldyreva et al., Phys Chem Chem Phys 2011;13:20326] obtained within the mean thermal velocity approximation. Weighted sums of the presently measured Voigt-profile O2-broadening parameters and of the previously published N2-broadening ones are calculated to yield experimental air-broadening coefficients for spectroscopic databases.

Speed-dependent Voigt lineshape parameter database from dual frequency comb measurements up to 1305 K. Part I: Pure H2O absorption, 6801-7188 cm-1

NASA Astrophysics Data System (ADS)

Schroeder, Paul J.; Cich, Matthew J.; Yang, Jinyu; Giorgetta, Fabrizio R.; Swann, William C.; Coddington, Ian; Newbury, Nathan R.; Drouin, Brian J.; Rieker, Gregory B.

2018-05-01

We measure speed-dependent Voigt lineshape parameters with temperature-dependence exponents for several hundred spectroscopic features of pure water spanning 6801-7188 cm-1. The parameters are extracted from broad bandwidth, high-resolution dual frequency comb absorption spectra with multispectrum fitting techniques. The data encompass 25 spectra ranging from 296 K to 1305 K and 1 to 17 Torr of pure water vapor. We present the extracted parameters, compare them to published data, and present speed-dependence, self-shift, and self-broadening temperature-dependent parameters for the first time. Lineshape data is extracted using a quadratic speed-dependent Voigt profile and a single self-broadening power law temperature-dependence exponent over the entire temperature range. The results represent an important step toward a new high-temperature database using advanced lineshape profiles.

Do Reuss and Voigt Bounds Really Bound in High-Pressure Rheology Experiments?

DOE Office of Scientific and Technical Information (OSTI.GOV)

Chen,J.; Li, L.; Yu, T.

2006-01-01

Energy dispersive synchrotron x-ray diffraction is carried out to measure differential lattice strains in polycrystalline Fe{sub 2}SiO{sub 4} (fayalite) and MgO samples using a multi-element solid state detector during high-pressure deformation. The theory of elastic modeling with Reuss (iso-stress) and Voigt (iso-strain) bounds is used to evaluate the aggregate stress and weight parameter, {alpha} (0{le}{alpha}{le}1), of the two bounds. Results under the elastic assumption quantitatively demonstrate that a highly stressed sample in high-pressure experiments reasonably approximates to an iso-stress state. However, when the sample is plastically deformed, the Reuss and Voigt bounds are no longer valid ({alpha} becomes beyond 1).more » Instead, if plastic slip systems of the sample are known (e.g. in the case of MgO), the aggregate property can be modeled using a visco-plastic self-consistent theory.« less

Calculation of Debye-Scherrer diffraction patterns from highly stressed polycrystalline materials

DOE PAGES

MacDonald, M. J.; Vorberger, J.; Gamboa, E. J.; ...

2016-06-07

Calculations of Debye-Scherrer diffraction patterns from polycrystalline materials have typically been done in the limit of small deviatoric stresses. Although these methods are well suited for experiments conducted near hydrostatic conditions, more robust models are required to diagnose the large strain anisotropies present in dynamic compression experiments. A method to predict Debye-Scherrer diffraction patterns for arbitrary strains has been presented in the Voigt (iso-strain) limit. Here, we present a method to calculate Debye-Scherrer diffraction patterns from highly stressed polycrystalline samples in the Reuss (iso-stress) limit. This analysis uses elastic constants to calculate lattice strains for all initial crystallite orientations, enablingmore » elastic anisotropy and sample texture effects to be modeled directly. Furthermore, the effects of probing geometry, deviatoric stresses, and sample texture are demonstrated and compared to Voigt limit predictions. An example of shock-compressed polycrystalline diamond is presented to illustrate how this model can be applied and demonstrates the importance of including material strength when interpreting diffraction in dynamic compression experiments.« less

Investigations of Cyclotron Resonance in InSb and PbTe: Intraband Transitions between Landau Levels

NASA Astrophysics Data System (ADS)

Burstein, Elias

2005-06-01

We describe the investigations of cyclotron resonance, and its formulation in terms of intraband transitions between Landau levels, that were carried out at the Naval Research Laboratory and the University of Pennsylvania in the 1950's and 1960's. Measurements were carried out as a function of magnetic field at fixed wavelength in the infrared in both the Faraday and Voigt configurations on an intrinsic sample of InSb sample for which ωP << ωC, and on doped n-type samples for which ωP is comparable to ωC. Azbel'-Kaner cyclotron resonance, which is also observed in the Voigt configuration, was investigated at microwave frequencies in degenerate p-type PbTe where the cyclotron orbit of the carriers is comparable to the skin depth. The results showed that AK-CR is a particularly effective tool for determining the effective mass of carriers in semiconductors at microwave frequencies when ωP cannot be made smaller than ωC.

CO{sub 2} isolated line shapes by classical molecular dynamics simulations: Influence of the intermolecular potential and comparison with new measurements

DOE Office of Scientific and Technical Information (OSTI.GOV)

Larcher, G.; Tran, H., E-mail: ha.tran@lisa.u-pec.fr; Schwell, M.

2014-02-28

Room temperature absorption spectra of various transitions of pure CO{sub 2} have been measured in a broad pressure range using a tunable diode-laser and a cavity ring-down spectrometer, respectively, in the 1.6 μm and 0.8 μm regions. Their spectral shapes have been calculated by requantized classical molecular dynamics simulations. From the time-dependent auto-correlation function of the molecular dipole, including Doppler and collisional effects, spectral shapes are directly computed without the use of any adjusted parameter. Analysis of the spectra calculated using three different anisotropic intermolecular potentials shows that the shapes of pure CO{sub 2} lines, in terms of both themore » Lorentz widths and non-Voigt effects, slightly depend on the used potential. Comparisons between these ab initio calculations and the measured spectra show satisfactory agreement for all considered transitions (from J = 6 to J = 46). They also show that non-Voigt effects on the shape of CO{sub 2} transitions are almost independent of the rotational quantum number of the considered lines.« less

The Gaussian-Lorentzian Sum, Product, and Convolution (Voigt) functions in the context of peak fitting X-ray photoelectron spectroscopy (XPS) narrow scans

NASA Astrophysics Data System (ADS)

Jain, Varun; Biesinger, Mark C.; Linford, Matthew R.

2018-07-01

X-ray photoelectron spectroscopy (XPS) is arguably the most important vacuum technique for surface chemical analysis, and peak fitting is an indispensable part of XPS data analysis. Functions that have been widely explored and used in XPS peak fitting include the Gaussian, Lorentzian, Gaussian-Lorentzian sum (GLS), Gaussian-Lorentzian product (GLP), and Voigt functions, where the Voigt function is a convolution of a Gaussian and a Lorentzian function. In this article we discuss these functions from a graphical perspective. Arguments based on convolution and the Central Limit Theorem are made to justify the use of functions that are intermediate between pure Gaussians and pure Lorentzians in XPS peak fitting. Mathematical forms for the GLS and GLP functions are presented with a mixing parameter m. Plots are shown for GLS and GLP functions with mixing parameters ranging from 0 to 1. There are fundamental differences between the GLS and GLP functions. The GLS function better follows the 'wings' of the Lorentzian, while these 'wings' are suppressed in the GLP. That is, these two functions are not interchangeable. The GLS and GLP functions are compared to the Voigt function, where the GLS is shown to be a decent approximation of it. Practically, both the GLS and the GLP functions can be useful for XPS peak fitting. Examples of the uses of these functions are provided herein.

Comments on the Voigt function implementation in the Astropy and SpectraPlot.com packages

NASA Astrophysics Data System (ADS)

Schreier, Franz

2018-07-01

The Voigt profile is important for spectroscopy, astrophysics, and many other fields of physics, but is notoriously difficult to compute. McLean et al. [1] [J. Electron Spectrosc. & Relat. Phenom., 1994] have proposed an approximation using a sum of Lorentzians. Our assessment indicates that this algorithm has significant errors for small arguments. After a brief survey of the requirements for spectroscopy we give a short list of both efficient and accurate codes and recommend implementations based on rational approximations.

Asymptotic coefficients for one-interacting-level Voigt profiles

NASA Astrophysics Data System (ADS)

Cope, D.; Lovett, R. J.

1988-02-01

The asymptotic behavior of general Voigt profiles with general width and shift functions has been determined by Cope and Lovett (1987). The resulting asymptotic coefficients are functions of the perturber/radiator mass ratio; also, the coefficients for the one-interacting-level (OIL) profiles proposed by Ward et al. (1974) were studied. In this paper, the behavior of the OIL asymptotic coefficients for large mass ratio values is determined, thereby providing a complete picture of OIL asymptotics for all mass ratios.

Fractional Generalizations of Maxwell and Kelvin-Voigt Models for Biopolymer Characterization

PubMed Central

Jóźwiak, Bertrand; Orczykowska, Magdalena; Dziubiński, Marek

2015-01-01

The paper proposes a fractional generalization of the Maxwell and Kelvin-Voigt rheological models for a description of dynamic behavior of biopolymer materials. It was found that the rheological models of Maxwell-type do not work in the case of modeling of viscoelastic solids, and the model which significantly better describes the nature of changes in rheological properties of such media is the modified fractional Kelvin-Voigt model with two built-in springpots (MFKVM2). The proposed model was used to describe the experimental data from the oscillatory and creep tests of 3% (w/v) kuzu starch pastes, and to determine the values of their rheological parameters as a function of pasting time. These parameters provide a lot of additional information about structure and viscoelastic properties of the medium in comparison to the classical analysis of dynamic curves G’ and G” and shear creep compliance J(t). It allowed for a comprehensive description of a wide range of properties of kuzu starch pastes, depending on the conditions of pasting process. PMID:26599756

Recent Line-Shape and Doppler Thermometry Studies Involving Transitions in the ν1 +ν3 Band of Acetylene

NASA Astrophysics Data System (ADS)

Hashemi, Robab; Rozario, Hoimonti; Povey, Chad; Garber, Jolene; Derksen, Mark; Predoi-Cross, Adriana

2014-06-01

The line positions for transitions in the ν1 +ν3 band are often used as a frequency standard by the telecom industry and also needed for planetary atmospheric studies. Four relevant studies have been recently carried out in our group and will be discussed briefly below. (1) N2-broadened line widths and N2-pressure induced line shifts have been measured for transitions in the ν1 +ν3 band of acetylene at seven temperatures in the range 213333K to obtain the temperature dependences of broadening and shift coefficients. The Voigt and hard-collision line profile models were used to retrieve the line parameters. This study has been published in Molecular Physics, 110 Issue 21/22 (2012) 2645-2663. (2) Six nitrogen perturbed transitions of acetylene within the ν1 +ν3 absorption band have been recorded using a 3-channel diode laser spectrometer. We have examined C2H2 spectra using a hard collision (Rautian) profile over a range of five temperatures (213 K-333 K). From these fits we have obtained the N2-broadening and narrowing coefficients of C2H2 and examined their temperature dependence. The experimentally measured narrowing coefficients have been used to estimate the nitrogen diffusion coefficients. The broadening coefficients and corresponding temperature dependence exponents have also been compared to that of calculations completed using a classical impact approach on an ab initio potential energy surface. We have observed a good agreement between our theoretical and experimental results. This study was published in Canadian Journal of Physics 91(11) 896-905 (2013). (3) An extension of the previous study was to analyze the room temperature for the same six transitions using the Voigt, Rautian, Galatry, RautianGalatry and Correlated Rautian profiles. For the entire pressure range, we have tested the applicability of these line-shape models. Except for Voigt profile, Dicke narrowing effect has been considered in all mentioned line-shape models. The experimental results for the narrowing parameters have been compared with calculated values based on the theory of diffusion. This study is in press in press in the Journal of Quantitative Spectroscopy and Radiative Transfer. (4) In this paper we present accurate measurements of the fundamental Boltzmann constant based on a lineshape analysis of acetylene spectra in the ν1 +ν3 band recorded using a tunable diode laser. Experimental spectra recorded at low pressures have been analyzed using both the Voigt model and the Speed Dependent Voigt model that takes into account the molecular speed dependence effects. These line-shape models reproduces the experimental data with high accuracy and allow us to determine precise line-shape parameters for the transitions used, the Doppler-width and then determined the Boltzmann constant, kB. This study has been submitted for publication in the Journal of Chemical Physics. 1 1 Research described in this work was funded by NSERC, Canada.

Calculation of Debye-Scherrer diffraction patterns from highly stressed polycrystalline materials

DOE Office of Scientific and Technical Information (OSTI.GOV)

MacDonald, M. J., E-mail: macdonm@umich.edu; SLAC National Accelerator Laboratory, Menlo Park, California 94025; Vorberger, J.

2016-06-07

Calculations of Debye-Scherrer diffraction patterns from polycrystalline materials have typically been done in the limit of small deviatoric stresses. Although these methods are well suited for experiments conducted near hydrostatic conditions, more robust models are required to diagnose the large strain anisotropies present in dynamic compression experiments. A method to predict Debye-Scherrer diffraction patterns for arbitrary strains has been presented in the Voigt (iso-strain) limit [Higginbotham, J. Appl. Phys. 115, 174906 (2014)]. Here, we present a method to calculate Debye-Scherrer diffraction patterns from highly stressed polycrystalline samples in the Reuss (iso-stress) limit. This analysis uses elastic constants to calculate latticemore » strains for all initial crystallite orientations, enabling elastic anisotropy and sample texture effects to be modeled directly. The effects of probing geometry, deviatoric stresses, and sample texture are demonstrated and compared to Voigt limit predictions. An example of shock-compressed polycrystalline diamond is presented to illustrate how this model can be applied and demonstrates the importance of including material strength when interpreting diffraction in dynamic compression experiments.« less

Aromaticity Parameters in Asphalt Binders Calculated From Profile Fitting X-ray Line Spectra Using Pearson VII and Pseudo-Voigt Functions

NASA Astrophysics Data System (ADS)

Shirokoff, J.; Lewis, J. Courtenay

2010-10-01

The aromaticity and crystallite parameters in asphalt binders are calculated from data obtained after profile fitting x-ray line spectra using Pearson VII and pseudo-Voigt functions. The results are presented and discussed in terms of the peak profile fit parameters used, peak deconvolution procedure, and differences in calculated values that can arise owing to peak shape and additional peaks present in the pattern. These results have implications concerning the evaluation and performance of asphalt binders used in highways and road applications.

High Pressure Elastic Constants of High-Pressure Iron Analog Osmium

NASA Astrophysics Data System (ADS)

Godwal, B. K.; Geballe, Z.; Jeanloz, R.

2011-12-01

Understanding the elasticity of hcp iron is important both for ascertaining the stable phase and for explaining the observed seismic anomalies of Earth's inner core. A systematic experimental study of analog materials is warranted because experiments at inner-core conditions remain exceptionally challenging and theory has yielded conflicting results for iron. The deformation of hexagonal close-packed (hcp) Os, an analog for the high-pressure hcp form of Fe, has been characterized under non-hydrostatic stresses using synchrotron-based angular-dispersive radial x-ray diffraction to pressures of 60 GPa at room temperature. Starting with published ultrasonic values of elastic constants and previous measurements of linear and volume compressibilities, we estimate the single-crystal elasticity tensor of osmium to 60 GPa and find that the crystal orientation with the largest shear modulus, (002), accommodates the largest shear stress (10 GPa) and a differential strain surpassing the Voigt iso-strain limit. We find the conventional elastic model, bounded by Reuss (iso-stress) and Voigt limits, inadequate for explaining our measurements. Instead, we infer that plastic deformation limits the amount of shear stress supported by the crystal planes near the a-axis, causing the more elastically strong c-axis to support the majority of the differential strain. This conclusion is consistent with the elasto-plastic self-consistent approach used to model the effect of plasticity on the high-pressure deformation of hcp-Co (Merkel et al, PRB 79, 064110 (2009)). Importantly, we document a strength anisotropy so large that the Voigt (elastic) limit is clearly surpassed.

Improving atmospheric CO2 retrievals using line mixing and speed-dependence when fitting high-resolution ground-based solar spectra

NASA Astrophysics Data System (ADS)

Mendonca, J.; Strong, K.; Toon, G. C.; Wunch, D.; Sung, K.; Deutscher, N. M.; Griffith, D. W. T.; Franklin, J. E.

2016-05-01

A quadratic speed-dependent Voigt spectral line shape with line mixing (qSDV + LM) has been included in atmospheric trace-gas retrievals to improve the accuracy of the calculated CO2 absorption coefficients. CO2 laboratory spectra were used to validate absorption coefficient calculations for three bands: the strong 20013 ← 00001 band centered at 4850 cm-1, and the weak 30013 ← 00001 and 30012 ← 00001 bands centered at 6220 cm-1 and 6340 cm-1 respectively, and referred to below as bands 1 and 2. Several different line lists were tested. Laboratory spectra were best reproduced for the strong CO2 band when using HITRAN 2008 spectroscopic data with air-broadened widths divided by 0.985, self-broadened widths divided by 0.978, line mixing coefficients calculated using the exponential power gap (EPG) law, and a speed-dependent parameter of 0.11 used for all lines. For the weak CO2 bands, laboratory spectra were best reproduced using spectroscopic parameters from the studies by Devi et al. in 2007 coupled with line mixing coefficients calculated using the EPG law. A total of 132,598 high-resolution ground-based solar absorption spectra were fitted using qSDV + LM to calculate CO2 absorption coefficients and compared to fits that used the Voigt line shape. For the strong CO2 band, the average root mean square (RMS) residual is 0.49 ± 0.22% when using qSDV + LM to calculate the absorption coefficients. This is an improvement over the results with the Voigt line shape, which had an average RMS residual of 0.60 ± 0.21%. When using the qSDV + LM to fit the two weak CO2 bands, the average RMS residual is 0.47 ± 0.19% and 0.51 ± 0.20% for bands 1 and 2, respectively. These values are identical to those obtained with the Voigt line shape. Finally, we find that using the qSDV + LM decreases the airmass dependence of the column averaged dry air mole fraction of CO2 retrieved from the strong and both weak CO2 bands when compared to the retrievals obtained using the Voigt line shape.

Transient Postseismic Relaxation With Burger's Body Viscoelasticity

NASA Astrophysics Data System (ADS)

Hetland, E. A.; Hager, B. H.; O'Connell, R. J.

2002-12-01

Typical models used to investigate postseismic deformation are composed of an elastic layer over a Maxwell viscoelastic region. Geodetic observations made after a number of large earthquakes show a rapid exponential decay in postseismic velocity immediately after the rupture, followed by a more slowly decaying (or constant) velocity at a later time. Models of a Maxwell viscoelastic interior predict a single exponential postseismic velocity relaxation. To account for observed rapid, short-term relaxation decay, surprisingly low viscosities in the lower-crust or upper-mantle have been proposed. To model the difference in short and long time decay rates, the Maxwell element is sometimes modified to have a non-linear rheology, which results in a lower effective viscosity immediately after the rupture, evolving to a higher effective viscosity as the co-seismic stresses relax. Incorporation of models of after-slip in the lower crust on a down-dip extension of the fault have also had some success at modeling the above observations. When real rocks are subjected to a sudden change in stress or strain, e.g., that caused by an earthquake, they exhibit a transient response. The transient deformation is typically accommodated by grain boundary sliding and the longer-time deformation is accommodated by motion of dislocations. Both a short-term transient response and long-term steady creep are exhibited by a Burger's body, a Maxwell element (a spring in series with a viscous dash-pot) in series with a Voigt element (a spring in parallel with a viscous dash-pot). Typically the (transient) viscosity of the Voigt element is 10 - 100 times less than the (steady) viscosity of the Maxwell element. Thus, with a Burger's body, stress relaxation is a superposition of two exponential decays. For a model composed of an elastic layer over a viscoelastic region, the coseismic changes in stress (and strain) depend only on the elastic moduli, and are independent of the description of the viscous component of the rheology. In a Burger's body model of viscoelasticity, if the viscosity of the Voigt element is much less than that of the Maxwell element, the initial relaxation time is given by the decay time τ = η {Voigt}}/G{ {Maxwell}. Whereas, for a Maxwell rheology, the initial relaxation time is given by τ = η {Maxwell}}/G{ {Maxwell}. For both models, the initial spatial distribution of stresses is the same, which results in identical initial spatial distribution of velocities. Thus it is easy to mistake the transient response of a Burger's body for that of a Maxwell rheology with unrealistically low viscosity. Only later in the seismic cycle do the spatial patterns of velocity differ for the two rheologies.

Focal ratio degradation: a new perspective

NASA Astrophysics Data System (ADS)

Haynes, Dionne M.; Withford, Michael J.; Dawes, Judith M.; Haynes, Roger; Bland-Hawthorn, Joss

2008-07-01

We have developed an alternative FRD empirical model for the parallel laser beam technique which can accommodate contributions from both scattering and modal diffusion. It is consistent with scattering inducing a Lorentzian contribution and modal diffusion inducing a Gaussian contribution. The convolution of these two functions produces a Voigt function which is shown to better simulate the observed behavior of the FRD distribution and provides a greatly improved fit over the standard Gaussian fitting approach. The Voigt model can also be used to quantify the amount of energy displaced by FRD, therefore allowing astronomical instrument scientists to identify, quantify and potentially minimize the various sources of FRD, and optimise the fiber and instrument performance.

Improvements of CO2 and O2 Transmission Modeling for ASCENDS Mission Applications

NASA Technical Reports Server (NTRS)

Pliutau, Denis; Prasad, Narashimha S.

2011-01-01

Simulations using the HITRAN database and other data have been carried out to select the optimum laser wavelengths for the measurements of CO2 and O2 concentrations with the application to the ASCENDS mission. The accuracy set forth for the ASCENDS mission requires accurate line-by-line calculations involving the use of non-Voigt line shapes. To aid in achieving this goal, improved CO2 and O2 transmission calculation methods are being developed. In particular, line-by-line transmission modeling of CO2 was improved by implementing non-Voigt spectral lineshapes. Ongoing work involves extending this approach to the O2 molecule 1.26-1.27micron spectral band.

Effect of texture dispersion on the effective biaxial modulus of fiber-textured hexagonal, tetragonal, and orthorhombic films

NASA Astrophysics Data System (ADS)

Wu, Huaping; Wu, Linzhi; Du, Shanyi

2008-04-01

The effective biaxial modulus (Meff) of fiber-textured hexagonal, tetragonal, and orthorhombic films is estimated by using the Voigt-Reuss-Hill and Vook-Witt grain-interaction models. The orientation distribution function with Gaussian distributions of the two Euler angles θ and ϕ is adopted to analyze the effect of texture dispersion degree on Meff. Numerical results that are based on ZnO, BaTiO3, and yttrium barium copper oxide (YBCO) materials show that the Vook-Witt average of Meff is identical to the Voigt-Reuss-Hill average of Meff for the (001) plane of ideally fiber-textured hexagonal and tetragonal films. The ϕ distribution has no influence on Meff of the (hkl)-fiber-textured hexagonal film at any θ distribution in terms of the isotropy in the plane perpendicular to the [001] direction. Comparably, tetragonal and orthorhombic films represent considerable actions of ϕ dispersion on Meff, and the effect of ϕ dispersion on Meff of a (001)-fiber-textured YBCO film is smaller than that for a (001)-fiber-textured BaTiO3 film since the shear anisotropic factor in the (001) shear plane of a YBCO film more closely approaches 1. Enhanced θ and ϕ distributions destroy the perfect fiber textures, and as a result, the films exhibit an evolution from ideal (hkl) fiber textures to random textures with varying full widths at half maximums of θ and ϕ.

DOE Office of Scientific and Technical Information (OSTI.GOV)

Berryman, J. G.

While the well-known Voigt and Reuss (VR) bounds, and the Voigt-Reuss-Hill (VRH) elastic constant estimators for random polycrystals are all straightforwardly calculated once the elastic constants of anisotropic crystals are known, the Hashin-Shtrikman (HS) bounds and related self-consistent (SC) estimators for the same constants are, by comparison, more difficult to compute. Recent work has shown how to simplify (to some extent) these harder to compute HS bounds and SC estimators. An overview and analysis of a subsampling of these results is presented here with the main point being to show whether or not this extra work (i.e., in calculating bothmore » the HS bounds and the SC estimates) does provide added value since, in particular, the VRH estimators often do not fall within the HS bounds, while the SC estimators (for good reasons) have always been found to do so. The quantitative differences between the SC and the VRH estimators in the eight cases considered are often quite small however, being on the order of ±1%. These quantitative results hold true even though these polycrystal Voigt-Reuss-Hill estimators more typically (but not always) fall outside the Hashin-Shtrikman bounds, while the self-consistent estimators always fall inside (or on the boundaries of) these same bounds.« less

Tidal dissipation in a viscoelastic planet

NASA Technical Reports Server (NTRS)

Ross, M.; Schubert, G.

1986-01-01

Tidal dissipation is examined using Maxwell standard liner solid (SLS), and Kelvin-Voigt models, and viscosity parameters are derived from the models that yield the amount of dissipation previously calculated for a moon model with QW = 100 in a hypothetical orbit closer to the earth. The relevance of these models is then assessed for simulating planetary tidal responses. Viscosities of 10 exp 14 and 10 ex 18 Pa s for the Kelvin-Voigt and Maxwell rheologies, respectively, are needed to match the dissipation rate calculated using the Q approach with a quality factor = 100. The SLS model requires a short time viscosity of 3 x 10 exp 17 Pa s to match the Q = 100 dissipation rate independent of the model's relaxation strength. Since Q = 100 is considered a representative value for the interiors of terrestrial planets, it is proposed that derived viscosities should characterize planetary materials. However, it is shown that neither the Kelvin-Voigt nor the SLS models simulate the behavior of real planetary materials on long time scales. The Maxwell model, by contrast, behaves realistically on both long and short time scales. The inferred Maxwell viscosity, corresponding to the time scale of days, is several times smaller than the longer time scale (greater than or equal to 10 exp 14 years) viscosity of the earth's mantle.

nmrfit

DOE Office of Scientific and Technical Information (OSTI.GOV)

2017-09-01

Nmrfit reads the output from a nuclear magnetic resonance (NMR) experiment and, through a number of intuitive API calls, produces a least-squares fit of Voigt-function approximations via particle swarm optimization.

A strategy to complete databases with parameters of refined line shapes and its test for CO in He, Ar and Kr

NASA Astrophysics Data System (ADS)

Ngo, N. H.; Hartmann, J.-M.

2017-12-01

We propose a strategy to generate parameters of the Hartmann-Tran profile (HTp) by simultaneously using first principle calculations and broadening coefficients deduced from Voigt/Lorentz fits of experimental spectra. We start from reference absorptions simulated, at pressures between 10 and 950 Torr, using the HTp with parameters recently obtained from high quality experiments for the P(1) and P(17) lines of the 3-0 band of CO in He, Ar and Kr. Using requantized Classical Molecular Dynamics Simulations (rCMDS), we calculate spectra under the same conditions. We then correct them using a single parameter deduced from Lorentzian fits of both reference and calculated absorptions at a single pressure. The corrected rCMDS spectra are then simultaneously fitted using the HTp, yielding the parameters of this model and associated spectra. Comparisons between the retrieved and input (reference) HTp parameters show a quite satisfactory agreement. Furthermore, differences between the reference spectra and those computed with the HT model fitted to the corrected-rCMDS predictions are much smaller than those obtained with a Voigt line shape. Their full amplitudes are in most cases smaller than 1%, and often below 0.5%, of the peak absorption. This opens the route to completing spectroscopic databases using calculations and the very numerous broadening coefficients available from Voigt fits of laboratory spectra.

Surface response of a fractional order viscoelastic halfspace to surface and subsurface sources

PubMed Central

Meral, F. Can; Royston, Thomas J.; Magin, Richard L.

2009-01-01

Previous studies by the second author published in this journal focused on low audible frequency (40–400 Hz) shear and surface wave motion in and on a viscoelastic material representative of biological tissue. Specific cases considered were that of surface wave motion on a halfspace caused by a finite rigid circular disk located on the surface and oscillating normal to it [Royston et al., J. Acoust. Soc. Am. 106, 3678–3686 (1999)] and compression, shear, and surface wave motion in a halfspace generated by a subsurface finite dipole [Royston et al., J. Acoust. Soc. Am. 113, 1109–1121 (2003)]. In both studies, a Voigt model of viscoelasticity was assumed in the theoretical treatment, which resulted in agreement between theoretical predictions and experimental measurements over a limited frequency range. In the present article, the linear viscoelastic assumption in these two prior works is revisited to consider a (still linear) fractional order Voigt model, where the rate-dependent damping component that is dependent on the first derivative of time is replaced with a component that is dependent on a fractional derivative of time. It is shown that in both excitation source configurations, the fractional order Voigt model assumption improves the match of theory to experiment over a wider frequency range (in some cases up to the measured range of 700 Hz). PMID:20000941

Elastic constants of calcite

USGS Publications Warehouse

Peselnick, L.; Robie, R.A.

1962-01-01

The recent measurements of the elastic constants of calcite by Reddy and Subrahmanyam (1960) disagree with the values obtained independently by Voigt (1910) and Bhimasenachar (1945). The present authors, using an ultrasonic pulse technique at 3 Mc and 25??C, determined the elastic constants of calcite using the exact equations governing the wave velocities in the single crystal. The results are C11=13.7, C33=8.11, C44=3.50, C12=4.82, C13=5.68, and C14=-2.00, in units of 1011 dyncm2. Independent checks of several of the elastic constants were made employing other directions and polarizations of the wave velocities. With the exception of C13, these values substantially agree with the data of Voigt and Bhimasenachar. ?? 1962 The American Institute of Physics.

Measurements of the broadening and shift parameters of the water vapor spectral lines in the 10,100-10,800 cm-1 region induced by pressure of carbon dioxide

NASA Astrophysics Data System (ADS)

Borkov, Yu. G.; Petrova, T. M.; Solodov, A. M.; Solodov, A. A.

2018-02-01

The absorption spectra of a mixture of H2O with CO2 at different partial pressures of CO2 have been recorded at room temperature in the 10,100-10,800 cm-1 region using a Bruker IFS 125 HR FTIR spectrometer. The multispectrum fitting procedure has been applied to these spectra to recover the broadening and shift parameters of the water vapor spectral lines. To obtain the spectral lines parameters two models of the line shape were used: the Voigt profile and the quadratic speed-dependent Voigt profile. The CO2 pressure induced broadening and shift coefficients for 168 spectral lines with rather large values of the signal to noise ratio have been measured.

Random sampling technique for ultra-fast computations of molecular opacities for exoplanet atmospheres

NASA Astrophysics Data System (ADS)

Min, M.

2017-10-01

Context. Opacities of molecules in exoplanet atmospheres rely on increasingly detailed line-lists for these molecules. The line lists available today contain for many species up to several billions of lines. Computation of the spectral line profile created by pressure and temperature broadening, the Voigt profile, of all of these lines is becoming a computational challenge. Aims: We aim to create a method to compute the Voigt profile in a way that automatically focusses the computation time into the strongest lines, while still maintaining the continuum contribution of the high number of weaker lines. Methods: Here, we outline a statistical line sampling technique that samples the Voigt profile quickly and with high accuracy. The number of samples is adjusted to the strength of the line and the local spectral line density. This automatically provides high accuracy line shapes for strong lines or lines that are spectrally isolated. The line sampling technique automatically preserves the integrated line opacity for all lines, thereby also providing the continuum opacity created by the large number of weak lines at very low computational cost. Results: The line sampling technique is tested for accuracy when computing line spectra and correlated-k tables. Extremely fast computations ( 3.5 × 105 lines per second per core on a standard current day desktop computer) with high accuracy (≤1% almost everywhere) are obtained. A detailed recipe on how to perform the computations is given.

Modeling transversely isotropic, viscoelastic, incompressible tissue-like materials with application in ultrasound shear wave elastography

NASA Astrophysics Data System (ADS)

Qiang, Bo; Brigham, John C.; Aristizabal, Sara; Greenleaf, James F.; Zhang, Xiaoming; Urban, Matthew W.

2015-02-01

In this paper, we propose a method to model the shear wave propagation in transversely isotropic, viscoelastic and incompressible media. The targeted application is ultrasound-based shear wave elastography for viscoelasticity measurements in anisotropic tissues such as the kidney and skeletal muscles. The proposed model predicts that if the viscoelastic parameters both across and along fiber directions can be characterized as a Voigt material, then the spatial phase velocity at any angle is also governed by a Voigt material model. Further, with the aid of Taylor expansions, it is shown that the spatial group velocity at any angle is close to a Voigt type for weakly attenuative materials within a certain bandwidth. The model is implemented in a finite element code by a time domain explicit integration scheme and shear wave simulations are conducted. The results of the simulations are analyzed to extract the shear wave elasticity and viscosity for both the spatial phase and group velocities. The estimated values match well with theoretical predictions. The proposed theory is further verified by an ex vivo tissue experiment measured in a porcine skeletal muscle by an ultrasound shear wave elastography method. The applicability of the Taylor expansion to analyze the spatial velocities is also discussed. We demonstrate that the approximations from the Taylor expansions are subject to errors when the viscosities across or along the fiber directions are large or the maximum frequency considered is beyond the bandwidth defined by radii of convergence of the Taylor expansions.

Molecular dynamic simulations of N2-broadened methane line shapes and comparison with experiments

NASA Astrophysics Data System (ADS)

Le, Tuong; Doménech, José-Luis; Lepère, Muriel; Tran, Ha

2017-03-01

Absorption spectra of methane transitions broadened by nitrogen have been calculated for the first time using classical molecular dynamic simulations. For that, the time evolution of the auto-correlation function of the dipole moment vector, assumed along a C-H axis, was computed using an accurate site-site intermolecular potential for CH4-N2. Quaternion coordinates were used to treat the rotation of the molecules. A requantization procedure was applied to the classical rotation and spectra were then derived as the Fourier-Laplace transform of the auto-correlation function. These computed spectra were compared with experimental ones recorded with a tunable diode laser and a difference-frequency laser spectrometer. Specifically, nine isolated methane lines broadened by nitrogen, belonging to various vibrational bands and having rotational quantum numbers J from 0 to 9, were measured at room temperature and at several pressures from 20 to 945 mbar. Comparisons between measured and calculated spectra were made through their fits using the Voigt profile. The results show that ab initio calculated spectra reproduce with very high fidelity non-Voigt effects on the measurements and that classical molecular dynamic simulations can be used to predict spectral shapes of isolated lines of methane perturbed by nitrogen.

Impact of the rail-pad multi-discrete model upon the prediction of the rail response

NASA Astrophysics Data System (ADS)

Mazilu, T.; Leu, M.

2017-08-01

Wheel/rail vibration has many technical effects such as wear of the rolling surfaces, rolling noise, settlement of the ballast and subgrade etc. This vibration is depending on the rail pad characteristic and subsequently, it is important to have an accurate overview on the relation between the rail pad characteristic and the level of the wheel/rail vibration. To this end, much theoretical and experimental research has been developed in the past, and for the theoretical approach the track model, in general, and, particularly, the rail pad model is of crucial importance. Usually, the rail pad model is discrete model one, neglecting the length of the rail pad. This fact is questionable because the sleepers span is only 4 times the rail pad length. Using the rail pad discrete model, the rail response is overestimated when the frequency of the excitation equals the pinned-pinned resonance frequency. In this paper, a multi-discrete model for the rail pad, consisting in many Kelvin-Voigt parallel systems, is inserted into an analytical model of the track. The track model is reduced to a rail taken as infinite Timoshenko beam, discretely supported via rail pad, sleeper and ballast. The influence of the number of Kelvin-Voigt systems of the rail pad model on the rail response is analysed.

Recommended Isolated-Line Profile for Representing High-Resolution Spectroscoscopic Transitions

NASA Astrophysics Data System (ADS)

Tennyson, J.; Bernath, P. F.; Campargue, A.; Császár, A. G.; Daumont, L.; Gamache, R. R.; Hodges, J. T.; Lisak, D.; Naumenko, O. V.; Rothman, L. S.; Tran, H.; Hartmann, J.-M.; Zobov, N. F.; Buldyreva, J.; Boone, C. D.; De Vizia, M. Domenica; Gianfrani, L.; McPheat, R.; Weidmann, D.; Murray, J.; Ngo, N. H.; Polyansky, O. L.

2014-06-01

Recommendations of an IUPAC Task Group, formed in 2011 on "Intensities and line shapes in high-resolution spectra of water isotopologues from experiment and theory" (Project No. 2011-022-2-100), on line profiles of isolated high-resolution rotational-vibrational transitions perturbed by neutral gas-phase molecules are presented. The well-documented inadequacies of the Voigt profile, used almost universally by databases and radiative-transfer codes to represent pressure effects and Doppler broadening in isolated vibrational-rotational and pure rotational transitions of the water molecule, have resulted in the development of a variety of alternative line profile models. These models capture more of the physics of the influence of pressure on line shapes but, in general, at the price of greater complexity. The Task Group recommends that the partially-Correlated quadratic-Speed-Dependent Hard-Collision profile should be adopted as the appropriate model for high-resolution spectroscopy. For simplicity this should be called the Hartmann-Tran profile (HTP). This profile is sophisticated enough to capture the various collisional contributions to the isolated line shape, can be computed in a straightforward and rapid manner, and reduces to simpler profiles, including the Voigt profile, under certain simplifying assumptions. For further details see: J. Tennyson et al, Pure Appl. Chem., 2014, in press.

Kelvin-Voigt model of wave propagation in fragmented geomaterials with impact damping

NASA Astrophysics Data System (ADS)

Khudyakov, Maxim; Pasternak, Elena; Dyskin, Arcady

2017-04-01

When a wave propagates through real materials, energy dissipation occurs. The effect of loss of energy in homogeneous materials can be accounted for by using simple viscous models. However, a reliable model representing the effect in fragmented geomaterials has not been established yet. The main reason for that is a mechanism how vibrations are transmitted between the elements (fragments) in these materials. It is hypothesised that the fragments strike against each other, in the process of oscillation, and the impacts lead to the energy loss. We assume that the energy loss is well represented by the restitution coefficient. The principal element of this concept is the interaction of two adjacent blocks. We model it by a simple linear oscillator (a mass on an elastic spring) with an additional condition: each time the system travels through the neutral point, where the displacement is equal to zero, the velocity reduces by multiplying itself by the restitution coefficient, which characterises an impact of the fragments. This additional condition renders the system non-linear. We show that the behaviour of such a model averaged over times much larger than the system period can approximately be represented by a conventional linear oscillator with linear damping characterised by a damping coefficient expressible through the restitution coefficient. Based on this the wave propagation at times considerably greater than the resonance period of oscillations of the neighbouring blocks can be modelled using the Kelvin-Voigt model. The wave velocities and the dispersion relations are obtained.

Broadband, high-resolution investigation of advanced absorption line shapes at high temperature

NASA Astrophysics Data System (ADS)

Schroeder, Paul J.; Cich, Matthew J.; Yang, Jinyu; Swann, William C.; Coddington, Ian; Newbury, Nathan R.; Drouin, Brian J.; Rieker, Gregory B.

2017-08-01

Spectroscopic studies of planetary atmospheres and high-temperature processes (e.g., combustion) require absorption line-shape models that are accurate over extended temperature ranges. To date, advanced line shapes, like the speed-dependent Voigt and Rautian profiles, have not been tested above room temperature with broadband spectrometers. We investigate pure water vapor spectra from 296 to 1305 K acquired with a dual-frequency comb spectrometer spanning from 6800 to 7200 c m-1 at a point spacing of 0.0033 c m-1 and absolute frequency accuracy of <3.3 ×10-6c m-1 . Using a multispectral fitting analysis, we show that only the speed-dependent Voigt accurately models this temperature range with a single power-law temperature-scaling exponent for the broadening coefficients. Only the data from the analysis using this profile fall within theoretical predictions, suggesting that this mechanism captures the dominant narrowing physics for these high-temperature conditions.

Vibration suppression with approximate finite dimensional compensators for distributed systems: Computational methods and experimental results

NASA Technical Reports Server (NTRS)

Banks, H. T.; Smith, Ralph C.; Wang, Yun

1994-01-01

Based on a distributed parameter model for vibrations, an approximate finite dimensional dynamic compensator is designed to suppress vibrations (multiple modes with a broad band of frequencies) of a circular plate with Kelvin-Voigt damping and clamped boundary conditions. The control is realized via piezoceramic patches bonded to the plate and is calculated from information available from several pointwise observed state variables. Examples from computational studies as well as use in laboratory experiments are presented to demonstrate the effectiveness of this design.

Effect of damping on excitability of high-order normal modes. [for a large space telescope spacecraft

NASA Technical Reports Server (NTRS)

Merchant, D. H.; Gates, R. M.; Straayer, J. W.

1975-01-01

The effect of localized structural damping on the excitability of higher-order large space telescope spacecraft modes is investigated. A preprocessor computer program is developed to incorporate Voigt structural joint damping models in a finite-element dynamic model. A postprocessor computer program is developed to select critical modes for low-frequency attitude control problems and for higher-frequency fine-stabilization problems. The selection is accomplished by ranking the flexible modes based on coefficients for rate gyro, position gyro, and optical sensor, and on image-plane motions due to sinusoidal or random PSD force and torque inputs.

Coccinia grandis (L.) Voigt Leaf Extract Exhibits Antileishmanial Effect Through Pro-inflammatory Response: An In Vitro Study.

PubMed

Pramanik, Asmita; Paik, Dibyendu; Naskar, Kshudiram; Chakraborti, Tapati

2017-01-01

The conventional drugs used for the treatment of human visceral leishmaniasis have concerns about the toxicity and most importantly parasite resistance. To overcome these troubles, more efforts are made for the development of innovative therapeutic agents having effective antileishmanial activity and simultaneously stimulate adaptive immune system of host cells. Hence, search for new leishmanicidal from the natural origin like plants has shown its effectiveness for the treatment of this tropical disease. The aim of this study is to investigate and characterize the antileishmanial efficacy of Coccinia grandis (L.) Voigt leaf extract (Cg-Ex) with its immunomodulatory property against Leishmania donovani in an in vitro experimental model. Cg-Ex significantly reduces the intracellular L. donovani parasite load with IC 50  value 193 ± 0.78 µg/ml, but it has lower cytotoxicity on the murine RAW 264.7 macrophage cell line. Interestingly, Cg-Ex induces the generation of potent antimicrobials like reactive oxygen species and nitric oxide dose dependently in infected murine macrophages. Moreover, the increased production of Th1 cytokines (IL-12, TNF-α) with a concurrent decrease of Th2 cytokines (IL-10, TGF-β) was also observed in Cg-Ex-treated infected host macrophages. Our results thus confirm that serine protease inhibitor(s)-rich Cg-Ex exhibits antileishmanial activity in vitro, and this was mediated through the modulation of pro-inflammatory cytokines. On the whole, the present findings first demonstrate the antileishmanial property of Cg-Ex targeting the Leishmania serine protease resulting protection of host cells with Th1 cytokine expression. Thus, these data indicate that C. grandis leaf extract (Cg-Ex) might be considered as a new lead for designing alternative and novel natural therapeutic against visceral leishmaniasis.

Homogeneous and inhomogeneous broadenings and the Voigt line shapes in the phase-resolved and intensity sum-frequency generation vibrational spectroscopy.

PubMed

Chen, Shun-Li; Fu, Li; Gan, Wei; Wang, Hong-Fei

2016-01-21

In this report, we show that the ability to measure the sub-1 cm(-1) resolution phase-resolved and intensity high-resolution broadband sum frequency generation vibrational spectra of the -CN stretch vibration of the Langmuir-Blodgett (LB) monolayer of the 4-n-octyl-4'-cyanobiphenyl (8CB) on the z-cut α-quartz surface allows the direct comparison and understanding of the homogeneous and inhomogeneous broadenings in the imaginary and intensity SFG vibrational spectral line shapes in detail. The difference of the full width at half maximum (FWHM) of the imaginary and intensity sum-frequency generation vibrational spectroscopy spectra of the same vibrational mode is the signature of the Voigt line shape and it measures the relative contribution to the overall line shape from the homogeneous and inhomogeneous broadenings in SFG vibrational spectra. From the phase-resolved and intensity spectra, we found that the FWHM of the 2238.00 ± 0.02 cm(-1) peak in the phase-resolved imaginary and intensity spectra is 19.2 ± 0.2 cm(-1) and 21.6 ± 0.4 cm(-1), respectively, for the -CN group of the 8CB LB monolayer on the z-cut α-quartz crystal surface. The FWHM width difference of 2.4 cm(-1) agrees quantitatively with a Voigt line shape with a homogeneous broadening half width of Γ = 5.29 ± 0.08 cm(-1) and an inhomogeneous standard derivation width Δω = 5.42 ± 0.07 cm(-1). These results shed new lights on the understanding and interpretation of the line shapes of both the phase-resolved and the intensity SFG vibrational spectra, as well as other incoherent and coherent spectroscopic techniques in general.

Study on Stress Development in the Phase Transition Layer of Thermal Barrier Coatings

PubMed Central

Chai, Yijun; Lin, Chen; Wang, Xian; Li, Yueming

2016-01-01

Stress development is one of the significant factors leading to the failure of thermal barrier coating (TBC) systems. In this work, stress development in the two phase mixed zone named phase transition layer (PTL), which grows between the thermally grown oxide (TGO) and the bond coat (BC), is investigated by using two different homogenization models. A constitutive equation of the PTL based on the Reuss model is proposed to study the stresses in the PTL. The stresses computed with the proposed constitutive equation are compared with those obtained with Voigt model-based equation in detail. The stresses based on the Voigt model are slightly higher than those based on the Reuss model. Finally, a further study is carried out to explore the influence of phase transition proportions on the stress difference caused by homogenization models. Results show that the stress difference becomes more evident with the increase of the PTL thickness ratio in the TGO. PMID:28773894

LQR Control of Shell Vibrations Via Piezoceramic Actuators

NASA Technical Reports Server (NTRS)

delRosario, R. C. H.; Smith, R. C.

1997-01-01

A model-based Linear Quadratic Regulator (LQR) method for controlling vibrations in cylindrical shells is presented. Surface-mounted piezo-ceramic patches are employed as actuators which leads to unbounded control input operators. Modified Donnell-Mushtari shell equations incorporating strong or Kelvin-Voigt damping are used to model the system. The model is then abstractly formulated in terms of sesquilinear forms. This provides a framework amenable for proving model well-posedness and convergence of LQR gains using analytic semigroup results combined with LQR theory for unbounded input operators. Finally, numerical examples demonstrating the effectiveness of the method are presented.

The properties of the extraordinary mode and surface plasmon modes in the three-dimensional magnetized plasma photonic crystals based on the magneto-optical Voigt effects

DOE Office of Scientific and Technical Information (OSTI.GOV)

Zhang, Hai-Feng, E-mail: hanlor@163.com, E-mail: lsb@nuaa.edu.cn; Nanjing Artillery Academy, Nanjing 211132; Liu, Shao-Bin, E-mail: hanlor@163.com, E-mail: lsb@nuaa.edu.cn

2014-06-15

In this paper, the properties of the extraordinary mode and surface plasmon modes in the three-dimensional (3D) magnetized plasma photonic crystals (MPPCs) with face-centered-cubic lattices that are composed of the core tellurium (Te) spheres with surrounded by the homogeneous magnetized plasma shells inserted in the air, are theoretically investigated in detail by the plane wave expansion method, as the magneto-optical Voigt effects of magnetized plasma are considered (the incidence electromagnetic wave vector is perpendicular to the external magnetic field at any time). The optical switching or wavelength division multiplexer can be realized by the proposed 3D MPPCs. Our analyses demonstratemore » that the complete photonic band gaps (PBGs) and two flatbands regions for the extraordinary mode can be observed obviously. PBGs can be tuned by the radius of core Te sphere, the plasma density and the external magnetic field. The flatbands regions are determined by the existence of surface plasmon modes. Numerical simulations also show that if the thickness of magnetized plasma shell is larger than a threshold value, the band structures of the extraordinary mode will be similar to those obtained from the same structure containing the pure magnetized plasma spheres. In this case, the band structures also will not be affected by the inserted core spheres. It is also provided that the upper edges of two flatbands regions will not depend on the topology of lattice. However, the frequencies of lower edges of two flatbands regions will be convergent to the different constants for different lattices, as the thickness of magnetized plasma shell is close to zero.« less

Gravitational red shift tests and a spectroscopy in Japan

NASA Astrophysics Data System (ADS)

Yokoo, Hiromitsu

Japanese astronomers and physicians tried to test the Einstein theory by gravitational red shift tests at 1920's. Spectroscopists in Japan contributed to Stark broadening of spectrum lines. Rikiti Kinoshita (1877 - 1935) probably started experiments according to Voigt's prediction earlier than Stark. Tokyo Astronomical Observatory constructed and used another Einstein Tower in Mitaka.

Application of Kevin-Voigt Model in Quantifying Whey Protein Adsorption on Polyethersulfone Using QCM-D

USDA-ARS?s Scientific Manuscript database

The study of protein adsorption on the membrane surface is of great importance to cheese-making processors that use polymeric membrane-based processes to recover whey protein from the process waste streams. Quartz crystal microbalance with dissipation (QCM-D) is a lab-scale, fast analytical techniq...

After the Storm: Ojibwe Treaty Rights Twenty-Five Years after the "Voigt" Decision

ERIC Educational Resources Information Center

Loew, Patty; Thannum, James

2011-01-01

Twenty-five years ago a "perfect storm" of economic, environmental, and social conditions swirled in northern Wisconsin and battered attempts by the Ojibwe to exercise their treaty-based fishing rights. This article examines the socioeconomic, political, and cultural factors that contributed to the spearfishing crisis twenty-five years…

Wave propagation in fluid-conveying viscoelastic single-walled carbon nanotubes with surface and nonlocal effects

NASA Astrophysics Data System (ADS)

Zhen, Ya-Xin

2017-02-01

In this paper, the transverse wave propagation in fluid-conveying viscoelastic single-walled carbon nanotubes is investigated based on nonlocal elasticity theory with consideration of surface effect. The governing equation is formulated utilizing nonlocal Euler-Bernoulli beam theory and Kelvin-Voigt model. Explicit wave dispersion relation is developed and wave phase velocities and frequencies are obtained. The effect of the fluid flow velocity, structural damping, surface effect, small scale effects and tube diameter on the wave propagation properties are discussed with different wave numbers. The wave frequency increases with the increase of fluid flow velocity, but decreases with the increases of tube diameter and wave number. The effect of surface elasticity and residual surface tension is more significant for small wave number and tube diameter. For larger values of wave number and nonlocal parameters, the real part of frequency ratio raises.

Theory of electromagnetic wave propagation in ferromagnetic Rashba conductor

NASA Astrophysics Data System (ADS)

Shibata, Junya; Takeuchi, Akihito; Kohno, Hiroshi; Tatara, Gen

2018-02-01

We present a comprehensive study of various electromagnetic wave propagation phenomena in a ferromagnetic bulk Rashba conductor from the perspective of quantum mechanical transport. In this system, both the space inversion and time reversal symmetries are broken, as characterized by the Rashba field α and magnetization M, respectively. First, we present a general phenomenological analysis of electromagnetic wave propagation in media with broken space inversion and time reversal symmetries based on the dielectric tensor. The dependence of the dielectric tensor on the wave vector q and M is retained to first order. Then, we calculate the microscopic electromagnetic response of the current and spin of conduction electrons subjected to α and M, based on linear response theory and the Green's function method; the results are used to study the system optical properties. First, it is found that a large α enhances the anisotropic properties of the system and enlarges the frequency range in which the electromagnetic waves have hyperbolic dispersion surfaces and exhibit unusual propagations known as negative refraction and backward waves. Second, we consider the electromagnetic cross-correlation effects (direct and inverse Edelstein effects) on the wave propagation. These effects stem from the lack of space inversion symmetry and yield q-linear off-diagonal components in the dielectric tensor. This induces a Rashba-induced birefringence, in which the polarization vector rotates around the vector (α ×q ) . In the presence of M, which breaks time reversal symmetry, there arises an anomalous Hall effect and the dielectric tensor acquires off-diagonal components linear in M. For α ∥M , these components yield the Faraday effect for the Faraday configuration q ∥M and the Cotton-Mouton effect for the Voigt configuration ( q ⊥M ). When α and M are noncollinear, M- and q-induced optical phenomena are possible, which include nonreciprocal directional dichroism in the Voigt configuration. In these nonreciprocal optical phenomena, a "toroidal moment," α ×M , and a "quadrupole moment," αiMj+Miαj , play central roles. These phenomena are strongly enhanced at the spin-split transition edge in the electron band.

Advanced magneto-optical microscopy: Imaging from picoseconds to centimeters - imaging spin waves and temperature distributions (invited)

DOE Office of Scientific and Technical Information (OSTI.GOV)

Urs, Necdet Onur; Mozooni, Babak; Kustov, Mikhail

2016-05-15

Recent developments in the observation of magnetic domains and domain walls by wide-field optical microscopy based on the magneto-optical Kerr, Faraday, Voigt, and Gradient effect are reviewed. Emphasis is given to the existence of higher order magneto-optical effects for advanced magnetic imaging. Fundamental concepts and advances in methodology are discussed that allow for imaging of magnetic domains on various length and time scales. Time-resolved imaging of electric field induced domain wall rotation is shown. Visualization of magnetization dynamics down to picosecond temporal resolution for the imaging of spin-waves and magneto-optical multi-effect domain imaging techniques for obtaining vectorial information are demonstrated.more » Beyond conventional domain imaging, the use of a magneto-optical indicator technique for local temperature sensing is shown.« less

Communication: Nuclear quadrupole moment-induced Cotton-Mouton effect in noble gas atoms

NASA Astrophysics Data System (ADS)

Fu, Li-juan; Rizzo, Antonio; Vaara, Juha

2013-11-01

New, high-sensitivity and high-resolution spectroscopic and imaging methods may be developed by exploiting nuclear magneto-optic effects. A first-principles electronic structure formulation of nuclear electric quadrupole moment-induced Cotton-Mouton effect (NQCME) is presented for closed-shell atoms. In NQCME, aligned quadrupole moments alter the index of refraction of the medium along with and perpendicular to the direction of nuclear alignment. The roles of basis-set convergence, electron correlation, and relativistic effects are investigated for three quadrupolar noble gas isotopes: 21Ne, 83Kr, and 131Xe. The magnitude of the resulting ellipticities is predicted to be 10-4-10-6 rad/(M cm) for fully spin-polarized nuclei. These should be detectable in the Voigt setup. Particularly interesting is the case of 131Xe, in which a high degree of spin polarization can be achieved via spin-exchange optical hyperpolarization.

Correlations in the three-dimensional Lyman-alpha forest contaminated by high column density absorbers

NASA Astrophysics Data System (ADS)

Rogers, Keir K.; Bird, Simeon; Peiris, Hiranya V.; Pontzen, Andrew; Font-Ribera, Andreu; Leistedt, Boris

2018-05-01

Correlations measured in three dimensions in the Lyman-alpha forest are contaminated by the presence of the damping wings of high column density (HCD) absorbing systems of neutral hydrogen (H I; having column densities N(H I) > 1.6 × 10^{17} atoms cm^{-2}), which extend significantly beyond the redshift-space location of the absorber. We measure this effect as a function of the column density of the HCD absorbers and redshift by measuring three-dimensional (3D) flux power spectra in cosmological hydrodynamical simulations from the Illustris project. Survey pipelines exclude regions containing the largest damping wings. We find that, even after this procedure, there is a scale-dependent correction to the 3D Lyman-alpha forest flux power spectrum from residual contamination. We model this residual using a simple physical model of the HCD absorbers as linearly biased tracers of the matter density distribution, convolved with their Voigt profiles and integrated over the column density distribution function. We recommend the use of this model over existing models used in data analysis, which approximate the damping wings as top-hats and so miss shape information in the extended wings. The simple `linear Voigt model' is statistically consistent with our simulation results for a mock residual contamination up to small scales (|k| < 1 h Mpc^{-1}). It does not account for the effect of the highest column density absorbers on the smallest scales (e.g. |k| > 0.4 h Mpc^{-1} for small damped Lyman-alpha absorbers; HCD absorbers with N(H I) ˜ 10^{21} atoms cm^{-2}). However, these systems are in any case preferentially removed from survey data. Our model is appropriate for an accurate analysis of the baryon acoustic oscillations feature. It is additionally essential for reconstructing the full shape of the 3D flux power spectrum.

Donor Magneto-Spectroscopy and Magnetic Field - Metal-Insulator Transition in MERCURY(1-X) Cadmium(x)tellurium and Indium Antimonide

NASA Astrophysics Data System (ADS)

Choi, Jung Bum

Far infrared (FIR) magneto-transmission studies of n-type Hg_{1-x}Cd _{x}Te (x = 0.198, 0.204, 0.224, 0.237, 0.270) for temperatures down to 1.5K and magnetic fields up to 9T in Voigt and Faraday geometries have been performed. Magneto-optical transitions of donor bound electrons are observed; including the (000) --> (001) and (010) --> (01k_{z}) in the Voigt geometry, and the (000) --> (110) in the Faraday geometry. These identifications are confirmed by their resonance positions, selection rules, and temperature dependence. The experimental observations are consistent with calculations of resonance positions and lineshapes based on the hydrogenic donor model including central cell effects. This work confirms the donor bound electronic ground state for Hg_{1-x}Cd_{x} Te. The magneto-transport and FIR spectroscopy have been combined to probe the nature of the impurity band in the vicinity of the magnetic field induced metal-insulator transition. The results obtained in Hg_ {1-x}Cd_{x}Te and InSb show the persistance of the (000) --> (110) impurity transition through the metal-insulator critical field. This observation demonstrates the existence of the metallic impurity band which is split off from the conduction band. In the studies of the critical behavior of InSb, the conductivity measured for temperatures down to 0.45K shows a dominant linear dependence on temperature near the transition field. Furthermore, the zero-temperature extrapolated conductivity was found to drop continuously to zero at the transition field with a critical exponent of nu = 1.07 +/- 0.07.

Effect of Longitudinal Magnetic Field on Vibration Characteristics of Single-Walled Carbon Nanotubes in a Viscoelastic Medium

NASA Astrophysics Data System (ADS)

Zhang, D. P.; Lei, Y.; Shen, Z. B.

2017-12-01

The effect of longitudinal magnetic field on vibration response of a sing-walled carbon nanotube (SWCNT) embedded in viscoelastic medium is investigated. Based on nonlocal Euler-Bernoulli beam theory, Maxwell's relations, and Kelvin viscoelastic foundation model, the governing equations of motion for vibration analysis are established. The complex natural frequencies and corresponding mode shapes in closed form for the embedded SWCNT with arbitrary boundary conditions are obtained using transfer function method (TFM). The new analytical expressions for the complex natural frequencies are also derived for certain typical boundary conditions and Kelvin-Voigt model. Numerical results from the model are presented to show the effects of nonlocal parameter, viscoelastic parameter, boundary conditions, aspect ratio, and strength of the magnetic field on vibration characteristics for the embedded SWCNT in longitudinal magnetic field. The results demonstrate the efficiency of the proposed methods for vibration analysis of embedded SWCNTs under magnetic field.

Thermal effect on the dynamic response of axially functionally graded beam subjected to a moving harmonic load

NASA Astrophysics Data System (ADS)

Wang, Yuewu; Wu, Dafang

2016-10-01

Dynamic response of an axially functionally graded (AFG) beam under thermal environment subjected to a moving harmonic load is investigated within the frameworks of classical beam theory (CBT) and Timoshenko beam theory (TBT). The Lagrange method is employed to derive the equations of thermal buckling for AFG beam, and then with the critical buckling temperature as a parameter the Newmark-β method is adopted to evaluate the dynamic response of AFG beam under thermal environments. Admissible functions denoting transverse displacement are expressed in simple algebraic polynomial forms. Temperature-dependency of material constituent is considered. The rule of mixture (Voigt model) and Mori-Tanaka (MT) scheme are used to evaluate the beam's effective material properties. A ceramic-metal AFG beam with immovable boundary condition is considered as numerical illustration to show the thermal effects on the dynamic behaviors of the beam subjected to a moving harmonic load.

Velocity selection in a Doppler-broadened ensemble of atoms interacting with a monochromatic laser beam

NASA Astrophysics Data System (ADS)

Hughes, Ifan G.

2018-03-01

There is extensive use of monochromatic lasers to select atoms with a narrow range of velocities in many atomic physics experiments. For the commonplace situation of the inhomogeneous Doppler-broadened (Gaussian) linewidth exceeding the homogeneous (Lorentzian) natural linewidth by typically two orders of magnitude, a substantial narrowing of the velocity class of atoms interacting with the light can be achieved. However, this is not always the case, and here we show that for a certain parameter regime there is essentially no selection - all of the atoms interact with the light in accordance with the velocity probability density. An explanation of this effect is provided, emphasizing the importance of the long tail of the constituent Lorentzian distribution in a Voigt profile.

The adhesion and hysteresis effect in friction skin with artificial materials

NASA Astrophysics Data System (ADS)

Subhi, K. A.; Tudor, A.; Hussein, E. K.; Wahad, H. S.

2017-02-01

Human skin is a soft biomaterial with a complex anatomical structure and it has a complex material behavior during the mechanical contact with objects and surfaces. The friction adhesion component is defined by means of the theories of Johnson-Kendall-Roberts (JKR), Derjaguin-Muller-Toporov (DMT) and Maugis - Dugdale (MD). We shall consider the human skin entering into contact with a rigid surface. The deformation (hysteresis) component of the skin friction is evaluated with Voigt rheological model for the spherical contact, with the original model, developed in MATHCAD software. The adhesive component of the skin friction is greater than the hysteresis component for all friction parameters (load, velocity, the strength of interface between skin and the artificial material).

How Reader Girl Got Her Groove Back: One Woman's Heroic Quest to Overcome the Classics

ERIC Educational Resources Information Center

Hale, Shannon

2008-01-01

This author has been a "reader girl" since the third grade, when she first read "Trumpet of the Swan" on her own. Fourth grade brought C. S. Lewis, Lloyd Alexander, and Joan Aiken. Fifth grade was Cynthia Voigt, Anne McCaffrey, and Robin McKinley. And so it continued with Ellen Raskin, Patricia McKillip, and L. M. Montgomery, a veritable battalion…

Determination of the vinyl fluoride line intensities by TDL spectroscopy: the object oriented approach of Visual Line Shape Fitting Program to line profile analysis

NASA Astrophysics Data System (ADS)

Tasinato, Nicola; Pietropolli Charmet, Andrea; Stoppa, Paolo; Giorgianni, Santi

2010-03-01

In this work the self-broadening coefficients and the integrated line intensities for a number of ro-vibrational transitions of vinyl fluoride have been determined for the first time by means of TDL spectroscopy. The spectra recorded in the atmospheric window around 8.7 µm appear very crowded with a density of about 90 lines per cm-1. In order to fit these spectral features a new fitting software has been implemented. The program, which is designed for laser spectroscopy, can fit many lines simultaneously on the basis of different theoretical profiles (Doppler, Lorentz, Voigt, Galatry and Nelkin-Ghatak). Details of the object oriented implementation of the application are given. The reliability of the program is demonstrated by determining the line parameters of some ro-vibrational lines of sulphur dioxide in the ν1 band region around 9 µm. Then the software is used for the line profile analysis of vinyl fluoride. The experimental line shapes show deviations from the Voigt profile, which can be well modelled by using a Dicke narrowed line shape function. This leads to the determination of the self-narrowing coefficient within the framework of the strong collision model.

First-principles calculations of the electronic, vibrational, and elastic properties of the magnetic laminate Mn₂GaC

DOE Office of Scientific and Technical Information (OSTI.GOV)

Thore, A., E-mail: andth@ifm.liu.se; Dahlqvist, M., E-mail: madah@ifm.liu.se, E-mail: bjoal@ifm.liu.se, E-mail: johro@ifm.liu.se; Alling, B., E-mail: madah@ifm.liu.se, E-mail: bjoal@ifm.liu.se, E-mail: johro@ifm.liu.se

2014-09-14

In this paper, we report the by first-principles predicted properties of the recently discovered magnetic MAX phase Mn₂GaC. The electronic band structure and vibrational dispersion relation, as well as the electronic and vibrational density of states, have been calculated. The band structure close to the Fermi level indicates anisotropy with respect to electrical conductivity, while the distribution of the electronic and vibrational states for both Mn and Ga depend on the chosen relative orientation of the Mn spins across the Ga sheets in the Mn–Ga–Mn trilayers. In addition, the elastic properties have been calculated, and from the five elastic constants,more » the Voigt bulk modulus is determined to be 157 GPa, the Voigt shear modulus 93 GPa, and the Young's modulus 233 GPa. Furthermore, Mn₂GaC is found relatively elastically isotropic, with a compression anisotropy factor of 0.97, and shear anisotropy factors of 0.9 and 1, respectively. The Poisson's ratio is 0.25. Evaluated elastic properties are compared to theoretical and experimental results for M₂AC phases where M = Ti, V, Cr, Zr, Nb, Ta, and A = Al, S, Ge, In, Sn.« less

Optical frequency comb Fourier transform spectroscopy with sub-nominal resolution and precision beyond the Voigt profile

NASA Astrophysics Data System (ADS)

Rutkowski, Lucile; Masłowski, Piotr; Johansson, Alexandra C.; Khodabakhsh, Amir; Foltynowicz, Aleksandra

2018-01-01

Broadband precision spectroscopy is indispensable for providing high fidelity molecular parameters for spectroscopic databases. We have recently shown that mechanical Fourier transform spectrometers based on optical frequency combs can measure broadband high-resolution molecular spectra undistorted by the instrumental line shape (ILS) and with a highly precise frequency scale provided by the comb. The accurate measurement of the power of the comb modes interacting with the molecular sample was achieved by acquiring single-burst interferograms with nominal resolution matched to the comb mode spacing. Here we describe in detail the experimental and numerical steps needed to achieve sub-nominal resolution and retrieve ILS-free molecular spectra, i.e. with ILS-induced distortion below the noise level. We investigate the accuracy of the transition line centers retrieved by fitting to the absorption lines measured using this method. We verify the performance by measuring an ILS-free cavity-enhanced low-pressure spectrum of the 3ν1 + ν3 band of CO2 around 1575 nm with line widths narrower than the nominal resolution. We observe and quantify collisional narrowing of absorption line shape, for the first time with a comb-based spectroscopic technique. Thus retrieval of line shape parameters with accuracy not limited by the Voigt profile is now possible for entire absorption bands acquired simultaneously.

Communication: Nuclear quadrupole moment-induced Cotton-Mouton effect in noble gas atoms

DOE Office of Scientific and Technical Information (OSTI.GOV)

Fu, Li-juan; Vaara, Juha, E-mail: juha.vaara@iki.fi; Rizzo, Antonio

New, high-sensitivity and high-resolution spectroscopic and imaging methods may be developed by exploiting nuclear magneto-optic effects. A first-principles electronic structure formulation of nuclear electric quadrupole moment-induced Cotton-Mouton effect (NQCME) is presented for closed-shell atoms. In NQCME, aligned quadrupole moments alter the index of refraction of the medium along with and perpendicular to the direction of nuclear alignment. The roles of basis-set convergence, electron correlation, and relativistic effects are investigated for three quadrupolar noble gas isotopes: {sup 21}Ne, {sup 83}Kr, and {sup 131}Xe. The magnitude of the resulting ellipticities is predicted to be 10{sup −4}–10{sup −6} rad/(M cm) for fully spin-polarized nuclei.more » These should be detectable in the Voigt setup. Particularly interesting is the case of {sup 131}Xe, in which a high degree of spin polarization can be achieved via spin-exchange optical hyperpolarization.« less

Effect of vibration frequency on biopsy needle insertion force.

PubMed

Tan, Lei; Qin, Xuemei; Zhang, Qinhe; Zhang, Hongcai; Dong, Hongjian; Guo, Tuodang; Liu, Guowei

2017-05-01

Needle insertion is critical in many clinical medicine procedures, such as biopsy, brachytherapy, and injection therapy. A platform with two degrees of freedom was set up to study the effect of vibration frequency on needle insertion force. The gel phantom deformation at the needle cutting edge and the Voigt model are utilized to develop a dynamic model to explain the relationship between the insertion force and needle-tip velocity. The accuracy of this model was verified by performing needle insertions into phantom gel. The effect of vibration on insertion force can be explained as the vibration increasing the needle-tip velocity and subsequently increasing the insertion force. In a series of needle insertion experiments with different vibration frequencies, the peak forces were selected for comparison to explore the effect of vibration frequency on needle insertion force. The experimental results indicate that the insertion force at 500Hz increases up to 17.9% compared with the force at 50Hz. Copyright © 2017 IPEM. Published by Elsevier Ltd. All rights reserved.

Patterns in Calabi-Yau Distributions

NASA Astrophysics Data System (ADS)

He, Yang-Hui; Jejjala, Vishnu; Pontiggia, Luca

2017-09-01

We explore the distribution of topological numbers in Calabi-Yau manifolds, using the Kreuzer-Skarke dataset of hypersurfaces in toric varieties as a testing ground. While the Hodge numbers are well-known to exhibit mirror symmetry, patterns in frequencies of combination thereof exhibit striking new patterns. We find pseudo-Voigt and Planckian distributions with high confidence and exact fit for many substructures. The patterns indicate typicality within the landscape of Calabi-Yau manifolds of various dimension.

Modelling water hammer in viscoelastic pipelines: short brief

NASA Astrophysics Data System (ADS)

Urbanowicz, K.; Firkowski, M.; Zarzycki, Z.

2016-10-01

The model of water hammer in viscoelastic pipelines is analyzed. An appropriate mathematical model of water hammer in polymer pipelines is presented. An additional term has been added to continuity equation to describe the retarded deformation of the pipe wall. The mechanical behavior of viscoelastic material is described by generalized Kelvin-Voigt model. The comparison of numerical simulation and experimental data from well known papers is presented. Short discussion about obtained results are given.

Predicting the Coupling Properties of Axially-Textured Materials.

PubMed

Fuentes-Cobas, Luis E; Muñoz-Romero, Alejandro; Montero-Cabrera, María E; Fuentes-Montero, Luis; Fuentes-Montero, María E

2013-10-30

A description of methods and computer programs for the prediction of "coupling properties" in axially-textured polycrystals is presented. Starting data are the single-crystal properties, texture and stereography. The validity and proper protocols for applying the Voigt, Reuss and Hill approximations to estimate coupling properties effective values is analyzed. Working algorithms for predicting mentioned averages are given. Bunge's symmetrized spherical harmonics expansion of orientation distribution functions, inverse pole figures and (single and polycrystals) physical properties is applied in all stages of the proposed methodology. The established mathematical route has been systematized in a working computer program. The discussion of piezoelectricity in a representative textured ferro-piezoelectric ceramic illustrates the application of the proposed methodology. Polycrystal coupling properties, predicted by the suggested route, are fairly close to experimentally measured ones.

Predicting the Coupling Properties of Axially-Textured Materials

PubMed Central

Fuentes-Cobas, Luis E.; Muñoz-Romero, Alejandro; Montero-Cabrera, María E.; Fuentes-Montero, Luis; Fuentes-Montero, María E.

2013-01-01

A description of methods and computer programs for the prediction of “coupling properties” in axially-textured polycrystals is presented. Starting data are the single-crystal properties, texture and stereography. The validity and proper protocols for applying the Voigt, Reuss and Hill approximations to estimate coupling properties effective values is analyzed. Working algorithms for predicting mentioned averages are given. Bunge’s symmetrized spherical harmonics expansion of orientation distribution functions, inverse pole figures and (single and polycrystals) physical properties is applied in all stages of the proposed methodology. The established mathematical route has been systematized in a working computer program. The discussion of piezoelectricity in a representative textured ferro-piezoelectric ceramic illustrates the application of the proposed methodology. Polycrystal coupling properties, predicted by the suggested route, are fairly close to experimentally measured ones. PMID:28788370

Value Focused Thinking Analysis of the Pacific Theater’s Future Air Mobility En Route System

DTIC Science & Technology

2011-06-01

pairing) alone does not establish a comparative advantage of an en route and should not be a sole basis for selection. Factors such as runway... advantage of it 8. Where possible, attempt to maximize transportation opportunities with intermodal capability 9. CONUS locations and end of the...Voigt, J. Optimization of Strategic Airlift En Route Throughput to Support the Global War on Terrorism. MS Graduate Research Paper, AFIT/ GMO /ENS/05E

Experimental validation of ultrasonic guided modes in electrical cables by optical interferometry.

PubMed

Mateo, Carlos; de Espinosa, Francisco Montero; Gómez-Ullate, Yago; Talavera, Juan A

2008-03-01

In this work, the dispersion curves of elastic waves propagating in electrical cables and in bare copper wires are obtained theoretically and validated experimentally. The theoretical model, based on Gazis equations formulated according to the global matrix methodology, is resolved numerically. Viscoelasticity and attenuation are modeled theoretically using the Kelvin-Voigt model. Experimental tests are carried out using interferometry. There is good agreement between the simulations and the experiments despite the peculiarities of electrical cables.

Biocompatibility Analysis of an Electrically-Activated Silver-Based Antibacterial Surface System for Medical Device Applications

DTIC Science & Technology

2012-12-16

sterilizing without causing toxicity in vivo. 1 Introduction As reported to the Centers for Disease Control and Pre- vention (CDC) between 2006 and...Owings MF. National Hospital Discharge Survey. Advance Data from Vital and Health Statistics. United States: Centers for Disease Control and Prevention...10.1007/s10856-012-4730-3. 19. Shirwaiker RA, Wysk RA, Kariyawasam S, Carrion H, Voigt RC. Micro-scale fabrication and characterization of a silver–polymer

Loss tangent and complex modulus estimated by acoustic radiation force creep and shear wave dispersion

PubMed Central

Amador, Carolina; Urban, Matthew W; Chen, Shigao; Greenleaf, James F

2012-01-01

Elasticity imaging methods have been used to study tissue mechanical properties and have demonstrated that tissue elasticity changes with disease state. In current shear wave elasticity imaging methods typically only shear wave speed is measured and rheological models, e.g., Kelvin-Voigt, Maxwell and Standard Linear Solid, are used to solve for tissue mechanical properties such as the shear viscoelastic complex modulus. This paper presents a method to quantify viscoelastic material properties in a model-independent way by estimating the complex shear elastic modulus over a wide frequency range using time-dependent creep response induced by acoustic radiation force. This radiation force induced creep (RFIC) method uses a conversion formula that is the analytic solution of a constitutive equation. The proposed method in combination with Shearwave Dispersion Ultrasound Vibrometry (SDUV) is used to measure the complex modulus so that knowledge of the applied radiation force magnitude is not necessary. The conversion formula is shown to be sensitive to sampling frequency and the first reliable measure in time according to numerical simulations using the Kelvin-Voigt model creep strain and compliance. Representative model-free shear complex moduli from homogeneous tissue mimicking phantoms and one excised swine kidney were obtained. This work proposes a novel model-free ultrasound-based elasticity method that does not require a rheological model with associated fitting requirements. PMID:22345425

Homogenization models for 2-D grid structures

NASA Technical Reports Server (NTRS)

Banks, H. T.; Cioranescu, D.; Rebnord, D. A.

1992-01-01

In the past several years, we have pursued efforts related to the development of accurate models for the dynamics of flexible structures made of composite materials. Rather than viewing periodicity and sparseness as obstacles to be overcome, we exploit them to our advantage. We consider a variational problem on a domain that has large, periodically distributed holes. Using homogenization techniques we show that the solution to this problem is in some topology 'close' to the solution of a similar problem that holds on a much simpler domain. We study the behavior of the solution of the variational problem as the holes increase in number, but decrease in size in such a way that the total amount of material remains constant. The result is an equation that is in general more complex, but with a domain that is simply connected rather than perforated. We study the limit of the solution as the amount of material goes to zero. This second limit will, in most cases, retrieve much of the simplicity that was lost in the first limit without sacrificing the simplicity of the domain. Finally, we show that these results can be applied to the case of a vibrating Love-Kirchhoff plate with Kelvin-Voigt damping. We rely heavily on earlier results of (Du), (CS) for the static, undamped Love-Kirchhoff equation. Our efforts here result in a modification of those results to include both time dependence and Kelvin-Voigt damping.

Loss tangent and complex modulus estimated by acoustic radiation force creep and shear wave dispersion.

PubMed

Amador, Carolina; Urban, Matthew W; Chen, Shigao; Greenleaf, James F

2012-03-07

Elasticity imaging methods have been used to study tissue mechanical properties and have demonstrated that tissue elasticity changes with disease state. In current shear wave elasticity imaging methods typically only shear wave speed is measured and rheological models, e.g. Kelvin-Voigt, Maxwell and Standard Linear Solid, are used to solve for tissue mechanical properties such as the shear viscoelastic complex modulus. This paper presents a method to quantify viscoelastic material properties in a model-independent way by estimating the complex shear elastic modulus over a wide frequency range using time-dependent creep response induced by acoustic radiation force. This radiation force induced creep method uses a conversion formula that is the analytic solution of a constitutive equation. The proposed method in combination with shearwave dispersion ultrasound vibrometry is used to measure the complex modulus so that knowledge of the applied radiation force magnitude is not necessary. The conversion formula is shown to be sensitive to sampling frequency and the first reliable measure in time according to numerical simulations using the Kelvin-Voigt model creep strain and compliance. Representative model-free shear complex moduli from homogeneous tissue mimicking phantoms and one excised swine kidney were obtained. This work proposes a novel model-free ultrasound-based elasticity method that does not require a rheological model with associated fitting requirements.

Line Parameters of Carbon Dioxide in the 4850 CM-1 Region

NASA Astrophysics Data System (ADS)

Benner, D. Chris; Devi, V. Malathy; Nugent, Emily; Sung, Keeyoon; Brown, Linda R.; Miller, Charles E.; Toth, Robert A.

2011-06-01

The spectral region near 4850 Cm-1 is used to monitor atmospheric carbon dioxide, but current accuracies of the line intensities and line shape coefficients do not permit carbon dioxide mixing ratios to be obtained to 1 ppm (about one part in 400). To improve the line parameters, we are remeasuring the prominent CO2 bands in this region specifically to characterize the non-Voigt effects of line mixing and speed dependence at room temperature. The laboratory spectra of air- and self-broadened CO2 have been recorded at a variety of pressures, path lengths, mixing ratios and resolutions (0.005 to 0.01 Cm-1) with two different Fourier transform spectrometers (the McMath-Pierce FTS at Kitt Peak and a Bruker 125 HR FTS at JPL). The line parameters of some 2000 transitions are being derived by simultaneous multispectrum fitting using a few dozen spectra encompassing a 230 Cm-1 wide spectral interval. The rovibrational constants for line positions and the band intensities and Herman-Wallis coefficients are being retrieved directly from the spectra, rather than floating positions and intensities individually. Self and foreign Lorentz widths and pressure shifts are being determined for the stronger bands while non-Voigt coefficients describing line mixing and speed dependence are being obtained for at least one of the strongest bands. D. Chris Benner, C. P. Rinsland, V. M. Devi, M. A. H. Smith, and D. A. Atkins, JQSRT 1995;53:705-21. V. M. Devi, D. Chris Benner, L. R. Brown, C. E. Miller, and R. A. Toth, J. Mol. Spectrosc. 2007;245:52-80. Part of the research described in this paper was performed at the Jet Propulsion Laboratory, California Institute of Technology, under contracts and cooperative agreements with the National Aeronautics and Space Administration. Support for the work at William and Mary was provided by contracts with JPL.

Diode laser spectroscopy: precise spectral line shape measurements

NASA Astrophysics Data System (ADS)

Nadezhdinskii, A. I.

1996-07-01

When one speaks about modern trends in tunable diode laser spectroscopy (TDLS) one should mention that precise line shape measurements have become one of the most promising applications of diode lasers in high resolution molecular spectroscopy. Accuracy limitations of TDL spectrometers are considered in this paper, proving the ability to measure spectral line profile with precision better than 1%. A four parameter Voigt profile is used to fit the experimental spectrum, and the possibility of line shift measurements with an accuracy of 2 × 10 -5 cm -1 is shown. Test experiments demonstrate the error line intensity ratios to be less than 0.3% for the proposed approach. Differences between "soft" and "hard" models of line shape have been observed experimentally for the first time. Some observed resonance effects are considered with respect to collision adiabacity.

Modeling of coherent ultrafast magneto-optical experiments: Light-induced molecular mean-field model

DOE Office of Scientific and Technical Information (OSTI.GOV)

Hinschberger, Y.; Hervieux, P.-A.

2015-12-28

We present calculations which aim to describe coherent ultrafast magneto-optical effects observed in time-resolved pump-probe experiments. Our approach is based on a nonlinear semi-classical Drude-Voigt model and is used to interpret experiments performed on nickel ferromagnetic thin film. Within this framework, a phenomenological light-induced coherent molecular mean-field depending on the polarizations of the pump and probe pulses is proposed whose microscopic origin is related to a spin-orbit coupling involving the electron spins of the material sample and the electric field of the laser pulses. Theoretical predictions are compared to available experimental data. The model successfully reproduces the observed experimental trendsmore » and gives meaningful insight into the understanding of magneto-optical rotation behavior in the ultrafast regime. Theoretical predictions for further experimental studies are also proposed.« less

Asymptotic expansions of the kernel functions for line formation with continuous absorption

NASA Technical Reports Server (NTRS)

Hummer, D. G.

1991-01-01

Asymptotic expressions are obtained for the kernel functions M2(tau, alpha, beta) and K2(tau, alpha, beta) appearing in the theory of line formation with complete redistribution over a Voigt profile with damping parameter a, in the presence of a source of continuous opacity parameterized by beta. For a greater than 0, each coefficient in the asymptotic series is expressed as the product of analytic functions of a and eta. For Doppler broadening, only the leading term can be evaluated analytically.

Spectral Analysis and Metastable Absorption Measurements of High Pressure Capacitively and Inductively Coupled Radio-Frequency Argon-Helium Discharges

DTIC Science & Technology

2013-06-01

density of the s5 and s3 metastable states for different discharge parameters. The absorption data was fit to an approximated Voigt profile from which...pressures are required in order to have enough spin-orbit relaxation to maintain CW lasing without significant bottlenecking. There are many methods to...for just that [(5),(12)]. This method allows for a wide study of energy levels since the limiting factor is the sensitivity of the detector and modern

Non-reciprocity and topology in optics: one-way road for light via surface magnon polariton.

PubMed

Ochiai, Tetsuyuki

2015-02-01

We show how non-reciprocity and topology are used to construct an optical one-way waveguide in the Voigt geometry. First, we present a traditional approach of the one-way waveguide of light using surface polaritons under a static magnetic field. Second, we explain a recent discovery of a topological approach using photonic crystals with the magneto-optical coupling. Third, we present a combination of the two approaches, toward a broadband one-way waveguide in the microwave range.

Non-reciprocity and topology in optics: one-way road for light via surface magnon polariton

PubMed Central

Ochiai, Tetsuyuki

2015-01-01

We show how non-reciprocity and topology are used to construct an optical one-way waveguide in the Voigt geometry. First, we present a traditional approach of the one-way waveguide of light using surface polaritons under a static magnetic field. Second, we explain a recent discovery of a topological approach using photonic crystals with the magneto-optical coupling. Third, we present a combination of the two approaches, toward a broadband one-way waveguide in the microwave range. PMID:27877739

Laser plasma x-ray line spectra fitted using the Pearson VII function

NASA Astrophysics Data System (ADS)

Michette, A. G.; Pfauntsch, S. J.

2000-05-01

The Pearson VII function, which is more general than the Gaussian, Lorentzian and other profiles, is used to fit the x-ray spectral lines produced in a laser-generated plasma, instead of the more usual, but computationally expensive, Voigt function. The mean full-width half-maximum of the fitted lines is 0.102+/-0.014 nm, entirely consistent with the value expected from geometrical considerations, and the fitted line profiles are generally inconsistent with being either Lorentzian or Gaussian.

Linear viscoelasticity of a single semiflexible polymer with internal friction.

PubMed

Hiraiwa, Tetsuya; Ohta, Takao

2010-07-28

The linear viscoelastic behaviors of single semiflexible chains with internal friction are studied based on the wormlike-chain model. It is shown that the frequency dependence of the complex compliance in the high frequency limit is the same as that of the Voigt model. This asymptotic behavior appears also for the Rouse model with internal friction. We derive the characteristic times for both the high frequency limit and the low frequency limit and compare the results with those obtained by Khatri et al.

Symposium on Molecular Spectroscopy (39th) Held in Columbus, Ohio on 11-15 Jun 84.

DTIC Science & Technology

1984-06-15

measured infrared absorbances to Gaussian and Voigt profiles. This work was supported by the Director, Office of Energy Research, Office of Basic Energy ...molecules) 7l) Liquid state (12 Solid 0 ate (electroriic) 3) Elect ronic theory IS Mat rix spectra 113) Solid state (i nfraredl 14) Energy transfer q) Mi...Y. CHOW CHIU, Department of Chemistry, Howard University, Washington, D.C., 20059. ME9. CALCULATION OF POTENTIAL ENERGY CURVES & FRANCK CONDON FACTORS

Wave Propagation Analysis of Edge Cracked Circular Beams under Impact Force

PubMed Central

Akbaş, Şeref Doğuşcan

2014-01-01

This paper presents responses of an edge circular cantilever beam under the effect of an impact force. The beam is excited by a transverse triangular force impulse modulated by a harmonic motion. The Kelvin–Voigt model for the material of the beam is used. The cracked beam is modelled as an assembly of two sub-beams connected through a massless elastic rotational spring. The considered problem is investigated within the Bernoulli-Euler beam theory by using energy based finite element method. The system of equations of motion is derived by using Lagrange's equations. The obtained system of linear differential equations is reduced to a linear algebraic equation system and solved in the time domain by using Newmark average acceleration method. In the study, the effects of the location of crack, the depth of the crack, on the characteristics of the reflected waves are investigated in detail. Also, the positions of the cracks are calculated by using reflected waves. PMID:24972050

Effect of geometric size on mechanical properties of dielectric elastomers based on an improved visco-hyperelastic film model

NASA Astrophysics Data System (ADS)

Chang, Mengzhou; Wang, Zhenqing; Tong, Liyong; Liang, Wenyan

2017-03-01

Dielectric polymers show complex mechanical behaviors with different boundary conditions, geometry size and pre-stress. A viscoelastic model suitable for inhomogeneous deformation is presented integrating the Kelvin-Voigt model in a new form in this work. For different types of uniaxial tensile test loading along the length direction of sample, single-step-relaxation tests, loading-unloading tests and tensile-creep-relaxation tests the improved model provides a quite favorable comparison with the experiment results. Moreover, The mechanical properties of test sample with several length-width ratios under different boundary conditions are also invested. The influences of the different boundary conditions are calculated with a stress applied on the boundary point and the result show that the fixed boundary will increase the stress compare with homogeneous deformation. In modeling the effect of pre-stress in the shear test, three pre-stressed mode are discussed. The model validation on the general mechanical behavior shows excellent predictive capability.

Ultra wideband (0.5-16 kHz) MR elastography for robust shear viscoelasticity model identification.

PubMed

Liu, Yifei; Yasar, Temel K; Royston, Thomas J

2014-12-21

Changes in the viscoelastic parameters of soft biological tissues often correlate with progression of disease, trauma or injury, and response to treatment. Identifying the most appropriate viscoelastic model, then estimating and monitoring the corresponding parameters of that model can improve insight into the underlying tissue structural changes. MR Elastography (MRE) provides a quantitative method of measuring tissue viscoelasticity. In a previous study by the authors (Yasar et al 2013 Magn. Reson. Med. 70 479-89), a silicone-based phantom material was examined over the frequency range of 200 Hz-7.75 kHz using MRE, an unprecedented bandwidth at that time. Six viscoelastic models including four integer order models and two fractional order models, were fit to the wideband viscoelastic data (measured storage and loss moduli as a function of frequency). The 'fractional Voigt' model (spring and springpot in parallel) exhibited the best fit and was even able to fit the entire frequency band well when it was identified based only on a small portion of the band. This paper is an extension of that study with a wider frequency range from 500 Hz to 16 kHz. Furthermore, more fractional order viscoelastic models are added to the comparison pool. It is found that added complexity of the viscoelastic model provides only marginal improvement over the 'fractional Voigt' model. And, again, the fractional order models show significant improvement over integer order viscoelastic models that have as many or more fitting parameters.

PP/PS anisotropic stereotomography

NASA Astrophysics Data System (ADS)

Nag, Steinar; Alerini, Mathias; Ursin, Bjørn

2010-04-01

Stereotomography is a slope tomographic method which gives good results for background velocity model estimation in 2-D isotropic media. We develop here the extension of the method to 3-D general anisotropic media for PP and PS events. We do not take into account the issue of shear wave degeneracy. As in isotropic media, the sensitivity matrix of the inversion can be computed by paraxial ray tracing. We introduce a `constant Z stereotomography' approach, which can reduce the size of the sensitivity matrix. Based on ray perturbation theory, we give all the derivatives of stereotomography data parameters with respect to model parameters in a 3-D general anisotropic medium. These general formulas for the derivatives can also be used in other applications that rely on anisotropic ray perturbation theory. In particular, we obtain derivatives of the phase velocity with respect to position, phase angle and elastic medium parameters, all for general anisotropic media. The derivatives are expressed using the Voigt notation for the elastic medium parameters. We include a Jacobian that allows to change the model parametrization from Voigt to Thomsen parameters. Explicit expressions for the derivatives of the data are given for the case of 2-D tilted transversely isotropic (TTI) media. We validate the method by single-parameter estimation of each Thomsen parameter field of a 2-D TTI synthetic model, where data are modelled by ray tracing. For each Thomsen parameter, the estimated velocity field fits well with the true velocity field.

The VLab repository of thermodynamics and thermoelastic properties of minerals

NASA Astrophysics Data System (ADS)

Da Silveira, P. R.; Sarkar, K.; Wentzcovitch, R. M.; Shukla, G.; Lindemann, W.; Wu, Z.

2015-12-01

Thermodynamics and thermoelastic properties of minerals at planetary interior conditions are essential as input for geodynamics simulations and for interpretation of seismic tomography models. Precise experimental determination of these properties at such extreme conditions is very challenging. Therefore, ab initio calculations play an essential role in this context, but at the cost of great computational effort and memory use. Setting up a widely accessible and versatile mineral physics database can relax unnecessary repetition of such computationally intensive calculations. Access to such data facilitates transactional interaction across fields and can advance more quickly insights about deep Earth processes. Hosted by the Minnesota Supercomputing Institute, the Virtual Laboratory for Earth and Planetary Materials (VLab) was designed to develop and promote the theory of planetary materials using distributed, high-throughput quantum calculations. VLab hosts an interactive database of thermodynamics and thermoelastic properties or minerals computed by ab initio. Such properties can be obtained according to user's preference. The database is accompanied by interactive visualization tools, allowing users to repeat and build upon previously published results. Using VLab2015, we have evaluated thermoelastic properties, such as elastic coefficients (Cij), Voigt, Reuss, and Voigt-Reuss-Hill aggregate averages for bulk (K) and shear modulus (G), shear wave velocity (VS), longitudinal wave velocity (Vp), and bulk sound velocity (V0) for several important minerals. Developed web services are general and can be used for crystals of any symmetry. Results can be tabulated, plotted, or downloaded from the VLab website according to user's preference.

Differential absorption lidar measurements of atmospheric temperature and pressure profiles

NASA Technical Reports Server (NTRS)

Korb, C. L.

1981-01-01

The theory and methodology of using differential absorption lidar techniques for the remote measurement of atmospheric pressure profiles, surface pressure, and temperature profiles from ground, air, and space-based platforms are presented. Pressure measurements are effected by means of high resolution measurement of absorption at the edges of the oxygen A band lines where absorption is pressure dependent due to collisional line broadening. Temperature is assessed using measurements of the absorption at the center of the oxygen A band line originating from a quantum state with high ground state energy. The population of the state is temperature dependent, allowing determination of the temperature through the Boltzmann term. The results of simulations of the techniques using Voigt profile and variational analysis are reported for ground-based, airborne, and Shuttle-based systems. Accuracies in the 0.5-1.0 K and 0.1-0.3% range are projected.

Chemical Potential Evaluation of Thermoelectric and Mechanical Properties of Zr2CoZ (Z = Si, Ge) Heusler Alloys

NASA Astrophysics Data System (ADS)

Yousuf, Saleem; Gupta, Dinesh C.

2018-04-01

The electronic, mechanical and thermoelectric properties of Zr2CoZ (Z = Si, Ge) Heusler alloys are investigated by the full-potential linearized augmented plane wave method. Using the Voigt-Reuss approximation, we calculated the various elastic constants, the shear and Young's moduli, and Poisson's ratio which predict the ductile nature of the alloys. Thermoelectric coefficients viz., Seebeck, electrical conductivity and figure of merit show Zr2CoZ alloys as n-type thermoelectric materials showing a linearly increasing Seebeck coefficient with temperature mainly because of the existence of almost flat conduction bands along L to D directions of a high symmetry Brillouin zone. The efficiency of conversion was measured as the figure of merit by taking into effect the lattice thermal part that achieves an upper-limit of 0.14 at 1200 K which may favour their use for waste heat recovery at higher temperatures.

Coupling mechanical tension and GTPase signaling to generate cell and tissue dynamics

NASA Astrophysics Data System (ADS)

Zmurchok, Cole; Bhaskar, Dhananjay; Edelstein-Keshet, Leah

2018-07-01

Regulators of the actin cytoskeleton such Rho GTPases can modulate forces developed in cells by promoting actomyosin contraction. At the same time, through mechanosensing, tension is known to affect the activity of Rho GTPases. What happens when these effects act in concert? Using a minimal model (1 GTPase coupled to a Kelvin–Voigt element), we show that two-way feedback between signaling (‘RhoA’) and mechanical tension (stretching) leads to a spectrum of cell behaviors, including contracted or relaxed cells, and cells that oscillate between these extremes. When such ‘model cells’ are connected to one another in a row or in a 2D sheet (‘epithelium’), we observe waves of contraction/relaxation and GTPase activity sweeping through the tissue. The minimal model lends itself to full bifurcation analysis, and suggests a mechanism that explains behavior observed in the context of development and collective cell behavior.

A Thermoplastic Acoustical Holography Recording Device.

DTIC Science & Technology

1980-09-25

Swinson, W. F. Ranson, D. Smith, H. K. Liu, Mr. J. A. Schaeffel , and Mr. Keith Rodgers. I. INTRODUCTION The purpose of this report is to describe the...Letters, Vol. 11 (1967), p. 294. 6. Schaeffel , J. A., Jr., "Acoustical Speckle Interferometry," Technical Report T-79-39, US Army Missile Research and...Arlington, VA 22209 DRSMI-LP, Mr. Voigt 1 -R 1 -RL, Mr. Comus 1 -RLA, Mr. Pettey 1 -RLA 1 Mr. Schaeffel 50 -RPT (Reference Copy) I (Record Copy) 1 -RPR 15 35 ~j~fj D-T I -C

Development of an analytical-numerical model to predict radiant emission or absorption

NASA Technical Reports Server (NTRS)

Wallace, Tim L.

1994-01-01

The development of an analytical-numerical model to predict radiant emission or absorption is discussed. A voigt profile is assumed to predict the spectral qualities of a singlet atomic transition line for atomic species of interest to the OPAD program. The present state of this model is described in each progress report required under contract. Model and code development is guided by experimental data where available. When completed, the model will be used to provide estimates of specie erosion rates from spectral data collected from rocket exhaust plumes or other sources.

A dynamic unilateral contact problem with adhesion and friction in viscoelasticity

NASA Astrophysics Data System (ADS)

Cocou, Marius; Schryve, Mathieu; Raous, Michel

2010-08-01

The aim of this paper is to study an interaction law coupling recoverable adhesion, friction and unilateral contact between two viscoelastic bodies of Kelvin-Voigt type. A dynamic contact problem with adhesion and nonlocal friction is considered and its variational formulation is written as the coupling between an implicit variational inequality and a parabolic variational inequality describing the evolution of the intensity of adhesion. The existence and approximation of variational solutions are analysed, based on a penalty method, some abstract results and compactness properties. Finally, some numerical examples are presented.

A High Altitude Infrared Radiance Model

DTIC Science & Technology

1977-11-30

retain the Tŗ/ 2 dependence. The chief complication with the functions for Voigt profiles is that for inter- mediate values of x the behavior is similar... behavior has been found by Malkmus (1967, 1968) for curves of growth for various random band models. A strict derivation of the asymptotic expansions...slightly faster than the 1974 mode. The most time consuming process is now the 65- 0 ൱ 0 u 41’ 0I 9-4- "V-4 4 J Řr- B06 co 4J . I0 Ch- 0 P-44

Boundary-element modelling of dynamics in external poroviscoelastic problems

NASA Astrophysics Data System (ADS)

Igumnov, L. A.; Litvinchuk, S. Yu; Ipatov, A. A.; Petrov, A. N.

2018-04-01

A problem of a spherical cavity in porous media is considered. Porous media are assumed to be isotropic poroelastic or isotropic poroviscoelastic. The poroviscoelastic formulation is treated as a combination of Biot’s theory of poroelasticity and elastic-viscoelastic correspondence principle. Such viscoelastic models as Kelvin–Voigt, Standard linear solid, and a model with weakly singular kernel are considered. Boundary field study is employed with the help of the boundary element method. The direct approach is applied. The numerical scheme is based on the collocation method, regularized boundary integral equation, and Radau stepped scheme.

Effect of temperature- and frequency-dependent dynamic properties of rail pads on high-speed vehicle-track coupled vibrations

NASA Astrophysics Data System (ADS)

Wei, Kai; Wang, Feng; Wang, Ping; Liu, Zi-xuan; Zhang, Pan

2017-03-01

The soft under baseplate pad of WJ-8 rail fastener frequently used in China's high-speed railways was taken as the study subject, and a laboratory test was performed to measure its temperature and frequency-dependent dynamic performance at 0.3 Hz and at -60°C to 20°C with intervals of 2.5°C. Its higher frequency-dependent results at different temperatures were then further predicted based on the time-temperature superposition (TTS) and Williams-Landel-Ferry (WLF) formula. The fractional derivative Kelvin-Voigt (FDKV) model was used to represent the temperature- and frequency-dependent dynamic properties of the tested rail pad. By means of the FDKV model for rail pads and vehicle-track coupled dynamic theory, high-speed vehicle-track coupled vibrations due to temperature- and frequency-dependent dynamic properties of rail pads was investigated. Finally, further combining with the measured frequency-dependent dynamic performance of vehicle's rubber primary suspension, the high-speed vehicle-track coupled vibration responses were discussed. It is found that the storage stiffness and loss factor of the tested rail pad are sensitive to low temperatures or high frequencies. The proposed FDKV model for the frequency-dependent storage stiffness and loss factors of the tested rail pad can basically meet the fitting precision, especially at ordinary temperatures. The numerical simulation results indicate that the vertical vibration levels of high-speed vehicle-track coupled systems calculated with the FDKV model for rail pads in time domain are higher than those calculated with the ordinary Kelvin-Voigt (KV) model for rail pads. Additionally, the temperature- and frequency-dependent dynamic properties of the tested rail pads would alter the vertical vibration acceleration levels (VALs) of the car body and bogie in 1/3 octave frequencies above 31.5 Hz, especially enlarge the vertical VALs of the wheel set and rail in 1/3 octave frequencies of 31.5-100 Hz and above 315 Hz, which are the dominant frequencies of ground vibration acceleration and rolling noise (or bridge noise) caused by high-speed railways respectively. Since the fractional derivative value of the adopted rubber primary suspension, unlike the tested rail pad, is very close to 1, its frequency-dependent dynamic performance has little effect on high-speed vehicle-track coupled vibration responses.

Magnetic field induced changes in linear and nonlinear optical properties of Ti incorporated Cr2O3 nanostructured thin film

NASA Astrophysics Data System (ADS)

Baraskar, Priyanka; Chouhan, Romita; Agrawal, Arpana; Choudhary, R. J.; Sen, Pranay K.; Sen, Pratima

2018-03-01

We report the magnetic field effect on the linear and nonlinear optical properties of pulse laser ablated Ti-incorporated Cr2O3 nanostructured thin film. Optical properties have been experimentally analyzed under Voigt geometry by performing ultraviolet-visible spectroscopy and closed aperture Z-scan technique using a continuous wave He-Ne laser source. Nonlinear optical response reveals a single peak-valley feature in the far field diffraction pattern in absence of magnetic field (B = 0) confirming self-defocussing effect. This feature switches to a valley-peak configuration for B = 5000G, suggesting self-focusing effect. For B ≤ 750G, oscillations were observed revealing the occurrence of higher order nonlinearity. Origin of nonlinearity is attributed to the near resonant d-d transitions observed from the broad peak occurring around 2 eV. These transitions are of magnetic origin and get modified under the application of external magnetic field. Our results suggest that magnetic field can be used as an effective tool to monitor the sign of optical nonlinearity and hence the thermal expansion in Ti-incorporated Cr2O3 nanostructured thin film.

Application of recursive Gibbs-Appell formulation in deriving the equations of motion of N-viscoelastic robotic manipulators in 3D space using Timoshenko Beam Theory

NASA Astrophysics Data System (ADS)

Korayem, M. H.; Shafei, A. M.

2013-02-01

The goal of this paper is to describe the application of Gibbs-Appell (G-A) formulation and the assumed modes method to the mathematical modeling of N-viscoelastic link manipulators. The paper's focus is on obtaining accurate and complete equations of motion which encompass the most related structural properties of lightweight elastic manipulators. In this study, two important damping mechanisms, namely, the structural viscoelasticity (Kelvin-Voigt) effect (as internal damping) and the viscous air effect (as external damping) have been considered. To include the effects of shear and rotational inertia, the assumption of Timoshenko beam (TB) theory (TBT) has been applied. Gravity, torsion, and longitudinal elongation effects have also been included in the formulations. To systematically derive the equations of motion and improve the computational efficiency, a recursive algorithm has been used in the modeling of the system. In this algorithm, all the mathematical operations are carried out by only 3×3 and 3×1 matrices. Finally, a computational simulation for a manipulator with two elastic links is performed in order to verify the proposed method.

Measurement of the electron and ion temperatures by the x-ray imaging crystal spectrometer on joint Texas experimental tokamak

DOE Office of Scientific and Technical Information (OSTI.GOV)

Yan, W.; Chen, Z. Y., E-mail: zychen@hust.edu.cn; Huang, D. W.

An x-ray imaging crystal spectrometer has been developed on joint Texas experimental tokamak for the measurement of electron and ion temperatures from the K{sub α} spectra of helium-like argon and its satellite lines. A two-dimensional multi-wire proportional counter has been applied to detect the spectra. The electron and ion temperatures have been obtained from the Voigt fitting with the spectra of helium-like argon ions. The profiles of electron and ion temperatures show the dependence on electron density in ohmic plasmas.

Comment on “Surface electromagnetic wave equations in a warm magnetized quantum plasma” [Phys. Plasmas 21, 072114 (2014)

DOE Office of Scientific and Technical Information (OSTI.GOV)

Moradi, Afshin, E-mail: a.moradi@kut.ac.ir

2016-07-15

In a recent article [C. Li et al., Phys. Plasmas 21, 072114 (2014)], Li et al. studied the propagation of surface waves on a magnetized quantum plasma half-space in the Voigt configuration (in this case, the magnetic field is parallel to the surface but is perpendicular to the direction of propagation). Here, we present a fresh look at the problem and obtain a new form of dispersion relation of surface waves of the system. We find that our new dispersion relation does not agree with the result obtained by Li et al.

Nuclear quadrupole moment-induced Cotton-Mouton effect in molecules

DOE Office of Scientific and Technical Information (OSTI.GOV)

Fu, Li-juan, E-mail: lijuan.fu@oulu.fi, E-mail: juha.vaara@iki.fi; Vaara, Juha, E-mail: lijuan.fu@oulu.fi, E-mail: juha.vaara@iki.fi

Nuclear magneto-optic effects could make important contributions to novel, high-sensitivity, and high-resolution spectroscopic and imaging methods that provide nuclear site-specific structural and dynamic information on molecular and materials systems. Here we present a first-principles electronic structure formulation of nuclear quadrupole moment-induced Cotton-Mouton effect in terms of response theory, as well as ab initio and density-functional theory calculations of this phenomenon for a series of molecular liquids: H{sub 2}O, CH{sub 3}NO{sub 2}, CH{sub 3}CH{sub 2}OH, C{sub 6}H{sub 6}, C{sub 6}H{sub 12} (cyclohexane), HI, XeF{sub 2}, WF{sub 5}Cl, and Pt(C{sub 2}dtp){sub 2}. The roles of basis-set convergence, electron correlation, and relativistic effectsmore » are discussed. The estimated order of magnitude of the overall ellipticities induced to linearly polarized light is 10{sup −3}–10{sup −7} rad/(M cm) for fully spin polarized nuclei. The cases with the largest presently obtained ellipticities should be detectable with modern instrumentation in the Voigt magneto-optic setup, particularly for the heavy nuclei.« less

Modeling ramp-hold indentation measurements based on Kelvin-Voigt fractional derivative model

NASA Astrophysics Data System (ADS)

Zhang, Hongmei; zhe Zhang, Qing; Ruan, Litao; Duan, Junbo; Wan, Mingxi; Insana, Michael F.

2018-03-01

Interpretation of experimental data from micro- and nano-scale indentation testing is highly dependent on the constitutive model selected to relate measurements to mechanical properties. The Kelvin-Voigt fractional derivative model (KVFD) offers a compact set of viscoelastic features appropriate for characterizing soft biological materials. This paper provides a set of KVFD solutions for converting indentation testing data acquired for different geometries and scales into viscoelastic properties of soft materials. These solutions, which are mostly in closed-form, apply to ramp-hold relaxation, load-unload and ramp-load creep-testing protocols. We report on applications of these model solutions to macro- and nano-indentation testing of hydrogels, gastric cancer cells and ex vivo breast tissue samples using an atomic force microscope (AFM). We also applied KVFD models to clinical ultrasonic breast data using a compression plate as required for elasticity imaging. Together the results show that KVFD models fit a broad range of experimental data with a correlation coefficient typically R 2  >  0.99. For hydrogel samples, estimation of KVFD model parameters from test data using spherical indentation versus plate compression as well as ramp relaxation versus load-unload compression all agree within one standard deviation. Results from measurements made using macro- and nano-scale indentation agree in trend. For gastric cell and ex vivo breast tissue measurements, KVFD moduli are, respectively, 1/3-1/2 and 1/6 of the elasticity modulus found from the Sneddon model. In vivo breast tissue measurements yield model parameters consistent with literature results. The consistency of results found for a broad range of experimental parameters suggest the KVFD model is a reliable tool for exploring intrinsic features of the cell/tissue microenvironments.

Homogeneous and inhomogeneous broadenings and the Voigt line shapes in the phase-resolved and intensity sum-frequency generation vibrational spectroscopy

DOE Office of Scientific and Technical Information (OSTI.GOV)

Chen, Shunli; Fu, Li; Gan, Wei

2016-01-21

In this report we show that the ability to measure the sub-1 cm -1 resolution phase-resolved and intensity high-resolution broadband sum frequency generation vibrational spectra (HR-BB-SFG-VS) of the –CN stretch vibration of the Langmuir-Blodgett (LB) monolayer of the 4-n-octyl-4’-cyanobiphenyl (8CB) on the z-cut α-quartz surface allows for the first time the direct comparison and understanding of the homogeneous and inhomogeneous broadenings in the imaginary and intensity SFG vibrational spectral lineshapes in detail. The difference of the full width at half maxima (FWHM) of the imaginary and intensity SFG-VS spectra of the same vibrational mode is the signature of the Voigtmore » lineshape and it measures the relative contribution to the overall lineshape from the homogeneous and inhomogeneous broadenings in SFG vibrational spectra. From the phase-resolved and intensity spectra, we found that the FWHM of the 2238.00 ±0.02 cm -1 peak in the phase-resolved imaginary and intensity spectra is 19.2 ± 0.2 cm -1 and 21.6 ± 0.4 cm -1, respectively, for the –CN group of the 8CB LB monolayer on the z-cut α-quartz crystal surface. The FWHM width difference of 2.4 cm -1 agrees quantitatively with a Voigt lineshape with a homogeneous broadening half width of Γ = 5.29 ± 0.08 cm -1 and a inhomogeneous standard derivation width Δω = 5.42 ± 0.07 cm -1. These results shed new lights on the understanding and interpretation of the lineshapes of both the phase-resolved and the intensity SFG vibrational spectra, as well as other incoherent and coherent spectroscopic techniques in general.« less

Assessing composition and structure of soft biphasic media from Kelvin-Voigt fractional derivative model parameters

NASA Astrophysics Data System (ADS)

Zhang, Hongmei; Wang, Yue; Fatemi, Mostafa; Insana, Michael F.

2017-03-01

Kelvin-Voigt fractional derivative (KVFD) model parameters have been used to describe viscoelastic properties of soft tissues. However, translating model parameters into a concise set of intrinsic mechanical properties related to tissue composition and structure remains challenging. This paper begins by exploring these relationships using a biphasic emulsion materials with known composition. Mechanical properties are measured by analyzing data from two indentation techniques—ramp-stress relaxation and load-unload hysteresis tests. Material composition is predictably correlated with viscoelastic model parameters. Model parameters estimated from the tests reveal that elastic modulus E 0 closely approximates the shear modulus for pure gelatin. Fractional-order parameter α and time constant τ vary monotonically with the volume fraction of the material’s fluid component. α characterizes medium fluidity and the rate of energy dissipation, and τ is a viscous time constant. Numerical simulations suggest that the viscous coefficient η is proportional to the energy lost during quasi-static force-displacement cycles, E A . The slope of E A versus η is determined by α and the applied indentation ramp time T r. Experimental measurements from phantom and ex vivo liver data show close agreement with theoretical predictions of the η -{{E}A} relation. The relative error is less than 20% for emulsions 22% for liver. We find that KVFD model parameters form a concise features space for biphasic medium characterization that described time-varying mechanical properties. The experimental work was carried out at the Beckman Institute for Advanced Science and Technology, University of Illinois at Urbana-Champaign, Urbana, IL 61801, USA. Methodological development, including numerical simulation and all data analysis, were carried out at the school of Life Science and Technology, Xi’an JiaoTong University, 710049, China.

A nonlocal strain gradient model for dynamic deformation of orthotropic viscoelastic graphene sheets under time harmonic thermal load

NASA Astrophysics Data System (ADS)

Radwan, Ahmed F.; Sobhy, Mohammed

2018-06-01

This work presents a nonlocal strain gradient theory for the dynamic deformation response of a single-layered graphene sheet (SLGS) on a viscoelastic foundation and subjected to a time harmonic thermal load for various boundary conditions. Material of graphene sheets is presumed to be orthotropic and viscoelastic. The viscoelastic foundation is modeled as Kelvin-Voigt's pattern. Based on the two-unknown plate theory, the motion equations are obtained from the dynamic version of the virtual work principle. The nonlocal strain gradient theory is established from Eringen nonlocal and strain gradient theories, therefore, it contains two material scale parameters, which are nonlocal parameter and gradient coefficient. These scale parameters have two different effects on the graphene sheets. The obtained deflection is compared with that predicted in the literature. Additional numerical examples are introduced to illustrate the influences of the two length scale coefficients and other parameters on the dynamic deformation of the viscoelastic graphene sheets.

A novel EBSD-based finite-element wave propagation model for investigating seismic anisotropy: Application to Finero Peridotite, Ivrea-Verbano Zone, Northern Italy

NASA Astrophysics Data System (ADS)

Zhong, Xin; Frehner, Marcel; Kunze, Karsten; Zappone, Alba

2014-10-01

A novel electron backscatter diffraction (EBSD) -based finite-element (FE) wave propagation simulation is presented and applied to investigate seismic anisotropy of peridotite samples. The FE model simulates the dynamic propagation of seismic waves along any chosen direction through representative 2D EBSD sections. The numerical model allows separation of the effects of crystallographic preferred orientation (CPO) and shape preferred orientation (SPO). The obtained seismic velocities with respect to specimen orientation are compared with Voigt-Reuss-Hill estimates and with laboratory measurements. The results of these three independent methods testify that CPO is the dominant factor controlling seismic anisotropy. Fracture fillings and minor minerals like hornblende only influence the seismic anisotropy if their volume proportion is sufficiently large (up to 23%). The SPO influence is minor compared to the other factors. The presented FE model is discussed with regard to its potential in simulating seismic wave propagation using EBSD data representing natural rock petrofabrics.

Hydrostatic pressure effects on the structural, elastic and thermodynamic properties of the complex transition metal hydrides A2OsH6 (A = Mg, Ca, Sr and Ba)

NASA Astrophysics Data System (ADS)

Souadia, Z.; Bouhemadou, A.; Boudrifa, O.; Bin-Omran, S.; Khenata, R.; Al-Douri, Y.

2017-10-01

We report a systematic first-principles density functional theory study on the pressure dependence of the structural parameters, elastic constants and related properties and thermodynamic properties of the complex transition metal hydrides Mg2OsH6, Ca2OsH6, Sr2OsH6 and Ba2OsH6. The calculated structural parameters are in excellent agreement with the existing data in the scientific literature. The single-crystal elastic constants and related properties were predicted using the stress-strain method. The elastic moduli of the polycrystalline aggregates were evaluated via the Voigt-Reuss-Hill approach. The dependences of the lattice parameter, bulk modulus, volume thermal expansion coefficient, isobaric and isochoric heat capacity and Debye temperature on the pressure and temperature, ranging from 0 to 15 GPa and from 0 to 1000 K, respectively, were investigated using the quasi-harmonic Debye model in combination with first-principles calculations.

An X-ray photoelectron spectroscopy study of the thermal nitridation of SiO2/Si

NASA Technical Reports Server (NTRS)

Vasquez, R. P.; Madhukar, A.; Grunthaner, F. J.; Naiman, M. L.

1986-01-01

The dependence of the nitrogen distribution in thermally nitrided SiO2 films on the nitridation time and temperature has been studied by means of X-ray photoelectron spectroscopy (XPS). The photoelectron peak intensities were measured by fitting Voigt profiles to the XPS spectra and were used to calculate the film composition as a function of film depth, applying an analytical method described in detail. The times of appearance of the maxima in interfacial nitrogen concentration are shown for 800, 1000, and 1150 C, and the data are related to a kinetic model of Vasquez and Madhukar (1985), which considers the effect of interfacial strain on the nitridation kinetics. In addition, the intensity of a fluorine marker (from the HF used in the etching step) was found to correlate with the nitrogen concentration. It is postulated that the F bonds preferentially to defects. This hypothesis and the measured F intensities are consistent with the proposed strain-dependent energy of defect formation.

The costs and benefits of a cigarette ban.

PubMed

Doucet, Mathieu

2017-06-01

The death toll from tobacco is staggering: it might contribute to one billion premature deaths over the course of the 21st century. In 'The case for banning cigarettes', Kalle Grill and Kristin Voigt argue that the well-being and equality benefits of a complete ban on cigarettes more than justify the restrictions on autonomy that such a ban would impose. Their argument depends on two crucial simplifications: an assumption that the ban would be effective and the restriction of the analysis to a comparison with the status quo, rather than a broader range of policy options. I argue that despite the authors' claims, these two simplifications make it impossible for their argument to 'bring into focus the fundamental normative issues' surrounding a possible cigarette ban, since they dramatically overstate the benefits and obscure the most significant costs of such a ban. Published by the BMJ Publishing Group Limited. For permission to use (where not already granted under a licence) please go to http://www.bmj.com/company/products-services/rights-and-licensing/.

A Class of time-fractional hemivariational inequalities with application to frictional contact problem

NASA Astrophysics Data System (ADS)

Zeng, Shengda; Migórski, Stanisław

2018-03-01

In this paper a class of elliptic hemivariational inequalities involving the time-fractional order integral operator is investigated. Exploiting the Rothe method and using the surjectivity of multivalued pseudomonotone operators, a result on existence of solution to the problem is established. Then, this abstract result is applied to provide a theorem on the weak solvability of a fractional viscoelastic contact problem. The process is quasistatic and the constitutive relation is modeled with the fractional Kelvin-Voigt law. The friction and contact conditions are described by the Clarke generalized gradient of nonconvex and nonsmooth functionals. The variational formulation of this problem leads to a fractional hemivariational inequality.

Single-color, in situ photolithography marking of individual CdTe/ZnTe quantum dots containing a single Mn{sup 2+} ion

DOE Office of Scientific and Technical Information (OSTI.GOV)

Sawicki, K.; Malinowski, F. K.; Gałkowski, K.

2015-01-05

A simple, single-color method for permanent marking of the position of individual self-assembled semiconductor Quantum Dots (QDs) at cryogenic temperatures is reported. The method combines in situ photolithography with standard micro-photoluminescence spectroscopy. Its utility is proven by a systematic magnetooptical study of a single CdTe/ZnTe QD containing a Mn{sup 2+} ion, where a magnetic field of up to 10 T in two orthogonal, Faraday and Voigt, configurations is applied to the same QD. The presented approach can be applied to a wide range of solid state nanoemitters.

A class of fractional differential hemivariational inequalities with application to contact problem

NASA Astrophysics Data System (ADS)

Zeng, Shengda; Liu, Zhenhai; Migorski, Stanislaw

2018-04-01

In this paper, we study a class of generalized differential hemivariational inequalities of parabolic type involving the time fractional order derivative operator in Banach spaces. We use the Rothe method combined with surjectivity of multivalued pseudomonotone operators and properties of the Clarke generalized gradient to establish existence of solution to the abstract inequality. As an illustrative application, a frictional quasistatic contact problem for viscoelastic materials with adhesion is investigated, in which the friction and contact conditions are described by the Clarke generalized gradient of nonconvex and nonsmooth functionals, and the constitutive relation is modeled by the fractional Kelvin-Voigt law.

Optically tunable spontaneous Raman fluorescence from a single self-assembled InGaAs quantum dot.

PubMed

Fernandez, G; Volz, T; Desbuquois, R; Badolato, A; Imamoglu, A

2009-08-21

We report the observation of all-optically tunable Raman fluorescence from a single quantum dot. The Raman photons are produced in an optically driven Lambda system defined by subjecting the single electron charged quantum dot to a magnetic field in Voigt geometry. Detuning the driving laser from resonance, we tune the frequency of the Raman photons by about 2.5 GHz. The number of scattered photons and the linewidth of the Raman photons are investigated as a function of detuning. The study presented here could form the basis of a new technique for investigating spin-bath interactions in the solid state.

A model for longitudinal and shear wave propagation in viscoelastic media

PubMed

Szabo; Wu

2000-05-01

Relaxation models fail to predict and explain loss characteristics of many viscoelastic materials which follow a frequency power law. A model based on a time-domain statement of causality is presented that describes observed power-law behavior of many viscoelastic materials. A Hooke's law is derived from power-law loss characteristics; it reduces to the Hooke's law for the Voigt model for the specific case of quadratic frequency loss. Broadband loss and velocity data for both longitudinal and shear elastic types of waves agree well with predictions. These acoustic loss models are compared to theories for loss mechanisms in dielectrics based on isolated polar molecules and cooperative interactions.

General magnetic transition dipole moments for electron paramagnetic resonance.

PubMed

Nehrkorn, Joscha; Schnegg, Alexander; Holldack, Karsten; Stoll, Stefan

2015-01-09

We present general expressions for the magnetic transition rates in electron paramagnetic resonance (EPR) experiments of anisotropic spin systems in the solid state. The expressions apply to general spin centers and arbitrary excitation geometry (Voigt, Faraday, and intermediate). They work for linear and circular polarized as well as unpolarized excitation, and for crystals and powders. The expressions are based on the concept of the (complex) magnetic transition dipole moment vector. Using the new theory, we determine the parities of ground and excited spin states of high-spin (S=5/2) Fe(III) in hemin from the polarization dependence of experimental EPR line intensities.

Nonlinear deformation of composites with consideration of the effect of couple-stresses

NASA Astrophysics Data System (ADS)

Lagzdiņš, A.; Teters, G.; Zilaucs, A.

1998-09-01

Nonlinear deformation of spatially reinforced composites under active loading (without unloading) is considered. All the theoretical constructions are based on the experimental data on unidirectional and ±π/4 cross-ply epoxy plastics reinforced with glass fibers. Based on the elastic properties of the fibers and EDT-10 epoxy binder, the linear elastic characteristics of a transversely isotropic unidirectionally reinforced fiberglass plastic are found, whereas the nonlinear characteristics are obtained from experiments. For calculating the deformation properties of the ±π/4 cross-ply plastic, a refined version of the Voigt method is applied taking into account also the couple-stresses arising in the composite due to relative rotation of the reinforcement fibers. In addition, a fourth-rank damage tensor is introduced in order to account for the impact of fracture caused by the couple-stresses. The unknown constants are found from the experimental uniaxial tension curve for the cross-ply composite. The comparison between the computed curves and experimental data for other loading paths shows that the description of the nonlinear behavior of composites can be improved by considering the effect of couple-stresses generated by rotations of the reinforcing fibers.

H2-broadening, shifting and mixing coefficients of the doublets in the ν2 and ν4 bands of PH3 at room temperature

NASA Astrophysics Data System (ADS)

Salem, Jamel; Blanquet, Ghislain; Lepère, Muriel; Younes, Rached ben

2018-05-01

The broadening, shifting and mixing coefficients of the doublet spectral lines in the ν2 and ν4 bands of PH3 perturbed by H2 have been determined at room temperature. Indeed, the collisional spectroscopic parameters: intensities, line widths, line shifts and line mixing parameters, are all grouped together in the collisional relaxation matrix. To analyse the collisional process and physical effects on spectra of phosphine (PH3), we have used the measurements carried out using a tunable diode-laser spectrometer in the ν2 and ν4 bands of PH3 perturbed by hydrogen (H2) at room temperature. The recorded spectra are fitted by the Voigt profile and the speed-dependent uncorrelated hard collision model of Rautian and Sobelman. These profiles are developed in the studies of isolated lines and are modified to account for the line mixing effects in the overlapping lines. The line widths, line shifts and line mixing parameters are given for six A1 and A2 doublet lines with quantum numbers K = 3n, (n = 1, 2, …) and overlapped by collisional broadening at pressures of less than 50 mbar.

Radiation transport in kinetic simulations and the influence of photoemission on electron current in self-sustaining discharges

DOE PAGES

Fierro, Andrew S.; Moore, Christopher Hudson; Scheiner, Brett; ...

2017-01-12

A kinetic description for electronic excitation of helium for principal quantum number nmore » $$\\leqslant $$ 4 has been included into a particle-in-cell (PIC) simulation utilizing direct simulation Monte Carlo (DSMC) for electron-neutral interactions. The excited electronic levels radiate state-dependent photons with wavelengths from the extreme ultraviolet (EUV) to visible regimes. Photon wavelengths are chosen according to a Voigt distribution accounting for the natural, pressure, and Doppler broadened linewidths. This method allows for reconstruction of the emission spectrum for a non-thermalized electron energy distribution function (EEDF) and investigation of high energy photon effects on surfaces, specifically photoemission. A parallel plate discharge with a fixed field (i.e. space charge neglected) is used to investigate the effects of including photoemission for a Townsend discharge. When operating at a voltage near the self-sustaining discharge threshold, it is observed that the electron current into the anode is higher when including photoemission from the cathode than without even when accounting for self-absorption from ground state atoms. As a result, the photocurrent has been observed to account for as much as 20% of the total current from the cathode under steady-state conditions.« less

Measurements of high-pressure CO2 absorption near 2.0 μm and implications on tunable diode laser sensor design

NASA Astrophysics Data System (ADS)

Rieker, G. B.; Jeffries, J. B.; Hanson, R. K.

2009-01-01

A tunable diode laser (TDL) is used to measure the absorption spectra of the R46 through R54 transitions of the 20012 ←00001 band of CO2 near 2.0 μm (5000 cm-1) at room temperature and pressures to 10 atm (densities to 9.2 amagat). Spectra are recorded using direct absorption spectroscopy and wavelength modulation spectroscopy with second-harmonic detection (WMS-2f) in a mixture containing 11% CO2 in air. The direct absorption spectra are influenced by non-Lorentzian effects including finite-duration collisions which perturb far-wing absorption, and an empirical χ-function correction to the Voigt line shape is shown to greatly reduce error in the spectral model. WMS-2f spectra are shown to be at least a factor of four less-influenced by non-Lorentzian effects in this region, making this approach more resistant to errors in the far-wing line shape model and allowing a comparison between the spectral parameters of HITRAN and a new database which includes pressure-induced shift coefficients. The implications of these measurements on practical, high-pressure CO2 sensor design are discussed.

Hard tissue as a composite material. I - Bounds on the elastic behavior.

NASA Technical Reports Server (NTRS)

Katz, J. L.

1971-01-01

Recent determination of the elastic moduli of hydroxyapatite by ultrasonic methods permits a re-examination of the Voigt or parallel model of the elastic behavior of bone, as a two phase composite material. It is shown that such a model alone cannot be used to describe the behavior of bone. Correlative data on the elastic moduli of dentin, enamel and various bone samples indicate the existence of a nonlinear dependence of elastic moduli on composition of hard tissue. Several composite models are used to calculate the bounds on the elastic behavior of these tissues. The limitations of these models are described, and experiments to obtain additional critical data are discussed.

Accuracy analysis of automodel solutions for Lévy flight-based transport: from resonance radiative transfer to a simple general model

NASA Astrophysics Data System (ADS)

Kukushkin, A. B.; Sdvizhenskii, P. A.

2017-12-01

The results of accuracy analysis of automodel solutions for Lévy flight-based transport on a uniform background are presented. These approximate solutions have been obtained for Green’s function of the following equations: the non-stationary Biberman-Holstein equation for three-dimensional (3D) radiative transfer in plasma and gases, for various (Doppler, Lorentz, Voigt and Holtsmark) spectral line shapes, and the 1D transport equation with a simple longtailed step-length probability distribution function with various power-law exponents. The results suggest the possibility of substantial extension of the developed method of automodel solution to other fields far beyond physics.

Introduction to Voigt's wind power plant. [energy conversion efficiency

NASA Technical Reports Server (NTRS)

Tompkin, J.

1973-01-01

The design and operation of a 100 kilowatt wind driven generator are reported. Its high speed three-bladed turbine operates at a height of 50 meters. Blades are rigidly connected to the hub and turbine revolutions change linearly with wind velocity, maintaining a constant speed ratio of blade tip velocity to wind velocity over the full predetermined wind range. Three generators installed in the gondola generate either dc or ac current. Based on local wind conditions, the device has a maximum output of 720 kilowatts at a wind velocity of 16 meters per second. Total electrical capacity is 750 kilowatts, and power output per year is 2,135,000 kilowatt/hours.

Interactive Spectral Analysis and Computation (ISAAC)

NASA Technical Reports Server (NTRS)

Lytle, D. M.

1992-01-01

Isaac is a task in the NSO external package for IRAF. A descendant of a FORTRAN program written to analyze data from a Fourier transform spectrometer, the current implementation has been generalized sufficiently to make it useful for general spectral analysis and other one dimensional data analysis tasks. The user interface for Isaac is implemented as an interpreted mini-language containing a powerful, programmable vector calculator. Built-in commands provide much of the functionality needed to produce accurate line lists from input spectra. These built-in functions include automated spectral line finding, least squares fitting of Voigt profiles to spectral lines including equality constraints, various filters including an optimal filter construction tool, continuum fitting, and various I/O functions.

ExoCross: Spectra from molecular line lists

NASA Astrophysics Data System (ADS)

Yurchenko, Sergei N.; Al-Refaie, Ahmed; Tennyson, Jonathan

2018-03-01

ExoCross generates spectra and thermodynamic properties from molecular line lists in ExoMol, HITRAN, or several other formats. The code is parallelized and also shows a high degree of vectorization; it works with line profiles such as Doppler, Lorentzian and Voigt and supports several broadening schemes. ExoCross is also capable of working with the recently proposed method of super-lines. It supports calculations of lifetimes, cooling functions, specific heats and other properties. ExoCross converts between different formats, such as HITRAN, ExoMol and Phoenix, and simulates non-LTE spectra using a simple two-temperature approach. Different electronic, vibronic or vibrational bands can be simulated separately using an efficient filtering scheme based on the quantum numbers.

Fractional Derivative Models for Ultrasonic Characterization of Polymer and Breast Tissue Viscoelasticity

PubMed Central

Coussot, Cecile; Kalyanam, Sureshkumar; Yapp, Rebecca; Insana, Michael F.

2009-01-01

The viscoelastic response of hydropolymers, which include glandular breast tissues, may be accurately characterized for some applications with as few as 3 rheological parameters by applying the Kelvin-Voigt fractional derivative (KVFD) modeling approach. We describe a technique for ultrasonic imaging of KVFD parameters in media undergoing unconfined, quasi-static, uniaxial compression. We analyze the KVFD parameter values in simulated and experimental echo data acquired from phantoms and show that the KVFD parameters may concisely characterize the viscoelastic properties of hydropolymers. We then interpret the KVFD parameter values for normal and cancerous breast tissues and hypothesize that this modeling approach may ultimately be applied to tumor differentiation. PMID:19406700

Linking strain anisotropy and plasticity in copper metallization

DOE Office of Scientific and Technical Information (OSTI.GOV)

Murray, Conal E., E-mail: conal@us.ibm.com; Jordan-Sweet, Jean; Priyadarshini, Deepika

2015-05-04

The elastic anisotropy of copper leads to significant variation in the x-ray elastic constants (XEC), which link diffraction-based strain measurements to stress. An accurate depiction of the mechanical response in copper thin films requires a determination of an appropriate grain interaction model that lies between Voigt and Reuss limits. It is shown that the associated XEC weighting fraction, x*, between these limits provides a metric by which strain anisotropy can be quantified. Experimental values of x*, as determined by a linear regression scheme of diffraction data collected from multiple reflections, reveal the degree of strain anisotropy and its dependence onmore » plastic deformation induced during in-situ and ex-situ thermal treatments.« less

Wall-collision line broadening of molecular oxygen within nanoporous materials

DOE Office of Scientific and Technical Information (OSTI.GOV)

Xu, Can T.; Lewander, Maerta; Andersson-Engels, Stefan

2011-10-15

Wall-collision broadening of near-infrared absorption lines of molecular oxygen confined in nanoporous zirconia is studied by employing high-resolution diode-laser spectroscopy. The broadening is studied for pores of different sizes under a range of pressures, providing new insights on how wall collisions and intermolecular collisions influence the total spectroscopic line profile. The pressure series show that wall-collision broadening is relatively more prominent under reduced pressures, enabling sensitive means to probe pore sizes of porous materials. In addition, we show that the total wall-collision-broadened profile strongly deviates from a Voigt profile and that wall-collision broadening exhibits an additive-like behavior to the pressuremore » and Doppler broadening.« less

Optimizing the Mass-Specific Activity of Bilirubin Oxidase Adlayers through Combined Electrochemical Quartz Crystal Microbalance and Dual Polarization Interferometry Analyses.

PubMed

McArdle, Trevor; McNamara, Thomas P; Fei, Fan; Singh, Kulveer; Blanford, Christopher F

2015-11-18

Two surface analysis techniques, dual polarization interferometry (DPI) and analysis by an electrochemical quartz crystal microbalance with dissipation capability (E-QCM-D), were paired to find the deposition conditions that give the highest and most stable electrocatalytic activity per adsorbed mass of enzyme. Layers were formed by adsorption from buffered solutions of bilirubin oxidase from Myrothecium verrucaria at pH 6.0 to planar surfaces, under high enzyme loading (≥1 mg mL(-1)) for contact periods of up to 2 min. Both unmodified and carboxylate-functionalized gold-coated sensors showed that a deposition solution concentration of 10-25 mg mL(-1) gave the highest activity per mass of adsorbed enzyme with an effective catalytic rate constant (k(cat)) of about 60 s(-1). The densification of adsorbed layers observed by DPI correlated with reduced bioactivity observed by parallel E-QCM-D measurements. Postadsorption changes in thickness and density observed by DPI were incorporated into Kelvin-Voigt models of the QCM-D response. The modeled response matched experimental observations when the adlayer viscosity tripled after adsorption.

Atmospheric and surface temperatures and airborne dust amounts during late southern summer from Mariner 9 IRIS data

NASA Technical Reports Server (NTRS)

Santee, M.; Crisp, D.

1992-01-01

The temperature structure and dust loading of the Martian atmosphere are investigated using thermal emission spectra recorded in 1972 by the Mariner 9 infrared interferometer spectrometer (IRIS). The analysis focuses on a subset of data consisting of approximately 2400 spectra obtained near the end of the southern summer season (L(sub s) equal to 343 deg to 348 deg), after the global dust storm had largely abated and airborne dust amounts were subsiding to background values. Simultaneous retrieval of the vertical distribution of both atmospheric temperature and dust optical depth is accomplished through an iterative procedure which is performed on each individual spectrum. The atmospheric transmittances are calculated using a Voigt quasi-random band model, which includes absorption by CO2 and dust, but neglects the effects of multiple scattering. Vertical profiles of temperature and dust optical depth are obtained using modified algorithms. These profiles are used to construct global maps of temperature and dust optical depth as functions of latitude (+/- 90 deg), altitude (approximately 0-50 km), and local time of day.

Chemical state analysis of Cl Kα and Kβ1,3 X-ray emission lines using polychromatic WDXRF spectrometer

NASA Astrophysics Data System (ADS)

Kainth, Harpreet Singh; Upmanyu, Arun; Sharma, Hitesh; Singh, Tejbir; Kumar, Sanjeev

2018-02-01

With the support of research projects focusing on sampling and data analysing of different varieties of chemical compounds, wavelength dispersive X-ray fluorescence (WDXRF) technique is commonly used in many research laboratories throughout the world wide to determine the elemental composition of various unknown samples. In the present study, first time we have employed polychromatic S8 TIGER WDXRF spectrometer to study the chemical state analysis in Cl Kα and Kβ1,3 X-ray emission lines. A Voigt function is used to determine the central peak position of the K shell emission lines in all samples. From the present measurements, it is seen that both positive and negative shifts have been observed in Cl Kα (2.622 keV) and Kβ1,3 (2.817 keV) emission peaks. It has been also seen that the effective charge, relative line-width and relative intensity ratio I(Kβ1,3/Kα) are found proportional with the chemical shift. Furthermore, a parabolic relation is also established between them.

The Effect of AGN Heating on the Low-redshift Lyα Forest

NASA Astrophysics Data System (ADS)

Gurvich, Alex; Burkhart, Blakesley; Bird, Simeon

2017-02-01

We investigate the effects of AGN heating and the ultraviolet background on the low-redshift Lyα forest column density distribution (CDD) using the Illustris simulation. We show that Illustris reproduces observations at z = 0.1 in the column density range {10}12.5{--}{10}13.5 cm-2, relevant for the “photon underproduction crisis.” We attribute this to the inclusion of AGN feedback, which changes the gas distribution so as to mimic the effect of extra photons, as well as the use of the Faucher-Giguère ultraviolet background, which is more ionizing at z = 0.1 than the Haardt & Madau background previously considered. We show that the difference between simulations run with smoothed particle hydrodynamics and simulations using a moving mesh is small in this column density range but can be more significant at larger column densities. We further consider the effect of supernova feedback, Voigt profile fitting, and finite resolution, all of which we show to have little influence on the CDD. Finally, we identify a discrepancy between our simulations and observations at column densities {10}14{--}{10}16 cm-2, where Illustris produces too few absorbers, which suggests the AGN feedback model should be further refined. Since the “photon underproduction crisis” primarily affects lower column density systems, we conclude that AGN feedback and standard ionizing background models can resolve the crisis.

A new peak detection algorithm for MALDI mass spectrometry data based on a modified Asymmetric Pseudo-Voigt model.

PubMed

Wijetunge, Chalini D; Saeed, Isaam; Boughton, Berin A; Roessner, Ute; Halgamuge, Saman K

2015-01-01

Mass Spectrometry (MS) is a ubiquitous analytical tool in biological research and is used to measure the mass-to-charge ratio of bio-molecules. Peak detection is the essential first step in MS data analysis. Precise estimation of peak parameters such as peak summit location and peak area are critical to identify underlying bio-molecules and to estimate their abundances accurately. We propose a new method to detect and quantify peaks in mass spectra. It uses dual-tree complex wavelet transformation along with Stein's unbiased risk estimator for spectra smoothing. Then, a new method, based on the modified Asymmetric Pseudo-Voigt (mAPV) model and hierarchical particle swarm optimization, is used for peak parameter estimation. Using simulated data, we demonstrated the benefit of using the mAPV model over Gaussian, Lorentz and Bi-Gaussian functions for MS peak modelling. The proposed mAPV model achieved the best fitting accuracy for asymmetric peaks, with lower percentage errors in peak summit location estimation, which were 0.17% to 4.46% less than that of the other models. It also outperformed the other models in peak area estimation, delivering lower percentage errors, which were about 0.7% less than its closest competitor - the Bi-Gaussian model. In addition, using data generated from a MALDI-TOF computer model, we showed that the proposed overall algorithm outperformed the existing methods mainly in terms of sensitivity. It achieved a sensitivity of 85%, compared to 77% and 71% of the two benchmark algorithms, continuous wavelet transformation based method and Cromwell respectively. The proposed algorithm is particularly useful for peak detection and parameter estimation in MS data with overlapping peak distributions and asymmetric peaks. The algorithm is implemented using MATLAB and the source code is freely available at http://mapv.sourceforge.net.

VizieR Online Data Catalog: Bidelman-Parsons Spectroscopic/Bibliographic Cat (Parsons+ 1980)

NASA Astrophysics Data System (ADS)

Parsons, S. B.; Buta, N. S.; Bidelman, W. P.

1996-11-01

The Bidelman-Parsons Spectroscopic and Bibliographical Catalog (BPSB; Parsons, Buta, and Bidelman 1980a, b) contains data compiled from the astronomical literature by W. P. Bidelman. These data include diverse catalogs and lists, especially from pre-1950 journals (minor as well as major), and from pre-1962 observatory publications. From more recent years, the data on any object frequently are limited to one item with a reference; for example, a spectral type. No data published after 1973 are included. Over 200 publications are represented. The BPSB has information on 40,312 objects. The catalog contains most of the same information on MK spectral types as the Catalogue of Stellar Spectra Classified in the Morgan-Keenan System (Jaschek, Conde, and de Sierra 1964) and its updates, but it also includes such items as spectral types without a luminosity class (certainly better than nothing); spectroscopic absolute magnitudes; notes on multiplicity; notes on high proper motion or radial velocity (with the values, if probably variable, or if greater than 60 km/s); unpublished remarks and spectral types from several sources, including Bidelman and Henize; and Bidelman's preliminary identifications of many sources in the Two-Micron Sky Survey (Neugebauer and Leighton 1969). Some of the longer lists included in the catalog are those of OB stars from the Tonantzintla-Tacubaya and Heidelberg-Koenigstuhl surveys (Iriarte and Chavira 1957; Chavira 1958; Klare and Szeidl 1966); that of OB stars with emission from the Case-Hamburg surveys (Hardorp et al. 1959; Stock, Nassau, and Stephenson 1960; Hardorp, Theile, and Voigt 1964; Nassau and Stephenson 1963; Hardorp, Theile, and Voigt 1965; Nassau, Stephenson, and MacConnell 1965; Stephenson and Sanduleak 1971); and stars from the General Catalogue of Variable Stars (Kukarkin et al. 1969); and the Catalogue of Suspected Variable Stars (Kukarkin et al. 1951, 1965). Although the catalog is mainly of stellar data, it includes many galactic nebulae of various kinds. (3 data files).

A new peak detection algorithm for MALDI mass spectrometry data based on a modified Asymmetric Pseudo-Voigt model

PubMed Central

2015-01-01

Background Mass Spectrometry (MS) is a ubiquitous analytical tool in biological research and is used to measure the mass-to-charge ratio of bio-molecules. Peak detection is the essential first step in MS data analysis. Precise estimation of peak parameters such as peak summit location and peak area are critical to identify underlying bio-molecules and to estimate their abundances accurately. We propose a new method to detect and quantify peaks in mass spectra. It uses dual-tree complex wavelet transformation along with Stein's unbiased risk estimator for spectra smoothing. Then, a new method, based on the modified Asymmetric Pseudo-Voigt (mAPV) model and hierarchical particle swarm optimization, is used for peak parameter estimation. Results Using simulated data, we demonstrated the benefit of using the mAPV model over Gaussian, Lorentz and Bi-Gaussian functions for MS peak modelling. The proposed mAPV model achieved the best fitting accuracy for asymmetric peaks, with lower percentage errors in peak summit location estimation, which were 0.17% to 4.46% less than that of the other models. It also outperformed the other models in peak area estimation, delivering lower percentage errors, which were about 0.7% less than its closest competitor - the Bi-Gaussian model. In addition, using data generated from a MALDI-TOF computer model, we showed that the proposed overall algorithm outperformed the existing methods mainly in terms of sensitivity. It achieved a sensitivity of 85%, compared to 77% and 71% of the two benchmark algorithms, continuous wavelet transformation based method and Cromwell respectively. Conclusions The proposed algorithm is particularly useful for peak detection and parameter estimation in MS data with overlapping peak distributions and asymmetric peaks. The algorithm is implemented using MATLAB and the source code is freely available at http://mapv.sourceforge.net. PMID:26680279

A high resolution spectroscopic study of the oxygen molecule. Ph.D. Thesis Final Report

NASA Technical Reports Server (NTRS)

Ritter, K. J.

1984-01-01

A high resolution spectrometer which incorporates a narrow line width tunable dye laser was used to make absorption profiles of 57 spectral lines in the Oxygen A-Band at pressures up to one atmosphere in pure O2. The observed line profiles are compared to the Voigt, and a collisionally narrowed, profile using a least squares fitting procedure. The collisionally narrowed profile compares more favorable to the observed profiles. Values of the line strengths and self broadening coeffiencients, determined from the least square fitting process, are presented in tabular form. It is found that the experssion by Watson are in closest agreement with the experimentally determined strengths. The self broadening coefficients are compared with the measurements of several other investigators.

Transition dipole-moment of the ν1 +ν3 band of acetylene measured with dual-comb Fourier-transform spectroscopy

NASA Astrophysics Data System (ADS)

Okubo, Sho; Iwakuni, Kana; Yamada, Koichi M. T.; Inaba, Hajime; Onae, Atsushi; Hong, Feng-Lei; Sasada, Hiroyuki

2017-11-01

The ν1 +ν3 vibration band of acetylene (C2H2) in the near infrared region was recorded with a dual-comb Fourier-transform spectrometer. We observed 56 transitions from P (26) to R (29) at six different column densities. The integral line intensity was determined for each recorded absorption line by fitting the line profile to Lambert-Beer's law with a Voigt function. Thanks to the outstanding capability of dual-comb spectroscopy to cover a broad spectrum in a relatively short time with high resolution and high frequency precision, we determined the reliable line strength for each ro-vibrational transition as well as the transition dipole moment for this band.

Computational methods for the identification of spatially varying stiffness and damping in beams

NASA Technical Reports Server (NTRS)

Banks, H. T.; Rosen, I. G.

1986-01-01

A numerical approximation scheme for the estimation of functional parameters in Euler-Bernoulli models for the transverse vibration of flexible beams with tip bodies is developed. The method permits the identification of spatially varying flexural stiffness and Voigt-Kelvin viscoelastic damping coefficients which appear in the hybrid system of ordinary and partial differential equations and boundary conditions describing the dynamics of such structures. An inverse problem is formulated as a least squares fit to data subject to constraints in the form of a vector system of abstract first order evolution equations. Spline-based finite element approximations are used to finite dimensionalize the problem. Theoretical convergence results are given and numerical studies carried out on both conventional (serial) and vector computers are discussed.

Generalized viscothermoelasticity theory of dual-phase-lagging model for damping analysis in circular micro-plate resonators

NASA Astrophysics Data System (ADS)

Grover, D.; Seth, R. K.

2018-05-01

Analysis and numerical results are presented for the thermoelastic dissipation of a homogeneous isotropic, thermally conducting, Kelvin-Voigt type circular micro-plate based on Kirchhoff's Love plate theory utilizing generalized viscothermoelasticity theory of dual-phase-lagging model. The analytical expressions for thermoelastic damping of vibration and frequency shift are obtained for generalized dual-phase-lagging model and coupled viscothermoelastic plates. The scaled thermoelastic damping has been illustrated in case of circular plate and axisymmetric circular plate for fixed aspect ratio for clamped and simply supported boundary conditions. It is observed that the damping of vibrations significantly depend on time delay and mechanical relaxation times in addition to thermo-mechanical coupling in circular plate under resonance conditions and plate dimensions.

Photonic Shape Memory Polymer with Stable Multiple Colors

PubMed Central

2017-01-01

A photonic shape memory polymer film that shows large color response (∼155 nm) in a wide temperature range has been fabricated from a semi-interpenetrating network of a cholesteric polymer and poly(benzyl acrylate). The large color response is achieved by mechanical embossing of the photonic film above its broad glass transition temperature. The embossed film, as it recovers to its original shape on heating through the broad thermal transition, exhibits multiple structural colors ranging from blue to orange. The relaxation behavior of the embossed film can be fully described using a Kelvin–Voigt model, which reveals that the influence of temperature on the generation of colors is much stronger than that of time, thereby producing stable multiple colors. PMID:28840717

On the convergence of a fully discrete scheme of LES type to physically relevant solutions of the incompressible Navier-Stokes

NASA Astrophysics Data System (ADS)

Berselli, Luigi C.; Spirito, Stefano

2018-06-01

Obtaining reliable numerical simulations of turbulent fluids is a challenging problem in computational fluid mechanics. The large eddy simulation (LES) models are efficient tools to approximate turbulent fluids, and an important step in the validation of these models is the ability to reproduce relevant properties of the flow. In this paper, we consider a fully discrete approximation of the Navier-Stokes-Voigt model by an implicit Euler algorithm (with respect to the time variable) and a Fourier-Galerkin method (in the space variables). We prove the convergence to weak solutions of the incompressible Navier-Stokes equations satisfying the natural local entropy condition, hence selecting the so-called physically relevant solutions.

Middle atmosphere project: A radiative heating and cooling algorithm for a numerical model of the large scale stratospheric circulation

NASA Technical Reports Server (NTRS)

Wehrbein, W. M.; Leovy, C. B.

1981-01-01

A Curtis matrix is used to compute cooling by the 15 micron and 10 micron bands of carbon dioxide. Escape of radiation to space and exchange the lower boundary are used for the 9.6 micron band of ozone. Voigt line shape, vibrational relaxation, line overlap, and the temperature dependence of line strength distributions and transmission functions are incorporated into the Curtis matrices. The distributions of the atmospheric constituents included in the algorithm, and the method used to compute the Curtis matrices are discussed as well as cooling or heating by the 9.6 micron band of ozone. The FORTRAN programs and subroutines that were developed are described and listed.

Fluid-structure interaction with pipe-wall viscoelasticity during water hammer

NASA Astrophysics Data System (ADS)

Keramat, A.; Tijsseling, A. S.; Hou, Q.; Ahmadi, A.

2012-01-01

Fluid-structure interaction (FSI) due to water hammer in a pipeline which has viscoelastic wall behaviour is studied. Appropriate governing equations are derived and numerically solved. In the numerical implementation of the hydraulic and structural equations, viscoelasticity is incorporated using the Kelvin-Voigt mechanical model. The equations are solved by two different approaches, namely the Method of Characteristics-Finite Element Method (MOC-FEM) and full MOC. In both approaches two important effects of FSI in fluid-filled pipes, namely Poisson and junction coupling, are taken into account. The study proposes a more comprehensive model for studying fluid transients in pipelines as compared to previous works, which take into account either FSI or viscoelasticity. To verify the proposed mathematical model and its numerical solutions, the following problems are investigated: axial vibration of a viscoelastic bar subjected to a step uniaxial loading, FSI in an elastic pipe, and hydraulic transients in a pressurised polyethylene pipe without FSI. The results of each case are checked with available exact and experimental results. Then, to study the simultaneous effects of FSI and viscoelasticity, which is the new element of the present research, one problem is solved by the two different numerical approaches. Both numerical methods give the same results, thus confirming the correctness of the solutions.

Computing dispersion curves of elastic/viscoelastic transversely-isotropic bone plates coupled with soft tissue and marrow using semi-analytical finite element (SAFE) method.

PubMed

Nguyen, Vu-Hieu; Tran, Tho N H T; Sacchi, Mauricio D; Naili, Salah; Le, Lawrence H

2017-08-01

We present a semi-analytical finite element (SAFE) scheme for accurately computing the velocity dispersion and attenuation in a trilayered system consisting of a transversely-isotropic (TI) cortical bone plate sandwiched between the soft tissue and marrow layers. The soft tissue and marrow are mimicked by two fluid layers of finite thickness. A Kelvin-Voigt model accounts for the absorption of all three biological domains. The simulated dispersion curves are validated by the results from the commercial software DISPERSE and published literature. Finally, the algorithm is applied to a viscoelastic trilayered TI bone model to interpret the guided modes of an ex-vivo experimental data set from a bone phantom. Copyright © 2017 Elsevier Ltd. All rights reserved.

Ultrasound shear wave simulation based on nonlinear wave propagation and Wigner-Ville Distribution analysis

NASA Astrophysics Data System (ADS)

Bidari, Pooya Sobhe; Alirezaie, Javad; Tavakkoli, Jahan

2017-03-01

This paper presents a method for modeling and simulation of shear wave generation from a nonlinear Acoustic Radiation Force Impulse (ARFI) that is considered as a distributed force applied at the focal region of a HIFU transducer radiating in nonlinear regime. The shear wave propagation is simulated by solving the Navier's equation from the distributed nonlinear ARFI as the source of the shear wave. Then, the Wigner-Ville Distribution (WVD) as a time-frequency analysis method is used to detect the shear wave at different local points in the region of interest. The WVD results in an estimation of the shear wave time of arrival, its mean frequency and local attenuation which can be utilized to estimate medium's shear modulus and shear viscosity using the Voigt model.

First principles predictions of electronic and elastic properties of BaPb2As2 in the ThCr2Si2-type structure

NASA Astrophysics Data System (ADS)

Bourourou, Y.; Amari, S.; Yahiaoui, I. E.; Bouhafs, B.

2018-01-01

A first-principles approach is used to predicts the electronic and elastic properties of BaPb2As2 superconductor compound, using full-potential linearized augmented plane wave plus local orbitals (FP-L/APW+lo) scheme within the local density approximation LDA. The calculated equilibrium structural parameter a agree well with the experiment while the c/a ratio is far away from the experimental result. The band structure, density of states, together with the charge density and chemical bonding are discussed. The calculated elastic constants for our compound indicate that it is mechanically stable at ambient pressure. Polycrystalline elastic moduli (Young's, Bulk, shear Modulus and the Poisson's ratio) were calculated according to the Voigte-Reusse-Hill (VRH) average.

Support the Design of Improved IUE NEWSIPS High Dispersion Extraction Algorithms: Improved IUE High Dispersion Extraction Algorithms

NASA Technical Reports Server (NTRS)

Lawton, Pat

2004-01-01

The objective of this work was to support the design of improved IUE NEWSIPS high dispersion extraction algorithms. The purpose of this work was to evaluate use of the Linearized Image (LIHI) file versus the Re-Sampled Image (SIHI) file, evaluate various extraction, and design algorithms for evaluation of IUE High Dispersion spectra. It was concluded the use of the Re-Sampled Image (SIHI) file was acceptable. Since the Gaussian profile worked well for the core and the Lorentzian profile worked well for the wings, the Voigt profile was chosen for use in the extraction algorithm. It was found that the gamma and sigma parameters varied significantly across the detector, so gamma and sigma masks for the SWP detector were developed. Extraction code was written.

Elastic properties of uniaxial-fiber reinforced composites - General features

NASA Astrophysics Data System (ADS)

Datta, Subhendu; Ledbetter, Hassel; Lei, Ming

The salient features of the elastic properties of uniaxial-fiber-reinforced composites are examined by considering the complete set of elastic constants of composites comprising isotropic uniaxial fibers in an isotropic matrix. Such materials exhibit transverse-isotropic symmetry and five independent elastic constants in Voigt notation: C(11), C(33), C(44), C(66), and C(13). These C(ij) constants are calculated over the entire fiber-volume-fraction range 0.0-1.0, using a scattered-plane-wave ensemple-average model. Some practical elastic constants such as the principal Young moduli and the principal Poisson ratios are considered, and the behavior of these constants is discussed. Also presented are the results for the four principal sound velocities used to study uniaxial-fiber-reinforced composites: v(11), v(33), v(12), and v(13).

Mid infrared quantum cascade laser operating in pure amplitude modulation for background-free trace gas spectroscopy.

PubMed

Bidaux, Yves; Bismuto, Alfredo; Patimisco, Pietro; Sampaolo, Angelo; Gresch, Tobias; Strubi, Gregory; Blaser, Stéphane; Tittel, Frank K; Spagnolo, Vincenzo; Muller, Antoine; Faist, Jérôme

2016-11-14

We present a single mode multi-section quantum cascade laser source composed of three different sections: master oscillator, gain and phase section. Non-uniform pumping of the QCL's gain reveals that the various laser sections are strongly coupled. Simulations of the electronic and optical properties of the laser (based on the density matrix and scattering matrix formalisms, respectively) were performed and a good agreement with measurements is obtained. In particular, a pure modulation of the laser output power can be achieved. This capability of the device is applied in tunable-laser spectroscopy of N₂O where background-free quartz enhanced photo acoustic spectral scans with nearly perfect Voigt line shapes for the selected absorption line are obtained.

Rheological properties of kuzu starch pastes with galactomannans.

PubMed

Jóźwiak, Bertrand; Orczykowska, Magdalena; Dziubiński, Marek

2018-04-01

The paper describes the effects of galactomannans on viscoelastic properties of commercial Japanese white kuzu starch pastes. The study included morphological, thermal and rheological analyses of the biopolymer. The results obtained in the form of storage modulus G '( ω ) and loss modulus G ″( ω ) were described by the modified fractional Kelvin-Voigt model with two springpot-type elements, created on the basis of differential calculus of fractional order and Fourier transform. It allowed to determine 17 material parameters providing a lot of additional information about structure and viscoelastic properties of the biopolymer in comparison to the classical analysis of oscillatory and creep tests. The study led to the conclusion that commercial Japanese white kuzu starch was so-called type II starch with a high pasting temperature of 75 °C and an average granule diameter equal to 10.9 μm. Rheological properties of the pastes depended on the galactose-to-mannose ratio in galactomannan molecule. The larger substitution degree, the higher viscosity, characteristic relaxation times, polydispersity index, gel stiffness, and the lower cross-linking density and average molecular weights. The presence of galactose side groups favored the hydration and immobilization of water molecules.

Suppression of shocked-bubble expansion due to tissue confinement with application to shock-wave lithotripsy

PubMed Central

Freund, Jonathan B.

2008-01-01

Estimates are made of the effect of tissue confinement on the response of small bubbles subjected to lithotriptor shock pressures. To do this the Rayleigh–Plesset equation, which governs the dynamics of spherical bubbles, is generalized to treat a bubble in a liquid region (blood), which is in turn encased within an elastic membrane (like a vessel’s basement membrane), beyond which a Voigt viscoelastic material models the exterior tissue. Material properties are estimated from a range of measurements available for kidneys and similar soft tissues. Special attention is given to the constitutive modeling of the basement membranes because of their expected importance due to their proximity to the bubble and their toughness. It is found that the highest expected values for the elasticity of the membrane and surrounding tissue are insufficient to suppress bubble growth. The reduced confinement of a cylindrical vessel should not alter this conclusion. Tissue viscosities taken from ultrasound measurements suppress bubble growth somewhat, though not to a degree expected to resist injury. However, the higher reported viscosities measured by other means, which are arguably more relevant to the deformations caused by growing bubbles, do indeed significantly suppress bubble expansion. PMID:18529202

Suppression of shocked-bubble expansion due to tissue confinement with application to shock-wave lithotripsy.

PubMed

Freund, Jonathan B

2008-05-01

Estimates are made of the effect of tissue confinement on the response of small bubbles subjected to lithotriptor shock pressures. To do this the Rayleigh-Plesset equation, which governs the dynamics of spherical bubbles, is generalized to treat a bubble in a liquid region (blood), which is in turn encased within an elastic membrane (like a vessel's basement membrane), beyond which a Voigt viscoelastic material models the exterior tissue. Material properties are estimated from a range of measurements available for kidneys and similar soft tissues. Special attention is given to the constitutive modeling of the basement membranes because of their expected importance due to their proximity to the bubble and their toughness. It is found that the highest expected values for the elasticity of the membrane and surrounding tissue are insufficient to suppress bubble growth. The reduced confinement of a cylindrical vessel should not alter this conclusion. Tissue viscosities taken from ultrasound measurements suppress bubble growth somewhat, though not to a degree expected to resist injury. However, the higher reported viscosities measured by other means, which are arguably more relevant to the deformations caused by growing bubbles, do indeed significantly suppress bubble expansion.

Flutter of wings involving a locally distributed flexible control surface

NASA Astrophysics Data System (ADS)

Mozaffari-Jovin, S.; Firouz-Abadi, R. D.; Roshanian, J.

2015-11-01

This paper undertakes to facilitate appraisal of aeroelastic interaction of a locally distributed, flap-type control surface with aircraft wings operating in a subsonic potential flow field. The extended Hamilton's principle serves as a framework to ascertain the Euler-Lagrange equations for coupled bending-torsional-flap vibration. An analytical solution to this boundary-value problem is then accomplished by assumed modes and the extended Galerkin's method. The developed aeroelastic model considers both the inherent flexibility of the control surface displaced on the wing and the inertial coupling between these two flexible bodies. The structural deformations also obey the Euler-Bernoulli beam theory, along with the Kelvin-Voigt viscoelastic constitutive law. Meanwhile, the unsteady thin-airfoil and strip theories are the tools of producing the three-dimensional airloads. The origin of aerodynamic instability undergoes analysis in light of the oscillatory loads as well as the loads owing to arbitrary motions. After successful verification of the model, a systematic flutter survey was conducted on the theoretical effects of various control surface parameters. The results obtained demonstrate that the flapping modes and parameters of the control surface can significantly impact the flutter characteristics of the wings, which leads to a series of pertinent conclusions.

Diode laser measurements of linestrength and temperature-dependent lineshape parameters of H2O-, CO2-, and N2-perturbed H2O transitions near 2474 and 2482 nm

NASA Astrophysics Data System (ADS)

Goldenstein, Christopher S.; Jeffries, Jay B.; Hanson, Ronald K.

2013-11-01

Absorption lineshapes for two unresolved H2O doublets near 4029.52 and 4041.92 cm-1 were measured at high-resolution in a heated static cell using two distributed-feedback diode lasers. Measurements were acquired for H2O, CO2, and N2 perturbers over a temperature and pressure range of 650-1325 K and 2-760 Torr, respectively. Strong collisional narrowing effects were observed in CO2 and N2, but not in pure H2O. The Galatry profile was used to infer collisional-broadening and -narrowing coefficients and their respective temperature dependence for CO2 and N2 perturbers. The collisional-broadening and -narrowing coefficients for CO2 perturbers were found to decrease with increasing temperature in a similar manner. For N2 perturbers, the collisional-broadening coefficients increased with temperature while the collisional-narrowing coefficients decreased with increasing temperature. Self-broadening coefficients were inferred from Voigt profile fits and are compared with HITEMP 2010. The linestrengths of 17 H2O transitions are also reported.

A Boreal high-resolution composite carbon isotope record of the Albian to Turonian interval from the North German Basin

NASA Astrophysics Data System (ADS)

Bornemann, André; Erbacher, Jochen; Huck, Stefan; Heimhofer, Ulrich

2017-04-01

We present a potentially complete, six-hundred-meters-thick composite record of high-resolution bulk-rock carbon isotope data from northern Germany covering the topmost Lower Albian to Lower Turonian interval. The established composite record consists of more than 1700 measurements ana-lyzed from seven drill sites including the Kirchrode I and II cores (Nebe, 1999; Fenner, 2001), the Anderten I and II cores (Bornemann et al., 2017), two industrial cores Wunstorf 2011/2 and 2011/8 as well as the Wunstorf research core (Voigt et al., 2008). In the central North German Basin the Albian is represented by a several hundred meters-thick succession of clays and clayey marls, whereas the Lower Cenomanian is characterized by the transition from clayey to chalky sedimentation. The latter prevailed during the remaining Cenomanian. The top of the studied succession is marked by the prominent black shales of the Cenomanian-Turonian boundary event (CTBE). The isotope records display the carbon isotope expression of the Oceanic Anoxic Events 1d and 2 as well as the Lower and Mid-Cenomanian Events (LCE, MCE). The applied integrat-ed approach of high-resolution chemostratigraphy and revised biostratigraphy gives way for a substantial improvement of the Boreal Cretaceous stratigraphy. Fenner, J. (2001) The Kirchrode I and II boreholes: technical details and evidence on tectonics, and the palaeoceanographic development during the Albian. Palaeogeogr. Palaeoclimatol. Palaeoecol., 174, 33-65. Nebe, D. (1999) Zyklenuntersuchungen an unterkretazischen Sedimenten in NW-Deutschland - Nachweisbarkeit von Milankovitch-Zyklen [PhD thesis, Ruhr-Univ. Bochum]. Bornemann, A., Erbacher, J., Heldt, M., Kollaske, T., Lübke, N., Huck, S., Vollmar, N.M., Wilmsen, M. (2017) The Albian-Cenomanian transition and Oceanic Anoxic Event 1d - an example from the Boreal Realm. Sedimentol. [doi:10.1111/sed.12347]. Voigt, S., Erbacher, J., Mutterlose, J., Weiss, W., Westerhold, T., Wiese, F., Wilmsen, M., Wonik, T. (2008) The Cenomanian - Turonian of the Wunstorf section (North Germany): global stratigraphic reference section and new orbital time scale for Oceanic Anoxic Event 2. Newsl. Stratigr., 43, 65-89.

ESP Toolbox: A Computational Framework for Precise, Scale-Independent Analysis of Bulk Elastic and Seismic Properties

NASA Astrophysics Data System (ADS)

Johnson, S. E.; Vel, S. S.; Cook, A. C.; Song, W. J.; Gerbi, C. C.; Okaya, D. A.

2014-12-01

Owing to the abundance of highly anisotropic minerals in the crust, the Voigt and Reuss bounds on the seismic velocities can be separated by more than 1 km/s. These bounds are determined by modal mineralogy and crystallographic preferred orientations (CPO) of the constituent minerals, but where the true velocities lie between these bounds is determined by other fabric parameters such as the shapes, shape-preferred orientations, and spatial arrangements of grains. Thus, the calculation of accurate bulk stiffness relies on explicitly treating the grain-scale heterogeneity, and the same principle applies at larger scales, for example calculating accurate bulk stiffness for a crustal volume with varying proportions and distributions of folds or shear zones. We have developed stand-alone GUI software - ESP Toolbox - for the calculation of 3D bulk elastic and seismic properties of heterogeneous and polycrystalline materials using image or EBSD data. The GUI includes a number of different homogenization techniques, including Voigt, Reuss, Hill, geometric mean, self-consistent and asymptotic expansion homogenization (AEH) methods. The AEH method, which uses a finite element mesh, is most accurate since it explicitly accounts for elastic interactions of constituent minerals/phases. The user need only specify the microstructure and material properties of the minerals/phases. We use the Toolbox to explore changes in bulk elasticity and related seismic anisotropy caused by specific variables, including: (a) the quartz alpha-beta phase change in rocks with varying proportions of quartz, (b) changes in modal mineralogy and CPO fabric that occur during progressive deformation and metamorphism, and (c) shear zones of varying thickness, abundance and geometry in continental crust. The Toolbox allows rapid sensitivity analysis around these and other variables, and the resulting bulk stiffness matrices can be used to populate volumes for synthetic wave propagation experiments that allow direct visualization of how variables of interest might affect propagation at a variety of scales. Sensitivity analyses also illustrate the value of the more precise AEH method. The ESP Toolbox can be downloaded here: http://umaine.edu/mecheng/faculty-and-staff/senthil-vel/software/

X-ray Diffraction Investigation of Annealing Behavior of Peened Surface Deformation Layer on Precipitation Hardening Stainless Steel

NASA Astrophysics Data System (ADS)

Huang, Junjie; Wang, Zhou; Gan, Jin; Yang, Ying; Huang, Feng; Wu, Gang; Meng, Qingshuai

2018-05-01

In order to investigate the recrystallization behavior of peened surface deformation layer of precipitation hardening stainless steel, a classic x-ray diffraction line profile analysis, Voigt method, was carried out on peened 17-4PH with different isothermal annealing temperatures. The activation energy of domain boundary migration ( Q a) and the activation energy of microstrain relaxation ( Q b) were calculated by regression analysis in different annealing temperature conditions. The results show that the value of Q a decreases with annealing temperature increasing, which is due to the influence of precipitation (ɛ-Cu) size on the movements of grain and subgrain boundaries. The maximum growth rate of ɛ-Cu particles occurs during 400 to 500 °C interval. Compared with growth behavior of domain size, microstrain relaxation behavior is less sensitive to precipitation particle size. The effects of annealing temperature and time on dislocation density are both significant when annealing temperature is lower than 500 °C. However, the effect of annealing temperature on dislocation density becomes insignificant when annealing temperature is higher than 500 °C. 300 °C annealing temperature only leads to the microstrain relaxation but nearly cannot lead to the domain size growth even if prolonging annealing time. Microstructure enhancement effect still exists in plastic deformation layer when 300 °C annealing temperature lasts for 60 min but nearly disappears when 600 °C annealing temperature lasts for 20 min.

X-ray Diffraction Investigation of Annealing Behavior of Peened Surface Deformation Layer on Precipitation Hardening Stainless Steel

NASA Astrophysics Data System (ADS)

Huang, Junjie; Wang, Zhou; Gan, Jin; Yang, Ying; Huang, Feng; Wu, Gang; Meng, Qingshuai

2018-04-01

In order to investigate the recrystallization behavior of peened surface deformation layer of precipitation hardening stainless steel, a classic x-ray diffraction line profile analysis, Voigt method, was carried out on peened 17-4PH with different isothermal annealing temperatures. The activation energy of domain boundary migration (Q a) and the activation energy of microstrain relaxation (Q b) were calculated by regression analysis in different annealing temperature conditions. The results show that the value of Q a decreases with annealing temperature increasing, which is due to the influence of precipitation (ɛ-Cu) size on the movements of grain and subgrain boundaries. The maximum growth rate of ɛ-Cu particles occurs during 400 to 500 °C interval. Compared with growth behavior of domain size, microstrain relaxation behavior is less sensitive to precipitation particle size. The effects of annealing temperature and time on dislocation density are both significant when annealing temperature is lower than 500 °C. However, the effect of annealing temperature on dislocation density becomes insignificant when annealing temperature is higher than 500 °C. 300 °C annealing temperature only leads to the microstrain relaxation but nearly cannot lead to the domain size growth even if prolonging annealing time. Microstructure enhancement effect still exists in plastic deformation layer when 300 °C annealing temperature lasts for 60 min but nearly disappears when 600 °C annealing temperature lasts for 20 min.

The analysis of thermoplastic characteristics of special polymer sulfur composite

NASA Astrophysics Data System (ADS)

Książek, Mariusz

2017-01-01

Specific chemical environments step out in the industry objects. Portland cement composites (concrete and mortar) were impregnated by using the special polymerized sulfur and technical soot as a filler (polymer sulfur composite). Sulfur and technical soot was applied as the industrial waste. Portland cement composites were made of the same aggregate, cement and water. The process of special polymer sulfur composite applied as the industrial waste is a thermal treatment process in the temperature of about 150-155°C. The result of such treatment is special polymer sulfur composite in a liquid state. This paper presents the plastic constants and coefficients of thermal expansion of special polymer sulfur composites, with isotropic porous matrix, reinforced by disoriented ellipsoidal inclusions with orthotropic symmetry of the thermoplastic properties. The investigations are based on the stochastic differential equations of solid mechanics. A model and algorithm for calculating the effective characteristics of special polymer sulfur composites are suggested. The effective thermoplastic characteristics of special polymer sulfur composites, with disoriented ellipsoidal inclusions, are calculated in two stages: First, the properties of materials with oriented inclusions are determined, and then effective constants of a composite with disoriented inclusions are determined on the basis of the Voigt or Rice scheme. A brief summary of new products related to special polymer sulfur composites is given as follows: Impregnation, repair, overlays and precast polymer concrete will be presented. Special polymer sulfur as polymer coating impregnation, which has received little attention in recent years, currently has some very interesting applications.

CERT TST December 2015 Visit Summary

DOE Office of Scientific and Technical Information (OSTI.GOV)

Little, Robert Currier; Bailey, Teresa S.; Gamblin, G. Todd

2016-01-25

The annual PSAAP II TST visit to Texas A&M’s CERT Center was held on December 1-3, 2015. The agenda for the visit is attached. Non-TAMU attendees were: TST Members – Teresa Bailey (LLNL), Todd Gamblin (LLNL), Bob Little (LANL) – Chair, Chad Olinger (LANL), Shawn Pautz (SNL), Alan Williams (SNL);Other Lab staff – Skip Kahler (LANL), Ana Kupresanin (LLNL), and Rob Lowrie (LANL); AST Members – Nelson Hoffman (LANL) and Bob Voigt (Leidos) The TST wishes to express our appreciation to all involved with CERT for the high-quality posters and presentations and for the attention to logistics that enabled amore » successful visit. We have broken our comments into four sections: (1) Kudos, (2) Recommendations, (3) Feedback on Priorities for April Review, and (4) Follow-Up Activities with Labs.« less

Investigation of transient cavitating flow in viscoelastic pipes

NASA Astrophysics Data System (ADS)

Keramat, A.; Tijsseling, A. S.; Ahmadi, A.

2010-08-01

A study on water hammer in viscoelastic pipes when the fluid pressure drops to liquid vapour pressure is performed. Two important concepts including column separation and the effects of retarded strains in the pipe wall on the fluid response have been investigated separately in recent works, but there is some curiosity as to how the results for pressure and discharge are when column separation occurs in a viscoelastic pipe. For pipes made of plastic such as polyethylene (PE) and polyvinyl chloride (PVC), viscoelasticity is a crucial mechanical property which changes the hydraulic and structural transient responses. Based on previous developments in the analysis of water hammer, a model which is capable of analysing column separation in viscoelastic pipes is presented and used for solving the selected case studies. For the column-separation modelling the Discrete Vapour Cavity Model (DVCM) is utilised and the viscoelasticity property of the pipe wall is modelled by Kelvin-Voigt elements. The effects of viscoelasticity play an important role in the column separation phenomenon because it changes the water hammer fundamental frequency and so affects the time of opening or collapse of the cavities. Verification of the implemented computer code is performed for the effects of viscoelasticity and column separation - separately and simultaneously - using experimental results from the literature. In the provided examples the focus is placed on the simultaneous effect of viscoelasticity and column separation on the hydraulic transient response. The final conclusions drawn are that if rectangular grids are utilised the DVCM gives acceptable predictions of the phenomenon and that the pipe wall material's retarded behaviour strongly dampens the pressure spikes caused by column separation.

Does atomic polarizability play a role in hydrogen radio recombination spectra from Galactic H II regions?

NASA Astrophysics Data System (ADS)

Hey, J. D.

2013-09-01

Since highly excited atoms, which contribute to the radio recombination spectra from Galactic H II regions, possess large polarizabilities, their lifetimes are influenced by ion (proton)-induced dipole collisions. It is shown that, while these ion-radiator collisional processes, if acting alone, would effectively limit the upper principal quantum number attainable for given plasma parameters, their influence is small relative to that of electron impacts within the framework of line broadening theory. The present work suggests that ion-permanent dipole interactions (Hey et al 2004 J. Phys. B: At. Mol. Opt. Phys. 37 2543) would also be of minor importance in limiting the occupation of highly excited states. On the other hand, the ion-induced dipole collisions are essential for ensuring equipartition of energy between atomic and electron kinetic distributions (Hey et al 1999 J. Phys. B: At. Mol. Opt. Phys. 32 3555; 2005 J. Phys. B: At. Mol. Opt. Phys. 38 3517), without which Voigt profile analysis to extract impact broadening widths would not be possible. Electron densities deduced from electron impact broadening of individual lines (Griem 1967 Astrophys. J. 148 547; Watson 2006 J. Phys. B: At. Mol. Opt. Phys. 39 1889) may be used to check the significance of the constraints arising from the present analysis. The spectra of Bell et al (2000 Publ. Astron. Soc. Pac. 112 1236; 2011 Astrophys. Space Sci. 333 377; 2011 Astrophys. Space Sci. 335 451) for Orion A and W51 in the vicinity of 6.0 and 17.6 GHz are examined in this context, and also in terms of a possible role of the background ion microfield in reducing the near-elastic contributions to the electron impact broadening below the predictions of theory (Hey 2012 J. Phys. B: At. Mol. Opt. Phys. 45 065701). These spectra are analysed, subject to the constraint that calculated relative intensities of lines, arising from upper states in collisional-radiative equilibrium, should be consistent with those obtained from Voigt profile analysis. It is shown that the experimental technique yields an excellent temperature diagnostic for the H II regions. On the other hand, strong evidence is not obtained, from those spectra which satisfy the above constraint on intensity, to indicate that the electron impact broadening theory requires substantial correction. The main grounds for attempting a revision of theory to allow for the influence of the ion microfield during the scattering processes on the upper and lower states of each line thus still appear to have a stronger theoretical (Hey 2007 J. Phys. B: At. Mol. Opt. Phys. 40 4077) than experimental basis.

Study of the tensile properties of individual multicellular fibres generated by Bacillus subtilis

NASA Astrophysics Data System (ADS)

Ye, Xuan; Zhao, Liang; Liang, Jiecun; Li, Xide; Chen, Guo-Qiang

2017-04-01

Multicellular fibres formed by Bacillus subtilis (B. subtilis) are attracting interest because of their potential application as degradable biomaterials. However, mechanical properties of individual fibres remain unknown because of their small dimensions. Herein, a new approach is developed to investigate the tensile properties of individual fibres with an average diameter of 0.7 μm and a length range of 25.7-254.3 μm. Variations in the tensile strengths of fibres are found to be the result of variable interactions among pairs of microbial cells known as septa. Using Weibull weakest-link model to study this mechanical variability, we predict the length effect of the sample. Moreover, the mechanical properties of fibres are found to depend highly on relative humidity (RH), with a brittle-ductile transition occurring around RH = 45%. The elastic modulus is 5.8 GPa in the brittle state, while decreases to 62.2 MPa in the ductile state. The properties of fibres are investigated by using a spring model (RH < 45%) for its elastic behaviour, and the Kelvin-Voigt model (RH > 45%) for the time-dependent response. Loading-unloading experiments and numerical calculations demonstrate that necking instability comes from structural changes (septa) and viscoelasticity dominates the deformation of fibres at high RH.

Numerical modeling of bubble dynamics in viscoelastic media with relaxation

NASA Astrophysics Data System (ADS)

Warnez, M. T.; Johnsen, E.

2015-06-01

Cavitation occurs in a variety of non-Newtonian fluids and viscoelastic materials. The large-amplitude volumetric oscillations of cavitation bubbles give rise to high temperatures and pressures at collapse, as well as induce large and rapid deformation of the surroundings. In this work, we develop a comprehensive numerical framework for spherical bubble dynamics in isotropic media obeying a wide range of viscoelastic constitutive relationships. Our numerical approach solves the compressible Keller-Miksis equation with full thermal effects (inside and outside the bubble) when coupled to a highly generalized constitutive relationship (which allows Newtonian, Kelvin-Voigt, Zener, linear Maxwell, upper-convected Maxwell, Jeffreys, Oldroyd-B, Giesekus, and Phan-Thien-Tanner models). For the latter two models, partial differential equations (PDEs) must be solved in the surrounding medium; for the remaining models, we show that the PDEs can be reduced to ordinary differential equations. To solve the general constitutive PDEs, we present a Chebyshev spectral collocation method, which is robust even for violent collapse. Combining this numerical approach with theoretical analysis, we simulate bubble dynamics in various viscoelastic media to determine the impact of relaxation time, a constitutive parameter, on the associated physics. Relaxation time is found to increase bubble growth and permit rebounds driven purely by residual stresses in the surroundings. Different regimes of oscillations occur depending on the relaxation time.

Structural stability, mechanical properties, electronic structures and thermal properties of XS (X = Ti, V, Cr, Mn, Fe, Co, Ni) binary compounds

NASA Astrophysics Data System (ADS)

Liu, Yangzhen; Xing, Jiandong; Fu, Hanguang; Li, Yefei; Sun, Liang; Lv, Zheng

2017-08-01

The properties of sulfides are important in the design of new iron-steel materials. In this study, first-principles calculations were used to estimate the structural stability, mechanical properties, electronic structures and thermal properties of XS (X = Ti, V, Cr, Mn, Fe, Co, Ni) binary compounds. The results reveal that these XS binary compounds are thermodynamically stable, because their formation enthalpy is negative. The elastic constants, Cij, and moduli (B, G, E) were investigated using stress-strain and Voigt-Reuss-Hill approximation, respectively. The sulfide anisotropy was discussed from an anisotropic index and three-dimensional surface contours. The electronic structures reveal that the bonding characteristics of the XS compounds are a mixture of metallic and covalent bonds. Using a quasi-harmonic Debye approximation, the heat capacity at constant pressure and constant volume was estimated. NiS possesses the largest CP and CV of the sulfides.

The Single-Crystal Elasticity of Yttria (Y2O3) to High Temperature

NASA Technical Reports Server (NTRS)

Kriven, Waltraud M.; Palko, James W.; Sinogeikin, Stanislav V.; Bass, Jay D.; Sayir, Ali; Levine, Stanley R. (Technical Monitor)

2000-01-01

The single-crystal elastic moduli of yttria have been measured by Brillouin spectroscopy up to 1200 C. The room temperature values obtained are C11 = 223.6 +/- 0.6 GPa, C44 = 74.6 +/- 0.5 GPa, and C12 = 112.4 +/- 1.0 GPa. The resulting bulk and (Voigt-Reuss-Hill) shear moduli are K = 149.5 +/- 1.0 GPa and G(sub VRH) = 66.3 +/- 0.8 GPa, respectively. These agree much more closely with experimental values reported for polycrystalline samples than do previous single-crystal measurements. Linear least squares regressions to the variation of bulk and shear moduli with temperature result in derivatives of dK/dT = -17 +/- 2 MPa/degC and dG(sub VRH)/dT = -8 +/- 2 MPa/degC. Elastic anisotropy was found to remain essentially constant over the temperature range studied.

Theory of wave propagation in magnetized near-zero-epsilon metamaterials: evidence for one-way photonic states and magnetically switched transparency and opacity.

PubMed

Davoyan, Arthur R; Engheta, Nader

2013-12-20

We study propagation of transverse-magnetic electromagnetic waves in the bulk and at the surface of a magnetized epsilon-near-zero (ENZ) medium in a Voigt configuration. We reveal that in a certain range of material parameters novel regimes of wave propagation emerge; we show that the transparency of the medium can be altered with the magnetization leading either to magnetically induced Hall opacity or Hall transparency of the ENZ. In our theoretical study, we demonstrate that surface waves at the interface between either a transparent or an opaque Hall medium and a homogeneous medium may, under certain conditions, be predominantly one way. Moreover, we predict that one-way photonic surface states may exist at the interface of an opaque Hall ENZ and a regular metal, giving rise to the possibility for backscattering immune wave propagation and isolation.

Continuous wave dye-laser technique for simultaneous, spatially resolved measurements of temperature, pressure, and velocity of NO in an underexpanded free jet

NASA Technical Reports Server (NTRS)

Di Rosa, Michael D.; Chang, Albert Y.; Hanson, Ronald K.

1993-01-01

Gas dynamic quantities within an underexpanded nitrogen free jet, seeded with 0.5 percent NO, were measured nonintrusively by using an intracavity-doubled, rapid-tuning, CW ring dye laser. The UV beam passed obliquely through the jet axis, and its frequency repetitively scanned across adjacent rotational lines in the NO gamma band near 225 nm at a rate of 4 kHz. Spatially resolved excitation scans were obtained by monitoring the induced broadband fluoresence. Modeling the Doppler-shifted excitation scans with Voigt profiles permitted simultaneous determinations of NO velocity, rotational temperature, and pressure. Zero Doppler shift was referenced to an absorption trace obtained across a static cell and recorded concurrently with the excitation scan. Typically, the measured and predicted axial distributions agreed within 10 percent. At high Mach numbers there was evidence of rotational freezing of NO.

The estimation of material and patch parameters in a PDE-based circular plate model

NASA Technical Reports Server (NTRS)

Banks, H. T.; Smith, Ralph C.; Brown, D. E.; Metcalf, Vern L.; Silcox, R. J.

1995-01-01

The estimation of material and patch parameters for a system involving a circular plate, to which piezoceramic patches are bonded, is considered. A partial differential equation (PDE) model for the thin circular plate is used with the passive and active contributions form the patches included in the internal and external bending moments. This model contains piecewise constant parameters describing the density, flexural rigidity, Poisson ratio, and Kelvin-Voigt damping for the system as well as patch constants and a coefficient for viscous air damping. Examples demonstrating the estimation of these parameters with experimental acceleration data and a variety of inputs to the experimental plate are presented. By using a physically-derived PDE model to describe the system, parameter sets consistent across experiments are obtained, even when phenomena such as damping due to electric circuits affect the system dynamics.

Spin Flips versus Spin Transport in Nonthermal Electrons Excited by Ultrashort Optical Pulses in Transition Metals

NASA Astrophysics Data System (ADS)

Shokeen, V.; Sanchez Piaia, M.; Bigot, J.-Y.; Müller, T.; Elliott, P.; Dewhurst, J. K.; Sharma, S.; Gross, E. K. U.

2017-09-01

A joint theoretical and experimental investigation is performed to understand the underlying physics of laser-induced demagnetization in Ni and Co films with varying thicknesses excited by 10 fs optical pulses. Experimentally, the dynamics of spins is studied by determining the time-dependent amplitude of the Voigt vector, retrieved from a full set of magnetic and nonmagnetic quantities performed on both sides of films, with absolute time reference. Theoretically, ab initio calculations are performed using time-dependent density functional theory. Overall, we demonstrate that spin-orbit induced spin flips are the most significant contributors with superdiffusive spin transport, which assumes only that the transport of majority spins without spin flips induced by scattering does not apply in Ni. In Co it plays a significant role during the first ˜20 fs only. Our study highlights the material dependent nature of the demagnetization during the process of thermalization of nonequilibrium spins.

Computational expressions for signals in frequency-modulation spectroscopy.

PubMed

Di Rosa, Michael D; Reiten, M T

2015-06-01

General expressions for the signals in frequency-modulation spectroscopy (FMS) appear in the literature but are often reduced to simple analytical equations following the assumption of a weak modulation index. This is little help to the experimentalist who wants to predict signals for modulation depths of the order of unity or greater, where strong FMS signals reside. Here, we develop general formulas for FMS signals in the case of an absorber with a Voigt line shape and then link these expressions to an example and existing numerical code for the line shape. The resulting computational recipe is easy to implement and exercised here to show where the larger FMS signals are found over the coordinates of modulation index and modulation frequency. One can also estimate from provided curves the in-phase FMS signal over a wide range of modulation parameters at either the Lorentzian-broadening or Doppler-broadening limit, or anywhere in between by interpolation.

Radial magnetic compression in the expelled jet of a plasma deflagration accelerator

DOE Office of Scientific and Technical Information (OSTI.GOV)

Loebner, Keith T. K., E-mail: kloebner@stanford.edu; Underwood, Thomas C.; Mouratidis, Theodore

2016-02-29

A spectroscopic study of a pulsed plasma deflagration accelerator is carried out that confirms the existence of a strong compression in the emerging jet at the exit plane of the device. An imaging spectrometer is used to collect broadened Hα emission from a transaxial slice of the emerging jet at high spatial resolution, and the radial plasma density profile is computed from Voigt fits of the Abel inverted emissivity profiles. The plasma temperature, determined via Doppler broadening of impurity line emission, is compared against the temperature predictions of a radial magnetohydrodynamic equilibrium model applied to the measured density profiles. Empiricalmore » scaling laws developed for the plasma density, combined with the measured and predicted temperatures, indicate that a radially equilibrated Z-pinch is formed within the expelled plasma jet at the exit plane during the deflagration process.« less

HITRAN Application Programming Interface (HAPI): A comprehensive approach to working with spectroscopic data

NASA Astrophysics Data System (ADS)

Kochanov, R. V.; Gordon, I. E.; Rothman, L. S.; Wcisło, P.; Hill, C.; Wilzewski, J. S.

2016-07-01

The HITRAN Application Programming Interface (HAPI) is presented. HAPI is a free Python library, which extends the capabilities of the HITRANonline interface (www.hitran.org) and can be used to filter and process the structured spectroscopic data. HAPI incorporates a set of tools for spectra simulation accounting for the temperature, pressure, optical path length, and instrument properties. HAPI is aimed to facilitate the spectroscopic data analysis and the spectra simulation based on the line-by-line data, such as from the HITRAN database [JQSRT (2013) 130, 4-50], allowing the usage of the non-Voigt line profile parameters, custom temperature and pressure dependences, and partition sums. The HAPI functions allow the user to control the spectra simulation and data filtering process via a set of the function parameters. HAPI can be obtained at its homepage www.hitran.org/hapi.

Frequency-comb-assisted precision laser spectroscopy of CHF{sub 3} around 8.6 μm

DOE Office of Scientific and Technical Information (OSTI.GOV)

Gambetta, Alessio; Coluccelli, Nicola; Cassinerio, Marco

2015-12-21

We report a high-precision spectroscopic study of room-temperature trifluoromethane around 8.6 μm, using a CW quantum cascade laser phase-locked to a mid-infrared optical frequency comb. This latter is generated by a nonlinear down-conversion process starting from a dual-branch Er:fiber laser and is stabilized against a GPS-disciplined rubidium clock. By tuning the comb repetition frequency, several transitions falling in the υ{sub 5} vibrational band are recorded with a frequency resolution of 20 kHz. Due to the very dense spectra, a special multiple-line fitting code, involving a Voigt profile, is developed for data analysis. The combination of the adopted experimental approach andmore » survey procedure leads to fractional accuracy levels in the determination of line center frequencies, down to 2 × 10{sup −10}. Line intensity factors, pressure broadening, and shifting parameters are also provided.« less

Surface grafting of Corchorus olitorius fibre: a green approach for the development of activated bioadsorbent.

PubMed

Roy, Aparna; Chakraborty, Sumit; Kundu, Sarada Prasad; Majumder, Subhasish Basu; Adhikari, Basudam

2013-02-15

The present work is an endeavor to prepare lignocellulosic biomass based adsorbent, suitable for removal of organic and inorganic pollutants from industrial effluents. Lignocellulosic Corchorus olitorius fibre (jute fibre) surface was grafted with naturally available polyphenol, tannin, preceded by the epoxy-activation of fibre surface with epichlorohydrin under mild condition in an aqueous suspension. The reaction parameters for the modification, viz., concentration of epichlorohydrin and tannin, time, and temperature were optimized. The successful occurrence of surface modification of jute fibre (JF) was characterized and estimated from weight gain percent, elemental analysis, Fourier transform infrared spectroscopy (FTIR), X-ray diffraction, scanning electron and atomic force microscopy, and thermogravimetric analysis. An extensive analysis of deconvoluted FTIR spectra using the Voigt model was utilized to ensure the surface grafting. The microbiological susceptibility study revealed high persistency of JF towards biodegradation after efficient grafting with tannin. Copyright © 2012 Elsevier Ltd. All rights reserved.

First-principles investigations on structural, elastic, electronic properties and Debye temperature of orthorhombic Ni3Ta under pressure

NASA Astrophysics Data System (ADS)

Li, Pan; Zhang, Jianxin; Ma, Shiyu; Jin, Huixin; Zhang, Youjian; Zhang, Wenyang

2018-06-01

The structural, elastic, electronic properties and Debye temperature of Ni3Ta under different pressures are investigated using the first-principles method based on density functional theory. Our calculated equilibrium lattice parameters at 0 GPa well agree with the experimental and previous theoretical results. The calculated negative formation enthalpies and elastic constants both indicate that Ni3Ta is stable under different pressures. The bulk modulus B, shear modulus G, Young's modulus E and Poisson's ratio ν are calculated by the Voigt-Reuss-Hill method. The bigger ratio of B/G indicates Ni3Ta is ductile and the pressure can improve the ductility of Ni3Ta. In addition, the results of density of states and the charge density difference show that the stability of Ni3Ta is improved by the increasing pressure. The Debye temperature ΘD calculated from elastic modulus increases along with the pressure.

Laser absorption spectroscopy for measurement of He metastable atoms of a microhollow cathode plasma

NASA Astrophysics Data System (ADS)

Ueno, Keisuke; Kamebuchi, Kenta; Kakutani, Jiro; Matsuoka, Leo; Namba, Shinichi; Fujii, Keisuke; Shikama, Taiichi; Hasuo, Masahiro

2018-01-01

We generated a 0.3-mm-diameter DC, hollow-cathode helium discharge in a gas pressure range of 10-80 kPa. In discharge plasmas, we measured position-dependent laser absorption spectra for helium 23S1-23P0 transition with a spatial resolution of 55 µm. From the results of the analysis of the measured spectra using Voigt functions and including both the Doppler and collision broadening, we produced two-dimensional maps of the metastable 23S1 atomic densities and gas temperatures of the plasmas. We found that, at all pressures, the gas temperatures were approximately uniform in space with values in the range of 400-1500 K and the 23S1 atomic densities were ˜1019 m-3. We also found that the two-dimensional density distribution profiles became ring-shaped at high gas pressures, which is qualitatively consistent with the two-dimensional fluid simulation results.

Nonlinear behaviour of cantilevered carbon nanotube resonators based on a new nonlinear electrostatic load model

NASA Astrophysics Data System (ADS)

Farokhi, Hamed; Païdoussis, Michael P.; Misra, Arun K.

2018-04-01

The present study examines the nonlinear behaviour of a cantilevered carbon nanotube (CNT) resonator and its mass detection sensitivity, employing a new nonlinear electrostatic load model. More specifically, a 3D finite element model is developed in order to obtain the electrostatic load distribution on cantilevered CNT resonators. A new nonlinear electrostatic load model is then proposed accounting for the end effects due to finite length. Additionally, a new nonlinear size-dependent continuum model is developed for the cantilevered CNT resonator, employing the modified couple stress theory (to account for size-effects) together with the Kelvin-Voigt model (to account for nonlinear damping); the size-dependent model takes into account all sources of nonlinearity, i.e. geometrical and inertial nonlinearities as well as nonlinearities associated with damping, small-scale, and electrostatic load. The nonlinear equation of motion of the cantilevered CNT resonator is obtained based on the new models developed for the CNT resonator and the electrostatic load. The Galerkin method is then applied to the nonlinear equation of motion, resulting in a set of nonlinear ordinary differential equations, consisting of geometrical, inertial, electrical, damping, and size-dependent nonlinear terms. This high-dimensional nonlinear discretized model is solved numerically utilizing the pseudo-arclength continuation technique. The nonlinear static and dynamic responses of the system are examined for various cases, investigating the effect of DC and AC voltages, length-scale parameter, nonlinear damping, and electrostatic load. Moreover, the mass detection sensitivity of the system is examined for possible application of the CNT resonator as a nanosensor.

Very narrow band model calculations of atmospheric fluxes and cooling rates

DOE Office of Scientific and Technical Information (OSTI.GOV)

Bernstein, L.S.; Berk, A.; Acharya, P.K.

1996-10-15

A new very narrow band model (VNBM) approach has been developed and incorporated into the MODTRAN atmospheric transmittance-radiance code. The VNBM includes a computational spectral resolution of 1 cm{sup {minus}1}, a single-line Voigt equivalent width formalism that is based on the Rodgers-Williams approximation and accounts for the finite spectral width of the interval, explicit consideration of line tails, a statistical line overlap correction, a new sublayer integration approach that treats the effect of the sublayer temperature gradient on the path radiance, and the Curtis-Godson (CG) approximation for inhomogeneous paths. A modified procedure for determining the line density parameter 1/d ismore » introduced, which reduces its magnitude. This results in a partial correction of the VNBM tendency to overestimate the interval equivalent widths. The standard two parameter CG approximation is used for H{sub 2}O and CO{sub 2}, while the Goody three parameter CG approximation is used for O{sub 3}. Atmospheric flux and cooling rate predictions using a research version of MODTRAN, MODR, are presented for H{sub 2}O (with and without the continuum), CO{sub 2}, and O{sub 3} for several model atmospheres. The effect of doubling the CO{sub 2} concentration is also considered. These calculations are compared to line-by-line (LBL) model calculations using the AER, GLA, GFDL, and GISS codes. The MODR predictions fall within the spread of the LBL results. The effects of decreasing the band model spectral resolution are illustrated using CO{sub 2} cooling rate and flux calculations. 36 refs., 18 figs., 1 tab.« less

Releases of Psyttalia fletcheri (Hymenoptera: Braconidae) and sterile flies to suppress melon fly (Diptera: Tephritidae) in Hawaii.

PubMed

Vargas, Roger I; Long, Jay; Miller, Neil W; Delate, Kathleen; Jackson, Charles G; Uchida, Grant K; Bautista, Renato C; Harris, Ernie J

2004-10-01

Ivy gourd, Coccinia grandis (L.) Voigt, patches throughout Kailua-Kona, Hawaii Island, HI, were identified as persistent sources of melon fly, Bactrocera cucurbitae (Coquillett). These patches had a low incidence of Psyttalia fletcheri (Silvestri), its major braconid parasitoid natural enemy in Hawaii, and were used to evaluate augmentative releases of P. fletcheri against melon fly. In field cage studies of releases, numbers of melon flies emerging from ivy gourd fruit placed inside treatment cages were reduced up to 21-fold, and numbers of parasitoids were increased 11-fold. In open field releases of P. fletcheri into ivy gourd patches, parasitization rates were increased 4.7 times in release plots compared with those in control plots. However, there was no significant reduction in emergence of melon flies from fruit. In subsequent cage tests with sterile melon flies and P. fletcheri, combinations of sterile flies and P. fletcheri produced the greatest reduction (9-fold) in melon fly emergence from zucchini, Cucurbita pepo L. Reductions obtained with sterile flies alone or in combination with parasitoids were significantly greater than those in the control, whereas those for parasitoids alone were not. Although these results suggest that the effects of sterile flies were greater than those for parasitoids, from a multitactic melon fly management strategy, sterile flies would complement the effects of P. fletcheri. Cost and sustainability of these nonchemical approaches will be examined further in an ongoing areawide pest management program for melon fly in Hawaii.

A New GPU-Enabled MODTRAN Thermal Model for the PLUME TRACKER Volcanic Emission Analysis Toolkit

NASA Astrophysics Data System (ADS)

Acharya, P. K.; Berk, A.; Guiang, C.; Kennett, R.; Perkins, T.; Realmuto, V. J.

2013-12-01

Real-time quantification of volcanic gaseous and particulate releases is important for (1) recognizing rapid increases in SO2 gaseous emissions which may signal an impending eruption; (2) characterizing ash clouds to enable safe and efficient commercial aviation; and (3) quantifying the impact of volcanic aerosols on climate forcing. The Jet Propulsion Laboratory (JPL) has developed state-of-the-art algorithms, embedded in their analyst-driven Plume Tracker toolkit, for performing SO2, NH3, and CH4 retrievals from remotely sensed multi-spectral Thermal InfraRed spectral imagery. While Plume Tracker provides accurate results, it typically requires extensive analyst time. A major bottleneck in this processing is the relatively slow but accurate FORTRAN-based MODTRAN atmospheric and plume radiance model, developed by Spectral Sciences, Inc. (SSI). To overcome this bottleneck, SSI in collaboration with JPL, is porting these slow thermal radiance algorithms onto massively parallel, relatively inexpensive and commercially-available GPUs. This paper discusses SSI's efforts to accelerate the MODTRAN thermal emission algorithms used by Plume Tracker. Specifically, we are developing a GPU implementation of the Curtis-Godson averaging and the Voigt in-band transmittances from near line center molecular absorption, which comprise the major computational bottleneck. The transmittance calculations were decomposed into separate functions, individually implemented as GPU kernels, and tested for accuracy and performance relative to the original CPU code. Speedup factors of 14 to 30× were realized for individual processing components on an NVIDIA GeForce GTX 295 graphics card with no loss of accuracy. Due to the separate host (CPU) and device (GPU) memory spaces, a redesign of the MODTRAN architecture was required to ensure efficient data transfer between host and device, and to facilitate high parallel throughput. Currently, we are incorporating the separate GPU kernels into a single function for calculating the Voigt in-band transmittance, and subsequently for integration into the re-architectured MODTRAN6 code. Our overall objective is that by combining the GPU processing with more efficient Plume Tracker retrieval algorithms, a 100-fold increase in the computational speed will be realized. Since the Plume Tracker runs on Windows-based platforms, the GPU-enhanced MODTRAN6 will be packaged as a DLL. We do however anticipate that the accelerated option will be made available to the general MODTRAN community through an application programming interface (API).

Transparency of the 2 μm (5000 cm-1) methane window in Titan's atmosphere and impact on retrieved surface reflectivity

NASA Astrophysics Data System (ADS)

Rannou, Pascal; Seignovert, Benoit; Le Mouélic, Stéphane; Sotin, Christophe

2016-10-01

The study of Titan properties with remote sensing relies on a good knowledge of the atmosphere properties. The in-situ observations made by Huygens combined with recent advances in the definition of methane properties enable to model and interpret observations with a very good accuracy. Thanks to these progresses, we can analyze in this work the observations made at the limb of Titan in order to retrieve information on the haze properties as its vertical profiles and its spectral behaviour along the VIMS/Cassini range (from 0.88 to 5.1 μm). However, for applications to real atmospheres, one need to account for the widening of the spectroscopic lines (e.g., Voigt profile) and apply an empirical cut-off of the far wings. In general, this is a multiplying function of the wavenumber, f(ν), applied to the Voigt profile that allows a faster decay of the wing profile beyond a given distance from the center of the line ν0 : f(ν)=1 if |ν- ν0| ≤ Δν, and f(ν)=exp(-|ν- ν0|/ σ) if |ν- ν0| > Δν. Although the 2-μm window is apparently straitforward to model, it appears that the standard cut-off parameters (that is Δν ~ 26 cm-1 and σ ~ 120 cm-1) which is used for other windows in Titan's atmosphere is not adequat for this window. Other sets of parameter must be used to reproduce Titan spectrum at 2 μm. However, there is no convergence of the results between these works and a large variety of cut-off parameters are used. Alternatively, it was found that some gas absorptions (ethane and another unknown gas) leave a signature around 2-μm and also affect the transparency in this window. In our study we make an exhaustive investigation on the cut-off parameters to determine which are the best couples of parameters to fit the 2-μm window. We also evaluated how gaseous absorptions can allow to reach a satisfactory agreement and, especially, if it allows to match observations with the standard cut-off. Finally, we investigate the impact of the different solutions (different cut-off, with or without supplementary absorptions) on the retrieved surface albedo.

A multi-approach to the optical depth of a contrail cirrus cluster

NASA Astrophysics Data System (ADS)

Vazquez-Navarro, Margarita; Bugliaro, Luca; Schumann, Ulrich; Strandgren, Johan; Wirth, Martin; Voigt, Christiane

2017-04-01

Amongst the individual aviation emissions, contrail cirrus contribute the largest fraction to the aviation effects on climate. To investigate the optical depth from contrail cirrus, we selected a cirrus and contrail cloud outbreak on the 10th April 2014 between the North Sea and Switzerland detected during the ML-CIRRUS experiment (Voigt et al., 2017). The outbreak was not forecast by weather prediction models. We describe its origin and evolution using a combination of in-situ measurements, remote sensing approaches and contrail prediction model prognosis. The in-situ and lidar measurements were carried out with the HALO aircraft, where the cirrus was first identified. Model predictions from the contrail prediction model CoCiP (Schumann et al., 2012) point to an anthropogenic origin. The satellite pictures from the SEVIRI imager on MSG combined with the use of a contrail cluster tracking algorithm enable the automatic assessment of the origin, displacement and growth of the cloud and the correct labeling of cluster pixels. The evolution of the optical depth and particle size of the selected cluster pixels were derived using the CiPS algorithm, a neural network primarily based on SEVIRI images. The CoCiP forecast of the cluster compared to the actual cluster tracking show that the model correctly predicts the occurrence of the cluster and its advection direction although the cluster spreads faster than simulated. The optical depth derived from CiPS and from the airborne high spectral resolution lidar WALES are compared and show a remarkably good agreement. This confirms that the new CiPS algorithm is a very powerful tool for the assessment of the optical depth of even optically thinner cirrus clouds. References: Schumann, U.: A contrail cirrus prediction model, Geosci. Model Dev., 5, 543-580, doi: 10.5194/gmd-5-543-2012, 2012. Voigt, C., Schumann, U., Minikin, A., Abdelmonem, A., Afchine, A., Borrmann, S., Boettcher, M., Buchholz, B., Bugliaro, L., Costa, A., Curtius, J., Dollner, M., Dörnbrack, A., Dreiling, V., Ebert, V., Ehrlich, A., Fix, A., Forster, L., Frank, F., Fütterer, D., Giez, A., Graf, K., Grooß, J.-U., Groß, S., Heimerl, K., Heinold, B., Hüneke, T., Järvinen, E., Jurkat, T., Kaufmann, S., Kenntner, M., Klingebiel, M., Klimach, T., Kohl, R., Krämer, M., Krisna, T. C., Luebke, A., Mayer, B., Mertes, S., Molleker, S., Petzold, A., Pfeilsticker, K., Port, M., Rapp, M., Reutter, P., Rolf, C., Rose, D., Sauer, D., Schäfler, A., Schlage, R., Schnaiter, M., Schneider, J., Spelten, N., Spichtinger, P., Stock, P., Walser, A., Weigel, R., Weinzierl, B., Wendisch, M., Werner, F., Wernli, H., Wirth, M., Zahn, A., Ziereis, H., and Zöger, M.: ML-CIRRUS - The airborne experiment on natural cirrus and contrail cirrus with the high-altitude long-range research aircraft HALO, Bull. Amer. Meteorol. Soc., in press, doi: 10.1175/BAMS-D-15-00213.1, 2017.

Wave Propagation in Discontinuous Media by the Scattering Matrix Method

NASA Astrophysics Data System (ADS)

Perino, A.; Orta, R.; Barla, G.

2012-09-01

Propagation of elastic waves in discontinuous media is studied in this paper by the scattering matrix method (SMM). An electromagnetic transmission line analogy is also used to set up the mathematical model. The SMM operates in the frequency domain and allows for all wave polarizations (P, SV and SH). Rock masses are examples of discontinuous media in which the discontinuities (fractures or joints) influence wave propagation. Both elastic and viscoelastic joints are considered and the latter are described by Kelvin-Voigt, Maxwell and Burgers models. Rock joints with Coulomb slip behavior are also analyzed, by applying the averaging principle of Caughy (J Appl Mech 27:640-643, 1960). The evaluation of the effects of periodic discontinuities in a homogeneous medium is presented by introducing the concept of Bloch waves. The dispersion curves of these waves are useful to explain the existence of frequency bands of strong attenuation, also in the case of lossless (perfectly elastic) structures. Simple expressions of transmission and reflection coefficients are obtained. Finally, the SMM results are compared with those computed via the distinct element method (DEM). The comparisons are performed on a medium with joints with Coulomb slip behavior and the agreement is satisfactory, although the SMM must be applied in conjunction with the equivalent linearization technique. Even if the DEM is much more general, the SMM in these simple cases is extremely faster and provides a higher physical insight.

Relativistic viscoelastic fluid mechanics.

PubMed

Fukuma, Masafumi; Sakatani, Yuho

2011-08-01

A detailed study is carried out for the relativistic theory of viscoelasticity which was recently constructed on the basis of Onsager's linear nonequilibrium thermodynamics. After rederiving the theory using a local argument with the entropy current, we show that this theory universally reduces to the standard relativistic Navier-Stokes fluid mechanics in the long time limit. Since effects of elasticity are taken into account, the dynamics at short time scales is modified from that given by the Navier-Stokes equations, so that acausal problems intrinsic to relativistic Navier-Stokes fluids are significantly remedied. We in particular show that the wave equations for the propagation of disturbance around a hydrostatic equilibrium in Minkowski space-time become symmetric hyperbolic for some range of parameters, so that the model is free of acausality problems. This observation suggests that the relativistic viscoelastic model with such parameters can be regarded as a causal completion of relativistic Navier-Stokes fluid mechanics. By adjusting parameters to various values, this theory can treat a wide variety of materials including elastic materials, Maxwell materials, Kelvin-Voigt materials, and (a nonlinearly generalized version of) simplified Israel-Stewart fluids, and thus we expect the theory to be the most universal description of single-component relativistic continuum materials. We also show that the presence of strains and the corresponding change in temperature are naturally unified through the Tolman law in a generally covariant description of continuum mechanics.

Random polycrystals of grains containing cracks: Model ofquasistatic elastic behavior for fractured systems

DOE Office of Scientific and Technical Information (OSTI.GOV)

Berryman, James G.; Grechka, Vladimir

2006-07-08

A model study on fractured systems was performed using aconcept that treats isotropic cracked systems as ensembles of crackedgrains by analogy to isotropic polycrystalline elastic media. Theapproach has two advantages: (a) Averaging performed is ensembleaveraging, thus avoiding the criticism legitimately leveled at mosteffective medium theories of quasistatic elastic behavior for crackedmedia based on volume concentrations of inclusions. Since crack effectsare largely independent of the volume they occupy in the composite, sucha non-volume-based method offers an appealingly simple modelingalternative. (b) The second advantage is that both polycrystals andfractured media are stiffer than might otherwise be expected, due tonatural bridging effects ofmore » the strong components. These same effectshave also often been interpreted as crack-crack screening inhigh-crack-density fractured media, but there is no inherent conflictbetween these two interpretations of this phenomenon. Results of thestudy are somewhat mixed. The spread in elastic constants observed in aset of numerical experiments is found to be very comparable to the spreadin values contained between the Reuss and Voigt bounds for thepolycrystal model. However, computed Hashin-Shtrikman bounds are much tootight to be in agreement with the numerical data, showing thatpolycrystals of cracked grains tend to violate some implicit assumptionsof the Hashin-Shtrikman bounding approach. However, the self-consistentestimates obtained for the random polycrystal model are nevertheless verygood estimators of the observed average behavior.« less

Quantitative Analysis of Spectral Interference of Spontaneous Raman Scattering in High-Pressure Fuel-Rich H2-Air Combustion

NASA Technical Reports Server (NTRS)

Kojima, Jun; Nguyen, Quang-Viet

2004-01-01

We present a theoretical study of the spectral interferences in the spontaneous Raman scattering spectra of major combustion products in 30-atm fuel-rich hydrogen-air flames. An effective methodology is introduced to choose an appropriate line-shape model for simulating Raman spectra in high-pressure combustion environments. The Voigt profile with the additive approximation assumption was found to provide a reasonable model of the spectral line shape for the present analysis. The rotational/vibrational Raman spectra of H2, N2, and H2O were calculated using an anharmonic-oscillator model using the latest collisional broadening coefficients. The calculated spectra were validated with data obtained in a 10-atm fuel-rich H2-air flame and showed excellent agreement. Our quantitative spectral analysis for equivalence ratios ranging from 1.5 to 5.0 revealed substantial amounts of spectral cross-talk between the rotational H2 lines and the N2 O-/Q-branch; and between the vibrational H2O(0,3) line and the vibrational H2O spectrum. We also address the temperature dependence of the spectral cross-talk and extend our analysis to include a cross-talk compensation technique that removes the nterference arising from the H2 Raman spectra onto the N2, or H2O spectra.

Effect of shot peening on the microstructure of laser hardened 17-4PH

NASA Astrophysics Data System (ADS)

Wang, Zhou; Jiang, Chuanhai; Gan, Xiaoyan; Chen, Yanhua

2010-12-01

In order to investigate the influence of shot peening on microstructure of laser hardened steel and clarify how much influence of initial microstructure induced by laser hardening treatment on final microstructure of laser hardened steel after shot peening treatment, measurements of retained austenite, measurements of microhardness and microstructural analysis were carried out on three typical areas including laser hardened area, transitional area and matrix area of laser hardened 17-4PH steel. The results showed that shot peening was an efficient cold working method to eliminate the retained austenite on the surface of laser hardened samples. The surface hardness increased dramatically when shot peening treatments were carried out. The analyses of microstructure of laser hardened 17-4PH after shot peening treatment were carried out in matrix area and laser hardened area via Voigt method. With the increasing peening intensity, the influence depth of shot peening on hardness and microstructure increased but the surface hardness and microstructure did not change when certain peening intensity was reached. Influence depth of shot peening on hardness was larger than influence depth of shot peening on microstructure due to the kinetic energy loss along the depth during shot peening treatment. From the microstructural result, it can be shown that the shot peening treatment can influence the domain size and microstrain of treated samples but laser hardening treatment can only influence the microstrain of treated samples.

Relativistic viscoelastic fluid mechanics

DOE Office of Scientific and Technical Information (OSTI.GOV)

Fukuma, Masafumi; Sakatani, Yuho

2011-08-15

A detailed study is carried out for the relativistic theory of viscoelasticity which was recently constructed on the basis of Onsager's linear nonequilibrium thermodynamics. After rederiving the theory using a local argument with the entropy current, we show that this theory universally reduces to the standard relativistic Navier-Stokes fluid mechanics in the long time limit. Since effects of elasticity are taken into account, the dynamics at short time scales is modified from that given by the Navier-Stokes equations, so that acausal problems intrinsic to relativistic Navier-Stokes fluids are significantly remedied. We in particular show that the wave equations for themore » propagation of disturbance around a hydrostatic equilibrium in Minkowski space-time become symmetric hyperbolic for some range of parameters, so that the model is free of acausality problems. This observation suggests that the relativistic viscoelastic model with such parameters can be regarded as a causal completion of relativistic Navier-Stokes fluid mechanics. By adjusting parameters to various values, this theory can treat a wide variety of materials including elastic materials, Maxwell materials, Kelvin-Voigt materials, and (a nonlinearly generalized version of) simplified Israel-Stewart fluids, and thus we expect the theory to be the most universal description of single-component relativistic continuum materials. We also show that the presence of strains and the corresponding change in temperature are naturally unified through the Tolman law in a generally covariant description of continuum mechanics.« less

Numerical modeling of bubble dynamics in viscoelastic media with relaxation

PubMed Central

Warnez, M. T.; Johnsen, E.

2015-01-01

Cavitation occurs in a variety of non-Newtonian fluids and viscoelastic materials. The large-amplitude volumetric oscillations of cavitation bubbles give rise to high temperatures and pressures at collapse, as well as induce large and rapid deformation of the surroundings. In this work, we develop a comprehensive numerical framework for spherical bubble dynamics in isotropic media obeying a wide range of viscoelastic constitutive relationships. Our numerical approach solves the compressible Keller–Miksis equation with full thermal effects (inside and outside the bubble) when coupled to a highly generalized constitutive relationship (which allows Newtonian, Kelvin–Voigt, Zener, linear Maxwell, upper-convected Maxwell, Jeffreys, Oldroyd-B, Giesekus, and Phan-Thien-Tanner models). For the latter two models, partial differential equations (PDEs) must be solved in the surrounding medium; for the remaining models, we show that the PDEs can be reduced to ordinary differential equations. To solve the general constitutive PDEs, we present a Chebyshev spectral collocation method, which is robust even for violent collapse. Combining this numerical approach with theoretical analysis, we simulate bubble dynamics in various viscoelastic media to determine the impact of relaxation time, a constitutive parameter, on the associated physics. Relaxation time is found to increase bubble growth and permit rebounds driven purely by residual stresses in the surroundings. Different regimes of oscillations occur depending on the relaxation time. PMID:26130967

Effect of solution and post-mortem time on mechanical and histological properties of liver during cold preservation.

PubMed

Ayyildiz, Mehmet; Aktas, Ranan Gulhan; Basdogan, Cagatay

2014-01-01

In liver transplantation, the donor and recipient are in different locations most of the time, and longer preservation periods are inevitable. Hence, the choice of the preservation solution and the duration of the preservation period are critical for the success of the transplant surgery. In this study, we examine the mechanical and histological properties of the bovine liver tissue stored in Lactated Ringer's (control), HTK and UW solutions as a function of preservation period. The mechanical experiments are conducted with a shear rheometer on cylindrical tissue samples extracted from 3 bovine livers and the change in viscoelastic material properties of the bovine liver is characterized using the fractional derivative Kelvin-Voigt Model. Also, the histological examinations are performed on the same liver samples under a light microscope. The results show that the preservation solution and period have a significant effect on the mechanical and histological properties of the liver tissue. The storage and loss shear moduli, the number of the apoptotic cells, the collagen accumulation, and the sinusoidal dilatation increase, and the glycogen deposition decreases as the preservation period is longer. Based on the statistical analyses, we observe that the liver tissue is preserved well in all three solutions for up to 11 h. After then, UW solution provides a better preservation up to 29 h. However, for preservation periods longer than 29 h, HTK is a more effective preservation solution based on the least amount of change in mechanical properties. On the other hand, the highest correlation between the mechanical and histological properties is observed for the liver samples preserved in UW solution.

Optical pumping of a single hole spin in a p-doped quantum dot coupled to a metallic nanoparticle

NASA Astrophysics Data System (ADS)

Antón, M. A.; Carreño, F.; Melle, Sonia; Calderón, Oscar G.; Cabrera-Granado, E.; Singh, Mahi R.

2013-05-01

The preparation of quantum states with a defined spin is analyzed in a hybrid system consisting of a p-doped semiconductor quantum dot (QD) coupled to a metallic nanoparticle. The quantum dot is described as a four-level atom-like system using the density matrix formalism. The lower levels are Zeeman-split hole spin states and the upper levels correspond to positively charged excitons containing a spin-up, spin-down hole pair and a spin electron. A metallic nanoparticle with spheroidal geometry is placed in close proximity to the quantum dot, and its effects are considered in the quasistatic approximation. A linearly polarized laser field drives two of the optical transitions of the QD and produces localized surface plasmons in the nanoparticle which act back upon the QD. The frequencies of these localized plasmons are very different along the two principal axes of the nanoparticle, thus producing an anisotropic modification of the spontaneous emission rates of the allowed optical transitions which is accompanied by local-field corrections. This effect translates into a preferential acceleration of some of the optical pathways and therefore into a fast initialization of the QD by excitation with a short optical pulse. The population transfer between the lower levels of the QD and the fidelity is analyzed as a function of the nanoparticle's aspect ratio, the external magnetic field, and the Rabi frequency of the driving field. It is also shown that the main effect of the local-field corrections is a lengthening of the time elapsed to reach the steady-state. The hole spin is predicted to be successfully cooled from 5 to 0.04 K at a magnetic field of 4.6 T applied in the Voigt geometry.

Influence of velocity effects on the shape of N2 (and air) broadened H2O lines revisited with classical molecular dynamics simulations

NASA Astrophysics Data System (ADS)

Ngo, N. H.; Tran, H.; Gamache, R. R.; Bermejo, D.; Domenech, J.-L.

2012-08-01

The modeling of the shape of H2O lines perturbed by N2 (and air) using the Keilson-Storer (KS) kernel for collision-induced velocity changes is revisited with classical molecular dynamics simulations (CMDS). The latter have been performed for a large number of molecules starting from intermolecular-potential surfaces. Contrary to the assumption made in a previous study [H. Tran, D. Bermejo, J.-L. Domenech, P. Joubert, R. R. Gamache, and J.-M. Hartmann, J. Quant. Spectrosc. Radiat. Transf. 108, 126 (2007)], 10.1016/j.jqsrt.2007.03.009, the results of these CMDS show that the velocity-orientation and -modulus changes statistically occur at the same time scale. This validates the use of a single memory parameter in the Keilson-Storer kernel to describe both the velocity-orientation and -modulus changes. The CMDS results also show that velocity- and rotational state-changing collisions are statistically partially correlated. A partially correlated speed-dependent Keilson-Storer model has thus been used to describe the line-shape. For this, the velocity changes KS kernel parameters have been directly determined from CMDS, while the speed-dependent broadening and shifting coefficients have been calculated with a semi-classical approach. Comparisons between calculated spectra and measurements of several lines of H2O broadened by N2 (and air) in the ν3 and 2ν1 + ν2 + ν3 bands for a wide range of pressure show very satisfactory agreement. The evolution of non-Voigt effects from Doppler to collisional regimes is also presented and discussed.

van der Waals torque

NASA Astrophysics Data System (ADS)

Esquivel-Sirvent, Raul; Schatz, George

2014-03-01

The theory of generalized van der Waals forces by Lifshtz when applied to optically anisotropic media predicts the existence of a torque. In this work we present a theoretical calculation of the van der Waals torque for two systems. First we consider two isotropic parallel plates where the anisotropy is induced using an external magnetic field. The anisotropy will in turn induce a torque. As a case study we consider III-IV semiconductors such as InSb that can support magneto plasmons. The calculations of the torque are done in the Voigt configuration, that occurs when the magnetic field is parallel to the surface of the slabs. The change in the dielectric function as the magnetic field increases has the effect of decreasing the van der Waals force and increasing the torque. Thus, the external magnetic field is used to tune both the force and torque. The second example we present is the use of the torque in the non retarded regime to align arrays of nano particle slabs. The torque is calculated within Barash and Ginzburg formalism in the nonretarded limit, and is quantified by the introduction of a Hamaker torque constant. Calculations are conducted between anisotropic slabs of materials including BaTiO3 and arrays of Ag nano particles. Depending on the shape and arrangement of the Ag nano particles the effective dielectric function of the array can be tuned as to make it more or less anisotropic. We show how this torque can be used in self assembly of arrays of nano particles. ref. R. Esquivel-Sirvent, G. C. Schatz, Phys. Chem C, 117, 5492 (2013). partial support from DGAPA-UNAM.

Analysis of optical and magnetooptical spectra of Fe{sub 5}Si{sub 3} and Fe{sub 3}Si magnetic silicides using spectral magnetoellipsometry

DOE Office of Scientific and Technical Information (OSTI.GOV)

Lyashchenko, S. A., E-mail: lsa@iph.krasn.ru; Popov, Z. I.; Varnakov, S. N.

The optical, magnetooptical, and magnetic properties of polycrystalline (Fe{sub 5}Si{sub 3}/SiO{sub 2}/Si(100)) and epitaxial Fe{sub 3}Si/Si(111) films are investigated by spectral magnetoellipsometry. The dispersion of the complex refractive index of Fe{sub 5}Si{sub 3} is measured using multiangle spectral ellipsometry in the range of 250–1000 nm. The dispersion of complex Voigt magnetooptical parameters Q is determined for Fe{sub 5}Si{sub 3} and Fe{sub 3}Si in the range of 1.6–4.9 eV. The spectral dependence of magnetic circular dichroism for both silicides has revealed a series of resonance peaks. The energies of the detected peaks correspond to interband electron transitions for spin-polarized densities ofmore » electron states (DOS) calculated from first principles for bulk Fe{sub 5}Si{sub 3} and Fe{sub 3}Si crystals.« less

Investigation of the physical properties of two Laves phase compounds HRh2 (H = Ca and La): A DFT study

NASA Astrophysics Data System (ADS)

Rahaman, Md. Zahidur; Rahman, Md. Atikur

2018-05-01

By using the first-principle calculations, the structural, elastic, electronic and optical properties of Laves phase intermetallic compounds CaRh2 and LaRh2 prototype with MgCu2 are investigated. The evaluated lattice parameters are consistent with the experimental values. The important elastic properties, such as bulk modulus B, shear modulus G, Young’s modulus Y and the Poisson’s ratio v, are computed by applying the Voigt-Reuss-Hill (VRH) approximation. The analysis of Pugh’s ratio exhibits the ductile nature of both the phases. Electronic conductivity is predicted for both the compounds. Most of the contribution comes from Rh-4d states. The study of bonding characteristics reveals the existence of ionic and metallic bonds in both intermetallics. The study of optical properties indicates that CaRh2 is a better dielectric material than LaRh2. Absorption quality of both the phases is good in the ultraviolet region.

Uncertain viscoelastic models with fractional order: A new spectral tau method to study the numerical simulations of the solution

NASA Astrophysics Data System (ADS)

Ahmadian, A.; Ismail, F.; Salahshour, S.; Baleanu, D.; Ghaemi, F.

2017-12-01

The analysis of the behaviors of physical phenomena is important to discover significant features of the character and the structure of mathematical models. Frequently the unknown parameters involve in the models are assumed to be unvarying over time. In reality, some of them are uncertain and implicitly depend on several factors. In this study, to consider such uncertainty in variables of the models, they are characterized based on the fuzzy notion. We propose here a new model based on fractional calculus to deal with the Kelvin-Voigt (KV) equation and non-Newtonian fluid behavior model with fuzzy parameters. A new and accurate numerical algorithm using a spectral tau technique based on the generalized fractional Legendre polynomials (GFLPs) is developed to solve those problems under uncertainty. Numerical simulations are carried out and the analysis of the results highlights the significant features of the new technique in comparison with the previous findings. A detailed error analysis is also carried out and discussed.

A Constrained Genetic Algorithm with Adaptively Defined Fitness Function in MRS Quantification

NASA Astrophysics Data System (ADS)

Papakostas, G. A.; Karras, D. A.; Mertzios, B. G.; Graveron-Demilly, D.; van Ormondt, D.

MRS Signal quantification is a rather involved procedure and has attracted the interest of the medical engineering community, regarding the development of computationally efficient methodologies. Significant contributions based on Computational Intelligence tools, such as Neural Networks (NNs), demonstrated a good performance but not without drawbacks already discussed by the authors. On the other hand preliminary application of Genetic Algorithms (GA) has already been reported in the literature by the authors regarding the peak detection problem encountered in MRS quantification using the Voigt line shape model. This paper investigates a novel constrained genetic algorithm involving a generic and adaptively defined fitness function which extends the simple genetic algorithm methodology in case of noisy signals. The applicability of this new algorithm is scrutinized through experimentation in artificial MRS signals interleaved with noise, regarding its signal fitting capabilities. Although extensive experiments with real world MRS signals are necessary, the herein shown performance illustrates the method's potential to be established as a generic MRS metabolites quantification procedure.

Energy harvesting with stacked dielectric elastomer transducers: Nonlinear theory, optimization, and linearized scaling law

NASA Astrophysics Data System (ADS)

Tutcuoglu, A.; Majidi, C.

2014-12-01

Using principles of damped harmonic oscillation with continuous media, we examine electrostatic energy harvesting with a "soft-matter" array of dielectric elastomer (DE) transducers. The array is composed of infinitely thin and deformable electrodes separated by layers of insulating elastomer. During vibration, it deforms longitudinally, resulting in a change in the capacitance and electrical enthalpy of the charged electrodes. Depending on the phase of electrostatic loading, the DE array can function as either an actuator that amplifies small vibrations or a generator that converts these external excitations into electrical power. Both cases are addressed with a comprehensive theory that accounts for the influence of viscoelasticity, dielectric breakdown, and electromechanical coupling induced by Maxwell stress. In the case of a linearized Kelvin-Voigt model of the dielectric, we obtain a closed-form estimate for the electrical power output and a scaling law for DE generator design. For the complete nonlinear model, we obtain the optimal electrostatic voltage input for maximum electrical power output.

A Generalized Maxwell Model for Creep Behavior of Artery Opening Angle

PubMed Central

Zhang, W.; Guo, X.; Kassab, G. S.

2009-01-01

An artery ring springs open into a sector after a radial cut. The opening angle characterizes the residual strain in the unloaded state, which is fundamental to understanding stress and strain in the vessel wall. A recent study revealed that the opening angle decreases with time if the artery is cut from the loaded state, while it increases if the cut is made from the no-load state due to viscoelasticity. In both cases, the opening angle approaches the same value in 3 hours. This implies that the characteristic relaxation time is about 10,000 sec. Here, the creep function of a generalized Maxwell model (a spring in series with six Voigt bodies) is used to predict the temporal change of opening angle in multiple time scales. It is demonstrated that the theoretical model captures the salient features of the experimental results. The proposed creep function may be extended to study the viscoelastic response of blood vessels under various loading conditions. PMID:19045526

Computational expressions for signals in frequency-modulation spectroscopy

DOE Office of Scientific and Technical Information (OSTI.GOV)

Di Rosa, Michael D.; Reiten, M. T.

2015-05-25

In this study, general expressions for the signals in frequency-modulation spectroscopy (FMS) appear in the literature but are often reduced to simple analytical equations following the assumption of a weak modulation index. This is little help to the experimentalist who wants to predict signals for modulation depths of the order of unity or greater, where strong FMS signals reside. Here, we develop general formulas for FMS signals in the case of an absorber with a Voigt line shape and then link these expressions to an example and existing numerical code for the line shape. The resulting computational recipe is easymore » to implement and exercised here to show where the larger FMS signals are found over the coordinates of modulation index and modulation frequency. One can also estimate from provided curves the in-phase FMS signal over a wide range of modulation parameters at either the Lorentzian-broadening or Doppler-broadening limit, or anywhere in between by interpolation.« less

Line intensities and temperature-dependent line broadening coefficients of Q-branch transitions in the v2 band of ammonia near 10.4 μm

NASA Astrophysics Data System (ADS)

Sur, Ritobrata; Spearrin, R. Mitchell; Peng, Wen Y.; Strand, Christopher L.; Jeffries, Jay B.; Enns, Gregory M.; Hanson, Ronald K.

2016-05-01

We report measured line intensities and temperature-dependent broadening coefficients of NH3 with Ar, N2, O2, CO2, H2O, and NH3 for nine sQ(J,K) transitions in the ν2 fundamental band in the frequency range 961.5-967.5 cm-1. This spectral region was chosen due to the strong NH3 absorption strength and lack of spectral interference from H2O and CO2 for laser-based sensing applications. Spectroscopic parameters were determined by multi-line fitting using Voigt lineshapes of absorption spectra measured with two quantum cascade lasers in thermodynamically-controlled optical cells. The temperature dependence of broadening was measured over a range of temperatures between 300 and 600 K. These measurements aid the development of mid-infrared NH3 sensors for a broad range of gas mixtures and at elevated temperatures.

Application of Effective Medium Theory to the Three-Dimensional Heterogeneity of Mantle Anisotropy

NASA Astrophysics Data System (ADS)

Song, X.; Jordan, T. H.

2015-12-01

A self-consistent theory for the effective elastic parameters of stochastic media with small-scale 3D heterogeneities has been developed using a 2nd-order Born approximation to the scattered wavefield (T. H. Jordan, GJI, in press). Here we apply the theory to assess how small-scale variations in the local anisotropy of the upper mantle affect seismic wave propagation. We formulate a anisotropic model in which the local elastic properties are specified by a constant stiffness tensor with hexagonal symmetry of arbitrary orientation. This orientation is guided by a Gaussian random vector field with transversely isotropic (TI) statistics. If the outer scale of the statistical variability is small compared to a wavelength, then the effective seismic velocities are TI and depend on two parameters, a horizontal-to-vertical orientation ratio ξ and a horizontal-to-vertical aspect ratio, η. If ξ = 1, the symmetry axis is isotropically distributed; if ξ < 1, it is vertical biased (bipolar distribution), and if ξ > 1, it is horizontally biased (girdle distribution). If η = 1, the heterogeneity is geometrically isotropic; as η à∞, the medium becomes a horizontal stochastic laminate; as η à0, the medium becomes a vertical stochastic bundle. Using stiffness tensors constrained by laboratory measurements of mantle xenoliths, we explore the dependence of the effective P and S velocities on ξ and η. The effective velocities are strongly controlled by the orientation ratio ξ; e.g., if the hexagonal symmetry axis of the local anisotropy is the fast direction of propagation, then vPH > vPV and vSH > vSV for ξ > 1. A more surprising result is the 2nd-order insensitivity of the velocities to the heterogeneity aspect ratio η. Consequently, the geometrical anisotropy of upper-mantle heterogeneity significantly enhances seismic-wave anisotropy only through local variations in the Voigt-averaged velocities, which depend primarily on rock composition and not deformation history.

Thermal Aging of Oceanic Asthenosphere

NASA Astrophysics Data System (ADS)

Paulson, E.; Jordan, T. H.

2013-12-01

To investigate the depth extent of mantle thermal aging beneath ocean basins, we project 3D Voigt-averaged S-velocity variations from an ensemble of global tomographic models onto a 1x1 degree age-based regionalization and average over bins delineated by equal increments in the square-root of crustal age. From comparisons among the bin-averaged S-wave profiles, we estimate age-dependent convergence depths (minimum depths where the age variations become statistically insignificant) as well as S travel times from these depths to a shallow reference surface. Using recently published techniques (Jordan & Paulson, JGR, doi:10.1002/jgrb.50263, 2013), we account for the aleatory variability in the bin-averaged S-wave profiles using the angular correlation functions of the individual tomographic models, we correct the convergence depths for vertical-smearing bias using their radial correlation functions, and we account for epistemic uncertainties through Bayesian averaging over the tomographic model ensemble. From this probabilistic analysis, we can assert with 90% confidence that the age-correlated variations in Voigt-averaged S velocities persist to depths greater than 170 km; i.e., more than 100 km below the mean depth of the G discontinuity (~70 km). Moreover, the S travel time above the convergence depth decays almost linearly with the square-root of crustal age out to 200 Ma, consistent with a half-space cooling model. Given the strong evidence that the G discontinuity approximates the lithosphere-asthenosphere boundary (LAB) beneath ocean basins, we conclude that the upper (and probably weakest) part of the oceanic asthenosphere, like the oceanic lithosphere, participates in the cooling that forms the kinematic plates, or tectosphere. In other words, the thermal boundary layer of a mature oceanic plate appears to be more than twice the thickness of its mechanical boundary layer. We do not discount the possibility that small-scale convection creates heterogeneities in the oceanic upper mantle; however, the large-scale flow evidently advects these small-scale heterogeneities along with the plates, allowing the upper part of the asthenosphere to continue cooling with lithospheric age. The dominance of this large-scale horizontal flow may be related to the high stresses associated with its channelization in a thin (~100 km) asthenosphere, as well as the possible focusing of the subtectospheric strain in a low-viscosity channel immediately above the 410-km discontinuity. These speculations aside, the observed thermal aging of oceanic asthenosphere is inconsistent with a tenet of plate tectonics, the LAB hypothesis, which states that lithospheric plates are decoupled from deeper mantle flow by a shear zone in the upper part of the asthenosphere.

High-order space-time finite element schemes for acoustic and viscodynamic wave equations with temporal decoupling.

PubMed

Banks, H T; Birch, Malcolm J; Brewin, Mark P; Greenwald, Stephen E; Hu, Shuhua; Kenz, Zackary R; Kruse, Carola; Maischak, Matthias; Shaw, Simon; Whiteman, John R

2014-04-13

We revisit a method originally introduced by Werder et al. (in Comput. Methods Appl. Mech. Engrg., 190:6685-6708, 2001) for temporally discontinuous Galerkin FEMs applied to a parabolic partial differential equation. In that approach, block systems arise because of the coupling of the spatial systems through inner products of the temporal basis functions. If the spatial finite element space is of dimension D and polynomials of degree r are used in time, the block system has dimension ( r + 1) D and is usually regarded as being too large when r > 1. Werder et al. found that the space-time coupling matrices are diagonalizable over [Formula: see text] for r ⩽ 100, and this means that the time-coupled computations within a time step can actually be decoupled. By using either continuous Galerkin or spectral element methods in space, we apply this DG-in-time methodology, for the first time, to second-order wave equations including elastodynamics with and without Kelvin-Voigt and Maxwell-Zener viscoelasticity. An example set of numerical results is given to demonstrate the favourable effect on error and computational work of the moderately high-order (up to degree 7) temporal and spatio-temporal approximations, and we also touch on an application of this method to an ambitious problem related to the diagnosis of coronary artery disease. Copyright © 2014 The Authors. International Journal for Numerical Methods in Engineering published by John Wiley & Sons Ltd.

Precise predictions of H2O line shapes over a wide pressure range using simulations corrected by a single measurement

NASA Astrophysics Data System (ADS)

Ngo, N. H.; Nguyen, H. T.; Tran, H.

2018-03-01

In this work, we show that precise predictions of the shapes of H2O rovibrational lines broadened by N2, over a wide pressure range, can be made using simulations corrected by a single measurement. For that, we use the partially-correlated speed-dependent Keilson-Storer (pcsdKS) model whose parameters are deduced from molecular dynamics simulations and semi-classical calculations. This model takes into account the collision-induced velocity-changes effects, the speed dependences of the collisional line width and shift as well as the correlation between velocity and internal-state changes. For each considered transition, the model is corrected by using a parameter deduced from its broadening coefficient measured for a single pressure. The corrected-pcsdKS model is then used to simulate spectra for a wide pressure range. Direct comparisons of the corrected-pcsdKS calculated and measured spectra of 5 rovibrational lines of H2O for various pressures, from 0.1 to 1.2 atm, show very good agreements. Their maximum differences are in most cases well below 1%, much smaller than residuals obtained when fitting the measurements with the Voigt line shape. This shows that the present procedure can be used to predict H2O line shapes for various pressure conditions and thus the simulated spectra can be used to deduce the refined line-shape parameters to complete spectroscopic databases, in the absence of relevant experimental values.

Multispectrum analysis of the oxygen A-band.

PubMed

Drouin, Brian J; Benner, D Chris; Brown, Linda R; Cich, Matthew J; Crawford, Timothy J; Devi, V Malathy; Guillaume, Alexander; Hodges, Joseph T; Mlawer, Eli J; Robichaud, David J; Oyafuso, Fabiano; Payne, Vivienne H; Sung, Keeyoon; Wishnow, Edward H; Yu, Shanshan

2017-01-01

Retrievals of atmospheric composition from near-infrared measurements require measurements of airmass to better than the desired precision of the composition. The oxygen bands are obvious choices to quantify airmass since the mixing ratio of oxygen is fixed over the full range of atmospheric conditions. The OCO-2 mission is currently retrieving carbon dioxide concentration using the oxygen A-band for airmass normalization. The 0.25% accuracy desired for the carbon dioxide concentration has pushed the required state-of-the-art for oxygen spectroscopy. To measure O 2 A-band cross-sections with such accuracy through the full range of atmospheric pressure requires a sophisticated line-shape model (Rautian or Speed-Dependent Voigt) with line mixing (LM) and collision induced absorption (CIA). Models of each of these phenomena exist, however, this work presents an integrated self-consistent model developed to ensure the best accuracy. It is also important to consider multiple sources of spectroscopic data for such a study in order to improve the dynamic range of the model and to minimize effects of instrumentation and associated systematic errors. The techniques of Fourier Transform Spectroscopy (FTS) and Cavity Ring-Down Spectroscopy (CRDS) allow complimentary information for such an analysis. We utilize multispectrum fitting software to generate a comprehensive new database with improved accuracy based on these datasets. The extensive information will be made available as a multi-dimensional cross-section (ABSCO) table and the parameterization will be offered for inclusion in the HITRANonline database.

Multispectrum analysis of the oxygen A-band

PubMed Central

Drouin, Brian J.; Benner, D. Chris; Brown, Linda R.; Cich, Matthew J.; Crawford, Timothy J.; Devi, V. Malathy; Guillaume, Alexander; Hodges, Joseph T.; Mlawer, Eli J.; Robichaud, David J.; Oyafuso, Fabiano; Payne, Vivienne H.; Sung, Keeyoon; Wishnow, Edward H.; Yu, Shanshan

2016-01-01

Retrievals of atmospheric composition from near-infrared measurements require measurements of airmass to better than the desired precision of the composition. The oxygen bands are obvious choices to quantify airmass since the mixing ratio of oxygen is fixed over the full range of atmospheric conditions. The OCO-2 mission is currently retrieving carbon dioxide concentration using the oxygen A-band for airmass normalization. The 0.25% accuracy desired for the carbon dioxide concentration has pushed the required state-of-the-art for oxygen spectroscopy. To measure O2 A-band cross-sections with such accuracy through the full range of atmospheric pressure requires a sophisticated line-shape model (Rautian or Speed-Dependent Voigt) with line mixing (LM) and collision induced absorption (CIA). Models of each of these phenomena exist, however, this work presents an integrated self-consistent model developed to ensure the best accuracy. It is also important to consider multiple sources of spectroscopic data for such a study in order to improve the dynamic range of the model and to minimize effects of instrumentation and associated systematic errors. The techniques of Fourier Transform Spectroscopy (FTS) and Cavity Ring-Down Spectroscopy (CRDS) allow complimentary information for such an analysis. We utilize multispectrum fitting software to generate a comprehensive new database with improved accuracy based on these datasets. The extensive information will be made available as a multi-dimensional cross-section (ABSCO) table and the parameterization will be offered for inclusion in the HITRANonline database. PMID:27840454

Effect of Physiological State on Female Melon Fly (Diptera: Tephritidae) Attraction to Host and Food Odor in the Field.

PubMed

Vargas, Roger I; Piñero, Jaime C; Miller, Neil W

2018-05-28

Foraging behavior of wild female melon fly, Bactrocera (Zeugodacus) cucurbitae Coquillett, a worldwide pest of economically important cucurbit crops, was examined through mark and recapture studies in both wild (Kona: dominated by the invasive weed ivy gourd, Coccinea grandis [L.] Voigt [Cucurbitaceae]), and cultivated (Kapoho: dominated by papaya, Carica papaya L. [Caricaceae] orchards) habitats on Hawaii Island. In particular, the extent to which wild melon flies and color-marked F2 females responded to cucumber odor and Solulys yeast hydrolysate laced with ammonium acetate (1%, wt/vol) according to sexual maturity stage and degree of protein hunger was documented. Kona results indicated that more wild and color-marked F2 females responded to cucumber (Cucumis sativus L. [Cucurbitaceae]) odor than to protein odor with the exception of captured wild flies without eggs, which responded similarly to protein bait and cucumber odor. Results with captured wild females and color-marked F2 females in Kapoho suggested a significant preference for cucumber odor over protein odor regardless of whether or not they had eggs in their ovaries with the exception of protein-deprived color-marked F2 females, which responded to both odors in equal numbers. Implications of these new findings based on wild melon flies in natural habitats are discussed with respect to integrated pest management control strategies with protein bait sprays used in Hawaii. The possibility of adding cucurbit volatiles to protein-based baits is discussed.

Multispectrum analysis of the oxygen A-band

DOE PAGES

Drouin, Brian J.; Benner, D. Chris; Brown, Linda R.; ...

2016-04-11

Retrievals of atmospheric composition from near-infrared measurements require measurements of airmass to better than the desired precision of the composition. The oxygen bands are obvious choices to quantify airmass since the mixing ratio of oxygen is fixed over the full range of atmospheric conditions. The OCO-2 mission is currently retrieving carbon dioxide concentration using the oxygen A-band for airmass normalization. The 0.25% accuracy desired for the carbon dioxide concentration has pushed the required state-of-the-art for oxygen spectroscopy. To measure O2 A-band cross-sections with such accuracy through the full range of atmospheric pressure requires a sophisticated line-shape model (Rautian or Speed-Dependentmore » Voigt) with line mixing (LM) and collision induced absorption (CIA). Models of each of these phenomena exist, however, this work presents an integrated self-consistent model developed to ensure the best accuracy. It is also important to consider multiple sources of spectroscopic data for such a study in order to improve the dynamic range of the model and to minimize effects of instrumentation and associated systematic errors. The techniques of Fourier Transform Spectroscopy (FTS) and Cavity Ring-Down Spectroscopy (CRDS) allow complimentary information for such an analysis. We utilize multispectrum fitting software to generate a comprehensive new database with improved accuracy based on these datasets. As a result, the extensive information will be made available as a multi-dimensional cross-section (ABSCO) table and the parameterization will be offered for inclusion in the HITRANonline database.« less

Experimental studies by complementary terahertz techniques and semi-classical calculations of N2- broadening coefficients of CH335Cl

NASA Astrophysics Data System (ADS)

Guinet, M.; Rohart, F.; Buldyreva, J.; Gupta, V.; Eliet, S.; Motiyenko, R. A.; Margulès, L.; Cuisset, A.; Hindle, F.; Mouret, G.

2012-07-01

Room-temperature N2-broadening coefficients of methyl chloride rotational lines are measured over a large interval of quantum numbers (6≤J≤50, 0≤K≤18) by a submillimeter frequency-multiplication chain (J≤31) and a terahertz photomixing continuous-wave spectrometer (J≥31). In order to check the accuracy of both techniques, the measurements of identical lines are compared for J=31. The pressure broadening coefficients are deduced from line fits using mainly a Voigt profile model. The excellent signal-to-noise ratio of the frequency-multiplication scheme highlights some speed dependence effect on the line shape. Theoretical values of these coefficients are calculated by a semi-classical approach with exact trajectories. An intermolecular potential including atom-atom interactions is used for the first time. It is shown that, contrary to the previous theoretical predictions, the contributions of short-range forces are important for all values of the rotational quantum numbers. Additional testing of modifications required in the semi-classical formalism for a correct application of the cumulant expansion is also performed. It is stated that the use of the cumulant average on the rotational states of the perturbing molecule leads, for high J and small K values, to slightly higher line-broadening coefficients, as expected for the relatively strong interacting CH3Cl-N2 system. The excellent agreement between the theoretical and the experimental results ensures the reliability of these data.

High-order space-time finite element schemes for acoustic and viscodynamic wave equations with temporal decoupling

PubMed Central

Banks, H T; Birch, Malcolm J; Brewin, Mark P; Greenwald, Stephen E; Hu, Shuhua; Kenz, Zackary R; Kruse, Carola; Maischak, Matthias; Shaw, Simon; Whiteman, John R

2014-01-01

We revisit a method originally introduced by Werder et al. (in Comput. Methods Appl. Mech. Engrg., 190:6685–6708, 2001) for temporally discontinuous Galerkin FEMs applied to a parabolic partial differential equation. In that approach, block systems arise because of the coupling of the spatial systems through inner products of the temporal basis functions. If the spatial finite element space is of dimension D and polynomials of degree r are used in time, the block system has dimension (r + 1)D and is usually regarded as being too large when r > 1. Werder et al. found that the space-time coupling matrices are diagonalizable over for r ⩽100, and this means that the time-coupled computations within a time step can actually be decoupled. By using either continuous Galerkin or spectral element methods in space, we apply this DG-in-time methodology, for the first time, to second-order wave equations including elastodynamics with and without Kelvin–Voigt and Maxwell–Zener viscoelasticity. An example set of numerical results is given to demonstrate the favourable effect on error and computational work of the moderately high-order (up to degree 7) temporal and spatio-temporal approximations, and we also touch on an application of this method to an ambitious problem related to the diagnosis of coronary artery disease. Copyright © 2014 The Authors. International Journal for Numerical Methods in Engineering published by John Wiley & Sons Ltd. PMID:25834284

Numerical Evaluation of Parameter Correlation in the Hartmann-Tran Line Profile

NASA Astrophysics Data System (ADS)

Adkins, Erin M.; Reed, Zachary; Hodges, Joseph T.

2017-06-01

The partially correlated quadratic, speed-dependent hard-collision profile (pCqSDHCP), for simplicity referred to as the Hartmann-Tran profile (HTP), has been recommended as a generalized lineshape for high resolution spectroscopy. The HTP parameterizes complex collisional effects such as Dicke narrowing, speed dependent narrowing, and correlations between velocity-changing and dephasing collisions, while also simplifying to simpler profiles that are widely used, such as the Voigt profile. As advanced lineshape profiles are adopted by more researchers, it is important to understand the limitations that data quality has on the ability to retrieve physically meaningful parameters using sophisticated lineshapes that are fit to spectra of finite signal-to-noise ratio. In this work, spectra were simulated using the HITRAN Application Programming Interface (HAPI) across a full range of line parameters. Simulated spectra were evaluated to quantify the precision with which fitted lineshape parameters can be determined at a given signal-to-noise ratio, focusing on the numerical correlation between the retrieved Dicke narrowing frequency and the velocity-changing and dephasing collisions correlation parameter. Tran, H., N. Ngo, and J.-M. Hartmann, Journal of Quantitative Spectroscopy and Radiative Transfer 2013. 129: p. 89-100. Tennyson, et al., Pure Appl. Chem. 2014, 86: p. 1931-1943. Kochanov, R.V., et al., Journal of Quantitative Spectroscopy and Radiative Transfer 2016. 177: p. 15-30. Tran, H., N. Ngo, and J.-M. Hartmann, Journal of Quantitative Spectroscopy and Radiative Transfer 2013. 129: p. 199-203.

Multispectrum analysis of the oxygen A-band

DOE Office of Scientific and Technical Information (OSTI.GOV)

Drouin, Brian J.; Benner, D. Chris; Brown, Linda R.

Retrievals of atmospheric composition from near-infrared measurements require measurements of airmass to better than the desired precision of the composition. The oxygen bands are obvious choices to quantify airmass since the mixing ratio of oxygen is fixed over the full range of atmospheric conditions. The OCO-2 mission is currently retrieving carbon dioxide concentration using the oxygen A-band for airmass normalization. The 0.25% accuracy desired for the carbon dioxide concentration has pushed the required state-of-the-art for oxygen spectroscopy. To measure O2 A-band cross-sections with such accuracy through the full range of atmospheric pressure requires a sophisticated line-shape model (Rautian or Speed-Dependentmore » Voigt) with line mixing (LM) and collision induced absorption (CIA). Models of each of these phenomena exist, however, this work presents an integrated self-consistent model developed to ensure the best accuracy. It is also important to consider multiple sources of spectroscopic data for such a study in order to improve the dynamic range of the model and to minimize effects of instrumentation and associated systematic errors. The techniques of Fourier Transform Spectroscopy (FTS) and Cavity Ring-Down Spectroscopy (CRDS) allow complimentary information for such an analysis. We utilize multispectrum fitting software to generate a comprehensive new database with improved accuracy based on these datasets. As a result, the extensive information will be made available as a multi-dimensional cross-section (ABSCO) table and the parameterization will be offered for inclusion in the HITRANonline database.« less

A Nano-indentation Identification Technique for Viscoelastic Constitutive Characteristics of Periodontal Ligaments.

PubMed

Ashrafi, H; Shariyat, M

2016-06-01

Nano-indentation has recently been employed as a powerful tool for determining the mechanical properties of biological tissues on nano and micro scales. A majority of soft biological tissues such as ligaments and tendons exhibit viscoelastic or time-dependent behaviors. The constitutive characterization of soft tissues is among very important subjects in clinical medicine and especially, biomechanics fields. Periodontal ligament plays an important role in initiating tooth movement when loads are applied to teeth with orthodontic appliances. It is also the most accessible ligament in human body as it can be directly manipulated without any surgical intervention. From a mechanical point of view, this ligament can be considered as a thin interface made by a solid phase, consisting mainly of collagen fibers, which is immersed into a so-called ground substance. However, the viscoelastic constitutive effects of biological tissues are seldom considered rigorous during Nano-indentation tests. In the present paper, a mathematical contact approach is developed to enable determining creep compliance and relaxation modulus of distinct periodontal ligaments, using constant-rate indentation and loading time histories, respectively. An adequate curve-fitting method is presented to determine these characteristics based on the Nano-indentation of rigid Berkovich tips. Generalized Voigt-Kelvin and Wiechert models are used to model constitutive equations of periodontal ligaments, in which the relaxation and creep functions are represented by series of decaying exponential functions of time. Time-dependent creep compliance and relaxation function have been obtained for tissue specimens of periodontal ligaments. To improve accuracy, relaxation and creep moduli are measured from two tests separately. Stress relaxation effects appear more rapidly than creep in the periodontal ligaments.

Viscoelastic properties of cationic starch adsorbed on quartz studied by QCM-D.

PubMed

Tammelin, Tekla; Merta, Juha; Johansson, Leena-Sisko; Stenius, Per

2004-12-07

The adsorption and viscoelastic properties of layers of a cationic polyelectrolyte (cationic starch, CS, with 2-hydroxy-3-trimethylammoniumchloride as the substituent) adsorbed from aqueous solutions (pH 7.5, added NaCl 0, 1, 100, and 500 mM) on silica were studied with a quartz crystal microbalance with dissipation (QCM-D). Three different starches were investigated (weight-average molecular weights M(w) approximately 8.7 x 10(5) and 4.5 x 10(5) with degree of substitution DS = 0.75 and M(w) approximately 8.8 x 10(5) with DS = 0.2). At low ionic strength, the adsorbed layers are thin and rigid and the amount adsorbed can be calculated using the Sauerbrey equation. When the ionic strength is increased, significant changes take place in the amount of adsorbed CS and the viscoelasticity of the adsorbed layer. These changes were analyzed assuming that the layer can be described as a Voigt element on a rigid surface in contact with purely viscous solvent. It was found that CS with low charge density forms a thicker and more mobile layer with higher viscosity and elasticity than CS with high charge density. The polymers adsorbed on the silica even when the ionic strength was so high that electrostatic interactions were effectively screened. At this high ionic strength, it was possible to study the effect of molecular weight and molecular weight distribution of the CS on the properties of the adsorbed film. Increasing the molecular weight of CS resulted in a larger hydrodynamic thickness. CS with a narrow molecular weight distribution formed a more compact and rigid layer than broadly distributed CS, presumably due to the better packing of the molecules.

A Nano-indentation Identification Technique for Viscoelastic Constitutive Characteristics of Periodontal Ligaments

PubMed Central

Ashrafi, H.; Shariyat, M.

2016-01-01

Introduction Nano-indentation has recently been employed as a powerful tool for determining the mechanical properties of biological tissues on nano and micro scales. A majority of soft biological tissues such as ligaments and tendons exhibit viscoelastic or time-dependent behaviors. The constitutive characterization of soft tissues is among very important subjects in clinical medicine and especially, biomechanics fields. Periodontal ligament plays an important role in initiating tooth movement when loads are applied to teeth with orthodontic appliances. It is also the most accessible ligament in human body as it can be directly manipulated without any surgical intervention. From a mechanical point of view, this ligament can be considered as a thin interface made by a solid phase, consisting mainly of collagen fibers, which is immersed into a so-called ground substance. However, the viscoelastic constitutive effects of biological tissues are seldom considered rigorous during Nano-indentation tests. Methods In the present paper, a mathematical contact approach is developed to enable determining creep compliance and relaxation modulus of distinct periodontal ligaments, using constant–rate indentation and loading time histories, respectively. An adequate curve-fitting method is presented to determine these characteristics based on the Nano-indentation of rigid Berkovich tips. Generalized Voigt-Kelvin and Wiechert models are used to model constitutive equations of periodontal ligaments, in which the relaxation and creep functions are represented by series of decaying exponential functions of time. Results Time-dependent creep compliance and relaxation function have been obtained for tissue specimens of periodontal ligaments. Conclusion To improve accuracy, relaxation and creep moduli are measured from two tests separately. Stress relaxation effects appear more rapidly than creep in the periodontal ligaments. PMID:27672630

Reworked Middle Jurassic sandstones as a marker for Upper Cretaceous basin inversion in Central Europe—a case study for the U-Pb detrital zircon record of the Upper Cretaceous Schmilka section and their implication for the sedimentary cover of the Lausitz Block (Saxony, Germany)

NASA Astrophysics Data System (ADS)

Hofmann, Mandy; Voigt, Thomas; Bittner, Lucas; Gärtner, Andreas; Zieger, Johannes; Linnemann, Ulf

2018-04-01

The Saxonian-Bohemian Cretaceous Basin (Elbsandsteingebirge, E Germany and Czech Republic, Elbtal Group) comprises Upper Cretaceous sedimentary rocks from Upper Cenomanian to Santonian age. These sandstones were deposited in a narrow strait of the sea linking the northern Boreal shelf to the southern Tethyan areas. They were situated between the West Sudetic Island in the north and the Mid-European Island in the south. As known by former studies (e.g. Tröger, Geologie 6/7:717-730, 1964; Tröger, Geologie von Sachsen, Schweizerbart, 311-358, 2008; Voigt and Tröger, Proceedings of the 4th International Cretaceous Symposium, 275-290, 1996; Voigt, Dissertation, TU Bergakademie Freiberg, 1-130, 1995; Voigt, Zeitschrift der geologischen Wissenschaften 37(1-2): 15-39, 2009; Wilmsen et al., Freiberger Forschungshefte C540: 27-45, 2011) the main sedimentary input came from the north (Lausitz Block, southern West-Sudetic Island). A section of Turonian to Coniacian sandstones was sampled in the Elbsandsteingebirge near Schmilka (Elbtal Group, Saxony, Germany). The samples were analysed for their U-Pb age record of detrital zircon using LA-ICP-MS techniques. The results show main age clusters typical for the Bohemian Massif (local material) and are interpreted to reflect the erosion of uniform quartz-dominated sediments and basement rocks. Surprisingly, these rocks lack an expected Upper Proterozoic to Lower Palaeozoic age peak, which would be typical for the basement of the adjacent Lausitz Block (c. 540-c. 560 Ma). Therefore, the Lausitz Block basement must have been covered by younger sediments that acted as source rocks during deposition of the Elbtal Group. The sandstones of the Elbe valley (Elbtal Group, Schmilka section) represent the re-deposited sedimentary cover of the Lausitz Block in inverse order. This cover comprised Permian, Triassic, Jurassic and Lower Cretaceous deposits, which are eroded already today and cannot be investigated. Within the samples of the Elbtal Group (Schmilka section), the zircon age patterns change significantly towards the Lower Coniacian (topmost sample of the analysed section), where a major input of Meso- and Paleoproterozoic grains was obtained. Comparable ages are generally scarce in the working area. To have a reference for the detrital zircon age spectra of Triassic and Jurassic sediments of the area, two Upper Triassic und two Middle Jurassic clastic sediments of Germany were analysed. Surprisingly, the two Middle Jurassic (Dogger) sandstones from Bavaria and Lower Saxony showed similar detrital zircon age compositions as the Coniacian sediments on top of the Schmilka section (Elbe valley, Elbtal Group). In contrast, the two Upper Triassic sediments could be excluded as possible source rocks for the Upper Cretaceous sandstones of the Elbe valley (Schmilka section, Elbtal Group). The Meso- and Paleoproterozoic zircon age populations in the uppermost sandstone sample of the Schmilka section are assumed to originate from recycled Jurassic (Dogger) sandstones, resting on the Lausitz Block. These Middle Jurassic deposits were strongly influenced by a sedimentary input from the Scandinavian region (southern Baltica and North Sea Dome). The Turonian sandstones of the Schmilka section (samples below the topmost Coniacian sample) are interpreted to represent re-deposited Lower Cretaceous sediments resting on the Lausitz Block. A proposed synsedimentary uplift of about 5 km during the Upper Cretaceous along the Lausitz Fold (Lange et al., Zeitschrift der Deutschen Gesellschaft für Geowissenschaften 159(1):123-132, 2008) would have caused erosion of the pre-existing sedimentary cover of the Lausitz Block followed by inverse accumulation of the detritus into the Cretaceous Basin (Elbe valley, Elbtal Group). The Permian and Triassic cover units of the Lausitz Block were not exposed during the Upper Cretaceous, but are assumed to have contributed to younger (post-Coniacian) sediments of the Elbtal Group, which were eroded during uppermost Cretaceous and lower Paleogene. Based on this study, the detrital zircon record of the Jurassic Dogger sandstones of Germany can be seen as "marker ages" for the European Cretaceous Basin inversion. This paper presents the first results of a case study with further investigations in other areas of Europe to follow.

Water vapor sorption properties of cellulose nanocrystals and nanofibers using dynamic vapor sorption apparatus.

PubMed

Guo, Xin; Wu, Yiqiang; Xie, Xinfeng

2017-10-27

Hygroscopic behavior is an inherent characteristic of nanocellulose which strongly affects its applications. In this study, the water vapor sorption behavior of four nanocellulose samples, such as cellulose nanocrystals and nanofibers with cellulose I and II structures (cellulose nanocrystals (CNC) I, CNC II, cellulose nanofibers (CNF) I, and CNF II) were studied by dynamic vapor sorption. The highly reproducible data including the running time, real-time sample mass, target relative humidity (RH), actual RH, and isotherm temperature were recorded during the sorption process. In analyzing these data, significant differences in the total running time, equilibrium moisture content, sorption hysteresis and sorption kinetics between these four nanocellulose samples were confirmed. It was important to note that CNC I, CNC II, CNF I, and CNF II had equilibrium moisture contents of 21.4, 28.6, 33.2, and 38.9%, respectively, at a RH of 95%. Then, the sorption kinetics behavior was accurately described by using the parallel exponential kinetics (PEK) model. Furthermore, the Kelvin-Voigt model was introduced to interpret the PEK behavior and calculate the modulus of these four nanocellulose samples.

Time-resolved viscoelastic properties of self-assembling iron oxide nanocube superlattices probed by quartz crystal microbalance with dissipation monitoring.

PubMed

Kapuscinski, Martin; Agthe, Michael; Bergström, Lennart

2018-07-15

Self-assembly of nanoparticles into superlattices can be used to create hierarchically structured materials with tailored functions. We have used the surface sensitive quartz crystal microbalance with dissipation monitoring (QCM-D) technique in combination with video microscopy (VM) to obtain time-resolved information on the mass increase and rheological properties of evaporation-induced self-assembly of nanocubes. We have recorded the frequency and dissipation shifts during growth and densification of superlattices formed by self-assembly of oleic acid capped, truncated iron oxide nanocubes and analyzed the time-resolved QCM-D data using a Kelvin-Voigt viscoelastic model. We show that the nanoparticles first assemble into solvent-containing arrays dominated by a viscous response followed by a solvent-releasing step that results in the formation of rigid and well-ordered superlattices. Our findings demonstrate that QCM-D can be successfully used to follow self-assembly and assist in the design of optimized routes to produce well-ordered superlattices. Copyright © 2018 The Authors. Published by Elsevier Inc. All rights reserved.

Assessment of Liver Viscoelasticity for the Diagnosis of Early Stage Fatty Liver Disease Using Transient Elastography

NASA Astrophysics Data System (ADS)

Remenieras, Jean-Pierre; Dejobert, Maelle; Bastard, Cécile; Miette, Véronique; Perarnau, Jean-Marc; Patat, Frédéric

Nonalcoholic fatty liver disease (NAFLD) is characterized by accumulation of fat within the Liver. The main objective of this work is (1) to evaluate the feasibility of measuring in vivo in the liver the shear wave phase velocity dispersion cs(ω) between 20 Hz and 90 Hz using vibration-controlled transient elastography (VCTE); (2) to estimate through the rheological Kelvin-Voigt model the shear elastic μ and shear viscosity η modulus; (3) to correlate the evolution of these viscoelastic parameters on two patients at Tours Hospital with the hepatic fat percentage measured with T1-weighted gradient-echo in-and out-phase MRI sequence. For the first volunteer who has 2% of fat in the liver, we obtained μ = 1233 ± 133 Pa and η = 0.5 ± 0.4 Pa.s. For the patient with 22% of fat, we measure μ = 964 ± 91 Pa and η = 1.77 ± 0.3 Pa.s. In conclusion, this novel method showed to be sensitive in characterizing the visco-elastic properties of fatty liver.

High Temperature Elastic Properties of Single Crystal Mullite (Approximately 2.5Al2O3.SiO2) by Brillouin Spectroscopy

NASA Technical Reports Server (NTRS)

Palko, James W.; Sayir, Ali; Sinogeikin, Stanislav V.; Kriven, Waltraud M.; Bass, Jay D.; Farmer, Serene C. (Technical Monitor)

2001-01-01

The complete elastic tensor of mullite has been determined by brillouin spectroscopy at room temperature and elevated temperatures up to 1200C. Equivalent, isotropic moduli (bulk, shear, and Young's) have been calculated. The room temperature values obtained using Voigt-Reuss-Hill averaging are: K(sub VRH) = 173.5 + 6.9 GPa, G(sub VRH) = 88.0 + 3.5 GPa, E(sub VRH) = 225.9 + 9.0 GPa. All moduli show relatively gradual decreases with temperature. The temperature derivatives obtained for the equivalent, isotropic moduli are: dK(sub VRH)/dT = - 17.5 + 2.5 MPa/deg. C, dG(sub VRH)/dT = -8.8 + 1.4 MPa/deg. C, dE(sub VRH)/dT = -22.6 + 2.8 MPa/deg C. Substantial differences between bulk properties calculated from the single crystal measurements in this study and the properties reported in the literature for polycrystalline sintered mullite are identified, indicating the importance of factors such as microstructure, intergranular phases, and composition to the elasticity of mullite ceramics.

Experimental Study of Temperature-Dependence Laws of Non-Voigt Absorption Line Shape Parameters

NASA Astrophysics Data System (ADS)

Wilzewski, Jonas; Birk, Manfred; Loos, Joep; Wagner, Georg

2017-06-01

To improve the understanding of temperature-dependence laws of spectral line shape parameters, spectra of the ν_3 rovibrational band of CO_2 perturbed by 10, 30, 100, 300 and 1000 mbar of N_2 were measured at nine temperatures between 190 K and 330 K using a 22 cm long single-pass absorption cell in a Bruker IFS125 HR Fourier Transform spectrometer. The spectra were fitted employing a quadratic speed-dependent hard collision model in the Hartmann-Tran implementation extended to account for line mixing in the Rosenkranz approximation by means of a multispectrum fitting approach developed at DLR This enables high accuracy parameter retrievals to reproduce the spectra down to noise level and we will present the behavior of line widths, shifts, speed-dependence-, collisional narrowing- and line mixing-parameters over this 140 K temperature range. Tran et al. JQSRT 129, 199-203 (2013); JQSRT 134, 104 (2014). Loos et al., 2014; http://doi.org/10.5281/zenodo.11156. Ngo et al. JQSRT 29, 89-100 (2013); JQSRT 134, 105 (2014).

CGM-GRB: A survey of the CircumGalactic Medium around GRB hosts

NASA Astrophysics Data System (ADS)

Gatkine, Pradip; Veilleux, Sylvain; Cucchiara, Antonino; Cenko, Bradley

2018-01-01

Recent space- and ground-based studies of the circumgalactic medium around galaxies have revealed the dynamic interplay between the galaxy ecosystem and surrounding CGM using bright background quasars. Here, we extend this investigation of the CGM to higher redshifts by using the bright afterglows of gamma-ray bursts as background sources. This provides a unique opportunity to probe the host galaxy ISM and its surrounding CGM together. We compiled a sample of 25 high-resolution (R > 8000) and high-quality (typical S/N ~ 20) rest-frame UV spectra of GRB afterglows with a redshift range (1.5 < z < 5.9) obtained using Keck-HIRES, VLT-UVES, and VLT-X-shooter spectrographs. We fit multi-component Voigt profiles to several absorption lines of both high-ionization (O VI, C IV, Si IV, etc) and low-ionization species (Si II, C II, Fe II, etc) to extract the column densities (N), Doppler parameters (b) and line-centroids. The preliminary results of our analysis on the kinematics and physical properties of the ISM and CGM of these GRB hosts are presented here.

[Gamasid mites of small mammals in the semi-desert territories of the Saratov Trans-Volga region].

PubMed

Porshakov, A M; Yakovlev, S A; Kurnyaeva, A D

2017-01-01

The paper contains the data on the species composition and comparative analysis of gamaside mites, parasitizing on small mammals in the semi-desert territories of Saratov trans-Volga region. On the basis of the results of investigations conducted in the Aleksandrovo-Gaisky District in 2008-2013, 18 species of gamaside mites (9 genusus, 5 families) have been recorded. Nine species of maaside mites, which were not found in semi-desert zone earlier were revealed, includiding Hypoaspis (Stratiolaelaps) miles Berlese, 1882, H. (Geolaelaps) heselhausi Oudemans, 1912, H. (G.) lubrica Oudemans et Voigts, 1604, G. et. R. Canestrini, 1881, Haemogamasus citelli Bregetova et Nelzina, 1952, Hirstionyssus eusoricis Bregetova, 1956, Hi. ellobii Bregetova, 1653; five of these species are new for the territory of Saratov Province. As a result of the study of semi-desert zone of Saratov trans-Volga region and taking into account literary data, parasitic fauna of small mammals of Aleksandrovo-Gaisky District was expanded up to 21 species, and of Saratov Province, up to 44 species of gamasid mites.

Dual-Comb Spectroscopy of the ν_1+ ν_3 Band of Acetylene: Intensity and Transition Dipole Moment

NASA Astrophysics Data System (ADS)

Iwakuni, Kana; Okubo, Sho; Yamada, Koichi MT; Inaba, Hajime; Onae, Atsushi; Hong, Feng-Lei; Sasada, Hiroyuki

2017-06-01

The ν_1+ν_3 vibration band of ^{12}C_2H_2 is recorded with a homemade dual-comb spectrometer. The spectral resolution and the accuracy of frequency determination are high, and the bandwidth is broad enough to take spectrum of the whole band in one shot. The last remarkable competence enables us to record all the spectral lines under constant experimental conditions. The linewidth and line strength of the P(26) to R(29) transitions are determined by fitting the line profile to Lambert-Beer's law with a Voigt function. In the course of analysis, we found the ortho-para dependence of the pressure-broadening coefficient. This time, we have determined the transition dipole moment of the ν_1+ν_3 band. It is noted that the transition dipole moment determined from the ortho lines agrees with that from the para lines. S. Okubo et al., Applied Physics Express 8, 082402 (2015). K.Iwakuni et al., 71th ISMS, WK15 K. Iwakuni et al., Physical Review Letters 117, 143902 (2016).

Inner Core Tomography Under Africa

NASA Astrophysics Data System (ADS)

Irving, J. C. E.

2014-12-01

Hemispherical structure in the inner core has been observed using both normal mode and body wave data, but the more regional scale properties of the inner core are still the subject of ongoing debate. The nature of the vertical boundary regions between the eastern and western hemispheres will be an important constraint on dynamical processes at work in the inner core. With limited data available, earlier inner core studies defined each boundary using one line of longitude, but this may not be a sufficient description for what could be one of the inner core's most heterogeneous regions. Here, I present a large, hand-picked dataset of PKPbc-PKPdf differential travel times which sample the inner core under Africa, where the proposed position of one hemisphere boundary is located. The dataset contains polar, intermediate and equatorial rays through the inner core, and the presence of crossing raypaths makes regional-scale tomography of the inner core feasible. I invert the data to find regional variations in inner core anisotropy under different parts of Africa, and present both anisotropy and voigt isotropic velocity variations of this important portion of the inner core.

Observation of Mollow Triplets with Tunable Interactions in Double Lambda Systems of Individual Hole Spins

NASA Astrophysics Data System (ADS)

Lagoudakis, K. G.; Fischer, K. A.; Sarmiento, T.; McMahon, P. L.; Radulaski, M.; Zhang, J. L.; Kelaita, Y.; Dory, C.; Müller, K.; Vučković, J.

2017-01-01

Although individual spins in quantum dots have been studied extensively as qubits, their investigation under strong resonant driving in the scope of accessing Mollow physics is still an open question. Here, we have grown high quality positively charged quantum dots embedded in a planar microcavity that enable enhanced light-matter interactions. Under a strong magnetic field in the Voigt configuration, individual positively charged quantum dots provide a double lambda level structure. Using a combination of above-band and resonant excitation, we observe the formation of Mollow triplets on all optical transitions. We find that when the strong resonant drive power is used to tune the Mollow-triplet lines through each other, we observe anticrossings. We also demonstrate that the interaction that gives rise to the anticrossings can be controlled in strength by tuning the polarization of the resonant laser drive. Quantum-optical modeling of our system fully captures the experimentally observed spectra and provides insight on the complicated level structure that results from the strong driving of the double lambda system.

Determining the Viscosity Coefficient for Viscoelastic Wave Propagation in Rock Bars

NASA Astrophysics Data System (ADS)

Niu, Leilei; Zhu, Wancheng; Li, Shaohua; Guan, Kai

2018-05-01

Rocks with microdefects exhibit viscoelastic behavior during stress wave propagation. The viscosity coefficient of the wave can be used to characterize the attenuation as the wave propagates in rock. In this study, a long artificial bar with a readily adjustable viscosity coefficient was fabricated to investigate stress wave attenuation. The viscoelastic behavior of the artificial bar under dynamic loading was investigated, and the initial viscoelastic coefficient was obtained based on the amplitude attenuation of the incident harmonic wave. A one-dimensional wave propagation program was compiled to reproduce the time history of the stress wave measured during the experiments, and the program was well fitted to the Kelvin-Voigt model. The attenuation and dispersion of the stress wave in long artificial viscoelastic bars were quantified to accurately determine the viscoelastic coefficient. Finally, the method used to determine the viscoelastic coefficient of a long artificial bar based on the experiments and numerical simulations was extended to determine the viscoelastic coefficient of a short rock bar. This study provides a new method of determining the viscosity coefficient of rock.

Infrared and Raman Study of the Recluse Spider Silk

NASA Astrophysics Data System (ADS)

Wang, S. L.; Wang, Qijue; Xing, Zhen; Schniepp, H. C.; Qazilbash, M. M.

Spider silk exhibits remarkable mechanical properties, such as high tensile strength and toughness. We want to gain insight into the composition and structure of spider silk to discover the origin of these properties. We are especially interested in the organization of the crystalline beta sheets that are expected to contribute to the high strength of the silk from the recluse spider, Loxosceles laeta. The recluse spider produces a silk that has a unique geometry amongst arachnids. We measure the silk's optical properties, particularly the infrared-active and Raman-active vibrations. Broadband infrared transmission spectra were collected in the spectral range between 600 cm-1 and 4000 cm-1, with light polarized parallel and perpendicular to the long axis of the silk. Raman micro-spectroscopy was performed in the spectral range 500 cm-1 and 4000 cm- 1 with a 514 nm laser. The infrared and Raman vibrational modes are fit with Lorentzian and pseudo-Voigt functions. The vibrational modes are assigned to specific structures and electronic bonds in the silk. This work was supported by NASA/ Virginia Space Grant Consortium.

Calculating the Malliavin derivative of some stochastic mechanics problems

PubMed Central

Hauseux, Paul; Hale, Jack S.

2017-01-01

The Malliavin calculus is an extension of the classical calculus of variations from deterministic functions to stochastic processes. In this paper we aim to show in a practical and didactic way how to calculate the Malliavin derivative, the derivative of the expectation of a quantity of interest of a model with respect to its underlying stochastic parameters, for four problems found in mechanics. The non-intrusive approach uses the Malliavin Weight Sampling (MWS) method in conjunction with a standard Monte Carlo method. The models are expressed as ODEs or PDEs and discretised using the finite difference or finite element methods. Specifically, we consider stochastic extensions of; a 1D Kelvin-Voigt viscoelastic model discretised with finite differences, a 1D linear elastic bar, a hyperelastic bar undergoing buckling, and incompressible Navier-Stokes flow around a cylinder, all discretised with finite elements. A further contribution of this paper is an extension of the MWS method to the more difficult case of non-Gaussian random variables and the calculation of second-order derivatives. We provide open-source code for the numerical examples in this paper. PMID:29261776

Fast algorithm for spectral processing with application to on-line welding quality assurance

NASA Astrophysics Data System (ADS)

Mirapeix, J.; Cobo, A.; Jaúregui, C.; López-Higuera, J. M.

2006-10-01

A new technique is presented in this paper for the analysis of welding process emission spectra to accurately estimate in real-time the plasma electronic temperature. The estimation of the electronic temperature of the plasma, through the analysis of the emission lines from multiple atomic species, may be used to monitor possible perturbations during the welding process. Unlike traditional techniques, which usually involve peak fitting to Voigt functions using the Levenberg-Marquardt recursive method, sub-pixel algorithms are used to more accurately estimate the central wavelength of the peaks. Three different sub-pixel algorithms will be analysed and compared, and it will be shown that the LPO (linear phase operator) sub-pixel algorithm is a better solution within the proposed system. Experimental tests during TIG-welding using a fibre optic to capture the arc light, together with a low cost CCD-based spectrometer, show that some typical defects associated with perturbations in the electron temperature can be easily detected and identified with this technique. A typical processing time for multiple peak analysis is less than 20 ms running on a conventional PC.

Ground-based Photon Path Measurements from Solar Absorption Spectra of the O2 A-band

NASA Technical Reports Server (NTRS)

Yang, Z.; Wennberg, P. O.; Cageao, R. P.; Pongetti, T. J.; Toon, G. C.; Sander, S. P.

2005-01-01

High-resolution solar absorption spectra obtained from Table Mountain Facility (TMF, 34.38degN, 117.68degW, 2286 m elevation) have been analyzed in the region of the O2 A-band. The photon paths of direct sunlight in clear sky cases are retrieved from the O2 absorption lines and compared with ray-tracing calculations based on the solar zenith angle and surface pressure. At a given zenith angle, the ratios of retrieved to geometrically derived photon paths are highly precise (approx.0.2%), but they vary as the zenith angle changes. This is because current models of the spectral lineshape in this band do not properly account for the significant absorption that exists far from the centers of saturated lines. For example, use of a Voigt function with Lorentzian far wings results in an error in the retrieved photon path of as much as 5%, highly correlated with solar zenith angle. Adopting a super-Lorentz function reduces, but does not completely eliminate this problem. New lab measurements of the lineshape are required to make further progress.

Constitutive equations for an electroactive polymer

NASA Astrophysics Data System (ADS)

Tixier, Mireille; Pouget, Joël

2016-07-01

Ionic electroactive polymers can be used as sensors or actuators. For this purpose, a thin film of polyelectrolyte is saturated with a solvent and sandwiched between two platinum electrodes. The solvent causes a complete dissociation of the polymer and the release of small cations. The application of an electric field across the thickness results in the bending of the strip and vice versa. The material is modeled by a two-phase continuous medium. The solid phase, constituted by the polymer backbone inlaid with anions, is depicted as a deformable porous media. The liquid phase is composed of the free cations and the solvent (usually water). We used a coarse grain model. The conservation laws of this system have been established in a previous work. The entropy balance law and the thermodynamic relations are first written for each phase and then for the complete material using a statistical average technique and the material derivative concept. One deduces the entropy production. Identifying generalized forces and fluxes provides the constitutive equations of the whole system: the stress-strain relations which satisfy a Kelvin-Voigt model, generalized Fourier's and Darcy's laws and the Nernst-Planck equation.

High-resolution laser absorption spectroscopy of ozone near 1129.4 cm (-1)

NASA Technical Reports Server (NTRS)

Majorana, L. N.

1981-01-01

A Beer's Law experiment was performed with a tunable diode laser to determine self broadened line shape parameters of one infrared absorption ozone line in the nu1 band for ten pressures from 0.26 to 6.29 torr at 285 K. The SO2 line positions were used for wavelength calibration. Line shapes were iteratively fitted to the Voigt function at a Doppler width of 29.54 MHz (HWHM) resulting in values for the integrated line strength, (S), of (0.144 +/- 0.007) x 10 to the minus 20th/cm molecule/cu cm, line center frequency, nu sub o, of 1129.426/cm and the Lorentzian contributions to halfwidth. A linear least squares fit of (alpha sub L)5 as a function of pressure yielded a zero intercept of 15.27 +/- 0.29 MHz (rho = 0.99) and a broadening parameter, (alpha sub L)5, of 5.71 +/- 0.29 MHz/Torr. This results in a line width (FWHM) of 0.144 +/- .007/cm at 760 torr and 285 K.

First-principles study of Al2Sm intermetallic compound on structural, mechanical properties and electronic structure

NASA Astrophysics Data System (ADS)

Lin, Jingwu; Wang, Lei; Hu, Zhi; Li, Xiao; Yan, Hong

2017-02-01

The structural, thermodynamic, mechanical and electronic properties of cubic Al2Sm intermetallic compound are investigated by the first-principles method on the basis of density functional theory. In light of the strong on-site Coulomb repulsion between the highly localized 4f electrons of Sm atoms, the local spin density approximation approach paired with additional Hubbard terms is employed to achieve appropriate results. Moreover, to examine the reliability of this study, the experimental value of lattice parameter is procured from the analysis of the TEM image and diffraction pattern of Al2Sm phase in the AZ31 alloy to verify the authenticity of the results originated from the computational method. The value of cohesive energy reveals Al2Sm to be a stable in absolute zero Kelvin. According to the stability criteria, the subject of this work is mechanically stable. Afterward, elastic moduli are deduced by performing Voigt-Reuss-Hill approximation. Furthermore, elastic anisotropy and anisotropy of sound velocity are discussed. Finally, the calculation of electronic density of states is implemented to explore the underlying mechanism of structural stability.

Local buckling of composite channel columns

NASA Astrophysics Data System (ADS)

Szymczak, Czesław; Kujawa, Marcin

2018-05-01

The investigation concerns local buckling of compressed flanges of axially compressed composite channel columns. Cooperation of the member flange and web is taken into account here. The buckling mode of the member flange is defined by rotation angle a flange about the line of its connection with the web. The channel column under investigation is made of unidirectional fibre-reinforced laminate. Two approaches to member orthotropic material modelling are performed: the homogenization with the aid of theory of mixture and periodicity cell or homogenization upon the Voigt-Reuss hypothesis. The fundamental differential equation of local buckling is derived with the aid of the stationary total potential energy principle. The critical buckling stress corresponding to a number of buckling half-waves is assumed to be a minimum eigenvalue of the equation. Some numerical examples dealing with columns are given here. The analytical results are compared with the finite element stability analysis carried out by means of ABAQUS software. The paper is focused on a close analytical solution of the critical buckling stress and the associated buckling mode while the web-flange cooperation is assumed.

Soft inclusion in a confined fluctuating active gel

NASA Astrophysics Data System (ADS)

Singh Vishen, Amit; Rupprecht, J.-F.; Shivashankar, G. V.; Prost, J.; Rao, Madan

2018-03-01

We study stochastic dynamics of a point and extended inclusion within a one-dimensional confined active viscoelastic gel. We show that the dynamics of a point inclusion can be described by a Langevin equation with a confining potential and multiplicative noise. Using a systematic adiabatic elimination over the fast variables, we arrive at an overdamped equation with a proper definition of the multiplicative noise. To highlight various features and to appeal to different biological contexts, we treat the inclusion in turn as a rigid extended element, an elastic element, and a viscoelastic (Kelvin-Voigt) element. The dynamics for the shape and position of the extended inclusion can be described by coupled Langevin equations. Deriving exact expressions for the corresponding steady-state probability distributions, we find that the active noise induces an attraction to the edges of the confining domain. In the presence of a competing centering force, we find that the shape of the probability distribution exhibits a sharp transition upon varying the amplitude of the active noise. Our results could help understanding the positioning and deformability of biological inclusions, e.g., organelles in cells, or nucleus and cells within tissues.

Single Tracking Location Acoustic Radiation Force Impulse Viscoelasticity Estimation (STL-VE): A Method for Measuring Tissue Viscoelastic Parameters

PubMed Central

Langdon, Jonathan H; Elegbe, Etana; McAleavey, Stephen A

2015-01-01

Single Tracking Location (STL) Shear wave Elasticity Imaging (SWEI) is a method for detecting elastic differences between tissues. It has the advantage of intrinsic speckle bias suppression compared to Multiple Tracking Location (MTL) variants of SWEI. However, the assumption of a linear model leads to an overestimation of the shear modulus in viscoelastic media. A new reconstruction technique denoted Single Tracking Location Viscosity Estimation (STL-VE) is introduced to correct for this overestimation. This technique utilizes the same raw data generated in STL-SWEI imaging. Here, the STL-VE technique is developed by way of a Maximum Likelihood Estimation (MLE) for general viscoelastic materials. The method is then implemented for the particular case of the Kelvin-Voigt Model. Using simulation data, the STL-VE technique is demonstrated and the performance of the estimator is characterized. Finally, the STL-VE method is used to estimate the viscoelastic parameters of ex-vivo bovine liver. We find good agreement between the STL-VE results and the simulation parameters as well as between the liver shear wave data and the modeled data fit. PMID:26168170

Investigation of different physical aspects such as structural, mechanical, optical properties and Debye temperature of Fe2ScM (M=P and As) semiconductors: A DFT-based first principles study

NASA Astrophysics Data System (ADS)

Ali, Md. Lokman; Rahaman, Md. Zahidur

2018-04-01

By using first principles calculation dependent on the density functional theory (DFT), we have investigated the mechanical, structural properties and the Debye temperature of Fe2ScM (M=P and As) compounds under various pressures up to 60 GPa. The optical properties have been investigated under zero pressure. Our calculated optimized structural parameters of both the materials are in good agreement with other theoretical predictions. The calculated elastic constants show that Fe2ScM (M=P and As) compounds are mechanically stable under external pressure below 60 GPa. From the elastic constants, the shear modulus G, the bulk modulus B, Young’s modulus E, anisotropy factor A and Poisson’s ratio ν are calculated by using the Voigt-Reuss-Hill approximation. The Debye temperature and average sound velocities are also investigated from the obtained elastic constants. The detailed analysis of all optical functions reveals that both compounds are good dielectric material.

Acoustic and elastic waveform inversion best practices

NASA Astrophysics Data System (ADS)

Modrak, Ryan T.

Reaching the global minimum of a waveform misfit function requires careful choices about the nonlinear optimization, preconditioning and regularization methods underlying an inversion. Because waveform inversion problems are susceptible to erratic convergence, one or two test cases are not enough to reliably inform such decisions. We identify best practices instead using two global, one regional and four near-surface acoustic test problems. To obtain meaningful quantitative comparisons, we carry out hundreds acoustic inversions, varying one aspect of the implementation at a time. Comparing nonlinear optimization algorithms, we find that L-BFGS provides computational savings over nonlinear conjugate gradient methods in a wide variety of test cases. Comparing preconditioners, we show that a new diagonal scaling derived from the adjoint of the forward operator provides better performance than two conventional preconditioning schemes. Comparing regularization strategies, we find that projection, convolution, Tikhonov regularization, and total variation regularization are effective in different contexts. Besides these issues, reliability and efficiency in waveform inversion depend on close numerical attention and care. Implementation details have a strong effect on computational cost, regardless of the chosen material parameterization or nonlinear optimization algorithm. Building on the acoustic inversion results, we carry out elastic experiments with four test problems, three objective functions, and four material parameterizations. The choice of parameterization for isotropic elastic media is found to be more complicated than previous studies suggests, with "wavespeed-like'' parameters performing well with phase-based objective functions and Lame parameters performing well with amplitude-based objective functions. Reliability and efficiency can be even harder to achieve in transversely isotropic elastic inversions because rotation angle parameters describing fast-axis direction are difficult to recover. Using Voigt or Chen-Tromp parameters avoids the need to include rotation angles explicitly and provides an effective strategy for anisotropic inversion. The need for flexible and portable workflow management tools for seismic inversion also poses a major challenge. In a final chapter, the software used to the carry out the above experiments is described and instructions for reproducing experimental results are given.

Postseismic Deformations of the Aceh, Nias and Benkulu Earthquakes and the Viscoelastic Properties of the Mantle

NASA Astrophysics Data System (ADS)

Fleitout, L.; Garaud, J.; Cailletaud, G.; Vigny, C.; Simons, W. J.; Ambrosius, B. A.; Trisirisatayawong, I.; Satirapod, C.; Geotecdi Song

2011-12-01

The giant seism of Aceh (december 2004),followed by the Nias and Bengkulu earthquakes, broke a large portion of the boundary between the Indian ocean and the Sunda block. For the first time in history, the deformations associated with a very large earthquake can be followed by GPS, in particular by the SEAMERGE (far-field) and SUGAR (near-field) GPS networks. A 3D finite element code (Zebulon-Zset) is used to model both the cosismic and the postseismic deformations. The modeled zone is a large portion of spherical shell around Sumatra extanding over more than 60 degrees in latitude and longitude and from the Earth's surface to the core-mantle boundary. The mesh is refined close to the subduction zone. First, the inverted cosismic displacements on the subduction plane are inverted for and provide a very good fit to the GPS data for the three seisms. The observed postseismic displacements, non-dimensionalized by the cosismic displacements, present three very different patterns as function of time: For GPS stations in the far-field, the total horizontal post-seismic displacement after 4 years is as large as the cosismic displacement. The velocities vary slowly over 4 years. A large subsidence affects Thailand and Malaysia. In the near-field, the postseismic displacement reaches only some 15% of the cosismic displacement and it levels off after 2 years. In the middle-field (south-west coast of Sumatra), the postseismic displacement also levels-off with time but more slowly and it reaches more than 30% of the cosismic displacement after four years. In order to fit these three distinct displacement patterns, we need to invoke both viscoelastic deformation in the asthenosphere and a low-viscosity wedge: Neither the vertical subsidence nor the amplitude of the far-field horizontal velocities could be explained by postseismic sliding on the subduction interface. The low viscosity wedge permits to explain the large middle-field velocities. The viscoelastic properties of the asthenosphere are consistent with a Burger rheology with a transient creep represented by a Kelvin-Voigt element with a viscosity of 3.1018Pas and μ Kelvin}=μ {elastic/3. A second Kelvin-Voigt element with very limited amplitude may explain some characteristics of the short time-scale signal. The viscosity of the low viscosity wedge is also of the order of 3. 1018 Pas. The near-field displacements are not explained by viscoelastic relaxation and post-seismic slip on the fault plane (15% of the cosismic slip) occured in the months after the earthquakes. These large post-seismic deformations affect the deviatoric stresses in the whole Sunda-block. They also imply sizable far-field interseismic deformations.

Gemini long-slit observations of luminous obscured quasars: Further evidence for an upper limit on the size of the narrow-line region

DOE Office of Scientific and Technical Information (OSTI.GOV)

Hainline, Kevin N.; Hickox, Ryan C.; Greene, Jenny E.

2014-05-20

We examine the spatial extent of the narrow-line regions (NLRs) of a sample of 30 luminous obscured quasars at 0.4 < z < 0.7 observed with spatially resolved Gemini-N GMOS long-slit spectroscopy. Using the [O III] λ5007 emission feature, we estimate the size of the NLR using a cosmology-independent measurement: the radius where the surface brightness falls to 10{sup –15} erg s{sup –1} cm{sup –2} arcsec{sup –2}. We then explore the effects of atmospheric seeing on NLR size measurements and conclude that direct measurements of the NLR size from observed profiles are too large by 0.1-0.2 dex on average, asmore » compared to measurements made to best-fit Sérsic or Voigt profiles convolved with the seeing. These data, which span a full order of magnitude in IR luminosity (log (L {sub 8} {sub μm}/erg s{sup –1}) = 44.4-45.4), also provide strong evidence that there is a flattening of the relationship between NLR size and active galactic nucleus luminosity at a seeing-corrected size of ∼7 kpc. The objects in this sample have high luminosities which place them in a previously under-explored portion of the size-luminosity relationship. These results support the existence of a maximal size of the NLR around luminous quasars; beyond this size, there is either not enough gas or the gas is over-ionized and does not produce enough [O III] λ5007 emission.« less

Chimeric β-Lactamases: Global Conservation of Parental Function and Fast Time-Scale Dynamics with Increased Slow Motions

PubMed Central

Clouthier, Christopher M.; Morin, Sébastien; Gobeil, Sophie M. C.; Doucet, Nicolas; Blanchet, Jonathan; Nguyen, Elisabeth; Gagné, Stéphane M.; Pelletier, Joelle N.

2012-01-01

Enzyme engineering has been facilitated by recombination of close homologues, followed by functional screening. In one such effort, chimeras of two class-A β-lactamases – TEM-1 and PSE-4 – were created according to structure-guided protein recombination and selected for their capacity to promote bacterial proliferation in the presence of ampicillin (Voigt et al., Nat. Struct. Biol. 2002 9:553). To provide a more detailed assessment of the effects of protein recombination on the structure and function of the resulting chimeric enzymes, we characterized a series of functional TEM-1/PSE-4 chimeras possessing between 17 and 92 substitutions relative to TEM-1 β-lactamase. Circular dichroism and thermal scanning fluorimetry revealed that the chimeras were generally well folded. Despite harbouring important sequence variation relative to either of the two ‘parental’ β-lactamases, the chimeric β-lactamases displayed substrate recognition spectra and reactivity similar to their most closely-related parent. To gain further insight into the changes induced by chimerization, the chimera with 17 substitutions was investigated by NMR spin relaxation. While high order was conserved on the ps-ns timescale, a hallmark of class A β-lactamases, evidence of additional slow motions on the µs-ms timescale was extracted from model-free calculations. This is consistent with the greater number of resonances that could not be assigned in this chimera relative to the parental β-lactamases, and is consistent with this well-folded and functional chimeric β-lactamase displaying increased slow time-scale motions. PMID:23284969

How preservation time changes the linear viscoelastic properties of porcine liver.

PubMed

Wex, C; Stoll, A; Fröhlich, M; Arndt, S; Lippert, H

2013-01-01

The preservation time of a liver graft is one of the crucial factors for the success of a liver transplantation. Grafts are kept in a preservation solution to delay cell destruction and cellular edema and to maximize organ function after transplantation. However, longer preservation times are not always avoidable. In this paper we focus on the mechanical changes of porcine liver with increasing preservation time, in order to establish an indicator for the quality of a liver graft dependent on preservation time. A time interval of 26 h was covered and the rheological properties of liver tissue studied using a stress-controlled rheometer. For samples of 1 h preservation time 0.8% strain was found as the limit of linear viscoelasticity. With increasing preservation time a decrease in the complex shear modulus as an indicator for stiffness was observed for the frequency range from 0.1 to 10 Hz. A simple fractional derivative representation of the Kelvin Voigt model was applied to gain further information about the changes of the mechanical properties of liver with increasing preservation time. Within the small shear rate interval of 0.0001-0.01 s⁻¹ the liver showed Newtonian-like flow behavior.

Viscous-to-viscoelastic transition in phononic crystal and metamaterial band structures.

PubMed

Frazier, Michael J; Hussein, Mahmoud I

2015-11-01

The dispersive behavior of phononic crystals and locally resonant metamaterials is influenced by the type and degree of damping in the unit cell. Dissipation arising from viscoelastic damping is influenced by the past history of motion because the elastic component of the damping mechanism adds a storage capacity. Following a state-space framework, a Bloch eigenvalue problem incorporating general viscoelastic damping based on the Zener model is constructed. In this approach, the conventional Kelvin-Voigt viscous-damping model is recovered as a special case. In a continuous fashion, the influence of the elastic component of the damping mechanism on the band structure of both a phononic crystal and a metamaterial is examined. While viscous damping generally narrows a band gap, the hereditary nature of the viscoelastic conditions reverses this behavior. In the limit of vanishing heredity, the transition between the two regimes is analyzed. The presented theory also allows increases in modal dissipation enhancement (metadamping) to be quantified as the type of damping transitions from viscoelastic to viscous. In conclusion, it is shown that engineering the dissipation allows one to control the dispersion (large versus small band gaps) and, conversely, engineering the dispersion affects the degree of dissipation (high or low metadamping).

VizieR Online Data Catalog: CoRoT red giants abundances (Morel+, 2014)

NASA Astrophysics Data System (ADS)

Morel, T.; Miglio, A.; Lagarde, N.; Montalban, J.; Rainer, M.; Poretti, E.; Eggenberger, P.; Hekker, S.; Kallinger, T.; Mosser, B.; Valentini, M.; Carrier, F.; Hareter, M.; Mantegazza, L.

2014-02-01

The equivalent widths were measured manually assuming Gaussian profiles or Voigt profiles for the few lines with extended damping wings. Lines with an unsatisfactory fit or significantly affected by telluric features were discarded. Only values eventually retained for the analysis are provided. For the chemical abundances, the usual notation is used: [X/Y]=[log({epsilon}(X))-log({epsilon}(Y))]star - [log({epsilon}(X))-log({epsilon}(Y))]⊙ with log{epsilon}(X)=12+log[N(X)/N(H)] (N is the number density of the species). For lithium, the following notation is used: [Li/H]=log(N(Li))star-log(N(Li))⊙. The adopted solar abundances are taken from Grevesse & Sauval (1998SSRv...85..161G), except for Li for which we adopt our derived values: log({epsilon}(Li))⊙=1.09 and 1.13 in LTE and NLTE, respectively (see text). All the abundances are computed under the assumption of LTE, except Li for which values corrected for departures from LTE using the data of Lind et al. (2009A&A...503..541L) are also provided. All the quoted error bars are 1-sigma uncertainties. (6 data files).

Viscoelastic and fatigue properties of model methacrylate-based dentin adhesives

PubMed Central

Singh, Viraj; Misra, Anil; Marangos, Orestes; Park, Jonggu; Ye, Qiang; Kieweg, Sarah L.; Spencer, Paulette

2013-01-01

The objective of the current study is to characterize the viscoelastic and fatigue properties of model methacrylate-based dentin adhesives under dry and wet conditions. Static, creep, and fatigue tests were performed on cylindrical samples in a 3-point bending clamp. Static results showed that the apparent elastic modulus of the model adhesive varied from 2.56 to 3.53 GPa in the dry condition, and from 1.04 to 1.62 GPa in the wet condition, depending upon the rate of loading. Significant differences were also found for the creep behavior of the model adhesive under dry and wet conditions. A linear viscoelastic model was developed by fitting the adhesive creep behavior. The developed model with 5 Kelvin Voigt elements predicted the apparent elastic moduli measured in the static tests. The model was then utilized to interpret the fatigue test results. It was found that the failure under cyclic loading can be due to creep or fatigue, which has implications for the failure criterion that are applied for these types of tests. Finally, it was found that the adhesive samples tested under dry conditions were more durable than those tested under wet conditions. PMID:20848661

Modelling viscoacoustic wave propagation with the lattice Boltzmann method.

PubMed

Xia, Muming; Wang, Shucheng; Zhou, Hui; Shan, Xiaowen; Chen, Hanming; Li, Qingqing; Zhang, Qingchen

2017-08-31

In this paper, the lattice Boltzmann method (LBM) is employed to simulate wave propagation in viscous media. LBM is a kind of microscopic method for modelling waves through tracking the evolution states of a large number of discrete particles. By choosing different relaxation times in LBM experiments and using spectrum ratio method, we can reveal the relationship between the quality factor Q and the parameter τ in LBM. A two-dimensional (2D) homogeneous model and a two-layered model are tested in the numerical experiments, and the LBM results are compared against the reference solution of the viscoacoustic equations based on the Kelvin-Voigt model calculated by finite difference method (FDM). The wavefields and amplitude spectra obtained by LBM coincide with those by FDM, which demonstrates the capability of the LBM with one relaxation time. The new scheme is relatively simple and efficient to implement compared with the traditional lattice methods. In addition, through a mass of experiments, we find that the relaxation time of LBM has a quantitative relationship with Q. Such a novel scheme offers an alternative forward modelling kernel for seismic inversion and a new model to describe the underground media.

Ground state initialization in a doubly-charged, vertically-stacked InAs quantum dot molecule

NASA Astrophysics Data System (ADS)

Ross, Aaron; Chow, Colin; Sham, Lu; Bracker, Allan; Gammon, Daniel; Steel, Duncan

2015-03-01

We report on the rapid optical initialization of a subset of the two-electron ground states of a self-assembled, vertically stacked InAs quantum dot molecule, where the states of the electron are approximately localized to separate quantum dots with very little spatial overlap. Four eigenstates, a singlet and three triplets (S,T0,T+, T-) , arise from the exchange coupling and are identified via bias-dependent photoluminescence measurements. The degeneracy of the triplet states is lifted using an in-plane magnetic field (Voigt geometry). This allows for the determination of the in-plane electron and hole g-factors using differential transmission measurements in the co-tunneling regime (to avoid optical pumping). Three of the four eigenstates (S,T+, T-) can then be initialized with high fidelity using continuous wave (CW) optical pumping. Optical transition degeneracies prohibit simple CW initialization of the T0 state. Efforts towards near-unity initialization of the T0 state via two-photon Raman transitions will be presented. This work represents the first step in demonstrating a two-qubit quantum register based on electron spins in self-assembled quantum dots. This work is supported by NSF, ARO, AFSOR, DARPA, and ONR.

Random walks of colloidal probes in viscoelastic materials

NASA Astrophysics Data System (ADS)

Khan, Manas; Mason, Thomas G.

2014-04-01

To overcome limitations of using a single fixed time step in random walk simulations, such as those that rely on the classic Wiener approach, we have developed an algorithm for exploring random walks based on random temporal steps that are uniformly distributed in logarithmic time. This improvement enables us to generate random-walk trajectories of probe particles that span a highly extended dynamic range in time, thereby facilitating the exploration of probe motion in soft viscoelastic materials. By combining this faster approach with a Maxwell-Voigt model (MVM) of linear viscoelasticity, based on a slowly diffusing harmonically bound Brownian particle, we rapidly create trajectories of spherical probes in soft viscoelastic materials over more than 12 orders of magnitude in time. Appropriate windowing of these trajectories over different time intervals demonstrates that random walk for the MVM is neither self-similar nor self-affine, even if the viscoelastic material is isotropic. We extend this approach to spatially anisotropic viscoelastic materials, using binning to calculate the anisotropic mean square displacements and creep compliances along different orthogonal directions. The elimination of a fixed time step in simulations of random processes, including random walks, opens up interesting possibilities for modeling dynamics and response over a highly extended temporal dynamic range.

Changes in the state of heat-resistant steel induced by repeated hot deformation

NASA Astrophysics Data System (ADS)

Lyubimova, Lyudmila L.; Fisenko, Roman N.; Tashlykov, Alexander A.; Tabakaev, Roman B.

2018-01-01

This work deals with the problems of structural regeneration by thermal restoration treatment (TRT). These include the lack of a structural sign showing that TRT is possible, a consensus on TRT modes, the data on the necessary relaxation depth of residual stresses, or criteria of structural restoration. Performing a TRT without solving these problems may deteriorate the properties of steel or even accelerate its destruction. With this in view, the purpose of this work is to determine experimentally how the residual stress state changes under thermal and mechanical loads in order to specify the signs of the restoration of structure and structural stability. The object of this research is unused 12Cr1MoV steel that has been aged naturally for 13 years. Using X-ray dosimetry with X-ray spectral analysis, we study the distribution of internal residual stresses of the first kind during the repeated hot deformation. After repeated thermal deformation, the sample under study transforms from a viscoelastic Maxwell material into a Kelvin-Voigt material, which facilitates structural stabilization. A sign of this is the relaxation limit increase, prevention of continuous decay of an α-solid solution of iron and restoration of the lattice parameter.

Theoretical and experimental analysis of an equivalent circuit model for the investigation of shallow landmines with acoustic methods

NASA Astrophysics Data System (ADS)

Borgioli, G.; Bulletti, A.; Calzolai, M.; Capineri, L.; Falorni, P.; Masotti, L.; Valentini, S.; Windsor, C.

2007-10-01

Acoustic methods have been recently investigated for the detection of shallow landmines. Some plastic landmines have a flexible case which can made to vibrate by an airborne excitation like a loudspeaker. The soil-mine system shows a resonant behavior which is used as a signature to discriminate from other rigid objects. The mechanical resonance can be detected at the soil surface by a remote sensing systems like a laser interferometer. An equivalent physical model of the mine-soil system has been investigated having the known physical characteristics of mine simulants. The authors designed and built a test-object with known mechanical characteristics (mass, elasticity, damping factor). The model has been characterized in laboratory and the results compared with the classic mass-spring loss oscillator described by Voigt. The vibrations at the soil surface have been measured in various positions with a micro machined accelerometer. The results of the simulations for the acceleration of the soil-mine system agree well with the experiment. The calibrated mine model is useful to investigate the variation of the resonance frequency for various buried depths and to compare the results for different soils in different environmental conditions.

Electromechanical Impedance Response of a Cracked Timoshenko Beam

PubMed Central

Zhang, Yuxiang; Xu, Fuhou; Chen, Jiazhao; Wu, Cuiqin; Wen, Dongdong

2011-01-01

Typically, the Electromechanical Impedance (EMI) technique does not use an analytical model for basic damage identification. However, an accurate model is necessary for getting more information about any damage. In this paper, an EMI model is presented for predicting the electromechanical impedance of a cracked beam structure quantitatively. A coupled system of a cracked Timoshenko beam with a pair of PZT patches bonded on the top and bottom surfaces has been considered, where the bonding layers are assumed as a Kelvin-Voigt material. The shear lag model is introduced to describe the load transfer between the PZT patches and the beam structure. The beam crack is simulated as a massless torsional spring; the dynamic equations of the coupled system are derived, which include the crack information and the inertial forces of both PZT patches and adhesive layers. According to the boundary conditions and continuity conditions, the analytical expression of the admittance of PZT patch is obtained. In the case study, the influences of crack and the inertial forces of PZT patches are analyzed. The results show that: (1) the inertial forces affects significantly in high frequency band; and (2) the use of appropriate frequency range can improve the accuracy of damage identification. PMID:22164017

Pulsed laser-deposited VO2 thin films on Pt layers

NASA Astrophysics Data System (ADS)

Sakai, Joe; Zaghrioui, Mustapha; Ta Phuoc, Vinh; Roger, Sylvain; Autret-Lambert, Cécile; Okimura, Kunio

2013-03-01

VO2 films were deposited on Pt (111)/TiO2/SiO2/Si (001) substrates by means of a pulsed laser deposition technique. An x-ray diffraction peak at 2θ = 39.9° was deconvoluted into two pseudo-Voigt profiles of Pt (111) and VOx-originated components. The VOx diffraction peak was more obvious in a VOx/Pt (111)/Al2O3 (0001) sample, having a narrower width compared with a VO2/Al2O3 (0001) sample. Temperature-controlled Raman spectroscopy for the VOx/Pt/TiO2/SiO2/Si sample has revealed the monoclinic VO2 phase at low temperature and the structural phase transition at about 72 °C in a heating process. The electronic conductive nature at the high temperature phase was confirmed by near normal incidence infrared reflectivity measurements. Out-of-plane current-voltage characteristics showed an electric field-induced resistance switching at a voltage as low as 0.2 V for a 50 nm-thick film. A survey of present and previous results suggests an experimental law that the transition voltage of VO2 is proportional to the square root of the electrodes distance.

Anelastic characterization of soft poroelastic materials by anelastography

NASA Astrophysics Data System (ADS)

Flores B, Carolina; Ammann, Jean Jacques; Rivera, Ricardo

2008-11-01

This paper presents the ID characterization of the local anelastic strain determined in soft poroelastic materials through acoustic scattering in a creep test configuration. Backscattering signals are obtained at successive times in a specimen submitted to a constant stress, applied coaxially to the acoustic beam of a 5 MHz ultrasonic transducer operated in pulse-echo mode. The local displacement is measured by determining the local shift between the RF traces by performing a running cross-correlation operation between equivalent segments extracted from two pairs of RF traces. The local strain the in the specimen is obtained as the displacement gradient. The method has been implemented on biphasic porous materials that present poroelastic behaviors such as synthetic latex sponges impregnated with viscous liquids. The strain/time curves have been interpreted through a continuous bimodal anelastic model (CBA), composed of an infinite set of Kelvin-Voigt cells connected in series with an elastic spring. The fit of an experimental strain/time curve selected at a specific depth through the CBA model allow characterizing the local anelastic behavior through a set of 7 characteristics parameters for the specimen at this location: three short-term and three long-term anelastic parameters and one elastic constant.

Lineshape test on overlapped transitions (R9F1, R9F2) of the 2v3 band of 12CH4 by frequency-stabilized cavity ring-down spectroscopy

NASA Astrophysics Data System (ADS)

Yang, L.; Lin, H.; Plimmer, M. D.; Feng, X. J.; Zhang, J. T.

2018-05-01

The performances of a multi-spectral fit for the spectra of pressure-broadened overlapping lines (R9F1, R9F2) of 12CH4 in binary mixtures with N2 were studied by applying different lineshape models, from the simplest Voigt profile (VP) to the Harmann-Tran profile (HTP). Line-mixing was approximated in the first order in the spectral fits. Data were acquired using a high-resolution cavity ring-down spectrometer of minimum detectable absorption coefficient of 2.8 × 10-12 cm-1. The lines were observed with a signal-to-noise ratio of 19 365 for pressures from 5 to 40 kPa. The study reveals that the multi-spectral fits using the HTP and the speed-dependent Nelkin-Ghatak profile (SDNGP) yield the best among all tested. The two models gave the maximum relative residuals of less than 0.065 %. All things considered, the HTP and the SDNGP appear to be the most reliable models for treating the present case of multi-spectral fitting of unresolved dual-component spectra.

NIR small arms muzzle flash

NASA Astrophysics Data System (ADS)

Montoya, Joseph; Kennerly, Stephen; Rede, Edward

2010-04-01

Utilization of Near-Infrared (NIR) spectral features in a muzzle flash will allow for small arms detection using low cost silicon (Si)-based imagers. Detection of a small arms muzzle flash in a particular wavelength region is dependent on the intensity of that emission, the efficiency of source emission transmission through the atmosphere, and the relative intensity of the background scene. The NIR muzzle flash signature exists in the relatively large Si spectral response wavelength region of 300 nm-1100 nm, which allows for use of commercial-off-the-shelf (COTS) Si-based detectors. The alkali metal origin of the NIR spectral features in the 7.62 × 39-mm round muzzle flash is discussed, and the basis for the spectral bandwidth is examined, using a calculated Voigt profile. This report will introduce a model of the 7.62 × 39-mm NIR muzzle flash signature based on predicted source characteristics. Atmospheric limitations based on NIR spectral regions are investigated in relation to the NIR muzzle flash signature. A simple signal-to-clutter ratio (SCR) metric is used to predict sensor performance based on a model of radiance for the source and solar background and pixel registered image subtraction.

Bioerosion and encrustation: Evidences from the Middle ‒ Upper Jurassic of central Saudi Arabia

NASA Astrophysics Data System (ADS)

El-Hedeny, Magdy; El-Sabbagh, Ahmed; Al Farraj, Saleh

2017-10-01

The Middle ‒ Upper Jurassic hard substrates of central Saudi Arabia displayed considerable signs of bioerosion and encrustations. They include organic (oysters, other bivalves, gastropods, corals and brachiopods) and an inorganic carbonate hardground that marks the boundary between the Middle Jurassic Tuwaiq Mountain Limestone and the Upper Jurassic Hanifa Formation. Traces of bioerosion in organic substrates include seven ichnotaxa produced by bivalves (Gastrochaenolites Leymerie, 1842), polychaete annelids (Trypanites Mägdefrau, 1932; MaeandropolydoraVoigt, 1965 and CaulostrepsisClarke, 1908), sponges (Entobia Bronn, 1837), acrothoracican cirripedes (Rogerella Saint-Seine, 1951), gastropods (Oichnus Bromley, 1981) and probable ?Centrichnus cf. eccentricus. The encrusting epifauna on these substrates consist of several organisms, including oysters, serpulid worms, corals and foraminifera. In contrast, the carbonate hardground was only bioeroded by Gastrochaenolite, Trypanites and Entobia. Epibionts on this hardground include ;Liostrea Douvillé, 1904-type; oysters, Nanogyra nana Sowerby, 1822 and serpulids. In general, bioerosion and encrustation are less diversified in hardground than in organic substrates, indicating a long time of exposition of organic substrates with slow to moderate rate of deposition in a restricted marine environment. Both organic and inorganic commuinities are correlated with those of other equatorial, subtropical and temperate equivalents.

Laser absorption of nitric oxide for thermometry in high-enthalpy air

NASA Astrophysics Data System (ADS)

Spearrin, R. M.; Schultz, I. A.; Jeffries, J. B.; Hanson, R. K.

2014-12-01

The design and demonstration of a laser absorption sensor for thermometry in high-enthalpy air is presented. The sensor exploits the highly temperature-sensitive and largely pressure-independent concentration of nitric oxide in air at chemical equilibrium. Temperature is thus inferred from an in situ measurement of nascent nitric oxide. The strategy is developed by utilizing a quantum cascade laser source for access to the strong fundamental absorption band in the mid-infrared spectrum of nitric oxide. Room temperature measurements in a high-pressure static cell validate the suitability of the Voigt lineshape model to the nitric oxide spectra at high gas densities. Shock-tube experiments enable calibration of a collision-broadening model for temperatures between 1200-3000 K. Finally, sensor performance is demonstrated in a high-pressure shock tube by measuring temperature behind reflected shock waves for both fixed-chemistry experiments where nitric oxide is seeded, and for experiments involving nitric oxide formation in shock-heated mixtures of N2 and O2. Results show excellent performance of the sensor across a wide range of operating conditions from 1100-2950 K and at pressures up to 140 atm.

Deduced elasticity of sp3-bonded amorphous diamond

NASA Astrophysics Data System (ADS)

Ballato, J.; Ballato, A.

2017-11-01

Amorphous diamond was recently synthesized using high temperature and pressure techniques [Z. Zeng, L. Yang, Q. Zeng, H. Lou, H. Sheng, J. Wen, D. J. Miller, Y. Meng, W. Yang, W. L. Mao, and H. K. Mao, Nat. Commun. 8, 322 (2017)]. Here, selected physical properties of this new phase of carbon are deduced using an extension of the Voigt-Reuss-Hill (VRHx) methodology whereby single crystal values are averaged over all orientations to yield values for the amorphous analog. Specifically, the elastic constants were deduced to be c11 = 1156.5 GPa, c12 = 87.6 GPa, and c44 = 534.5 GPa, whereas the Young's modulus, bulk modulus, and Poisson's ratio were also estimated to be 1144.2 GPa, 443.9 GPa, and 0.0704, respectively. These numbers are compared with experimental and theoretical literature values for other allotropic forms, specifically, Lonsdaleite, and two forms each of graphite and amorphous carbon. It is unknown at this time how the high temperature and pressure synthesis approach employed influences the structure, hence properties, of amorphous diamond at room temperature. However, the values provided herein constitute a baseline against which future structure/property/processing analyses can be compared.

Revisiting elastic anisotropy of biotite gneiss from the Outokumpu scientific drill hole based on new texture measurements and texture-based velocity calculations

NASA Astrophysics Data System (ADS)

Wenk, H.-R.; Vasin, R. N.; Kern, H.; Matthies, S.; Vogel, S. C.; Ivankina, T. I.

2012-10-01

A sample of biotite gneiss from the Outokumpu deep drilling project in Finland was investigated by Kern et al. (2008) for crystal preferred orientation and elastic anisotropy. Considerable differences between measured acoustic velocities and velocities calculated on the basis of texture patterns were observed. Measured P-wave anisotropy was 15.1% versus a Voigt average yielding 7.9%. Here we investigate the same sample with different methods and using different averaging techniques. Analyzing time-of-flight neutron diffraction data from Dubna-SKAT and LANSCE-HIPPO diffractometers with the Rietveld technique, much stronger preferred orientation for biotite is determined, compared to conventional pole-figure analysis reported previously. The comparison reveals important differences: HIPPO has much better counting statistics but pole figure coverage is poor. SKAT has better angular resolution. Using the new preferred orientation data and applying a self-consistent averaging method that takes grain shapes into account, close agreement of calculated and measured P-wave velocities is observed (12.6%). This is further improved by adding 0.1 vol.% flat micropores parallel to the biotite platelets in the simulation (14.9%).

Investigation of the collision line broadening problem as applicable to the NASA Optical Plume Anomaly Detection (OPAD) system, phase 1

NASA Astrophysics Data System (ADS)

Dean, Timothy C.; Ventrice, Carl A.

1995-05-01

As a final report for phase 1 of the project, the researchers are submitting to the Tennessee Tech Office of Research the following two papers (reprinted in this report): 'Collision Line Broadening Effects on Spectrometric Data from the Optical Plume Anomaly System (OPAD),' presented at the 30th AIAA/ASME/SAE/ASEE Joint Propulsion Conference, 27-29 June 1994, and 'Calculation of Collision Cross Sections for Atomic Line Broadening in the Plume of the Space Shuttle Main Engine (SSME),' presented at the IEEE Southeastcon '95, 26-29 March 1995. These papers fully state the problem and the progress made up to the end of NASA Fiscal Year 1994. The NASA OPAD system was devised to predict concentrations of anomalous species in the plume of the Space Shuttle Main Engine (SSME) through analysis of spectrometric data. The self absorption of the radiation of these plume anomalies is highly dependent on the line shape of the atomic transition of interest. The Collision Line Broadening paper discusses the methods used to predict line shapes of atomic transitions in the environment of a rocket plume. The Voigt profile is used as the line shape factor since both Doppler and collisional line broadening are significant. Methods used to determine the collisional cross sections are discussed and the results are given and compared with experimental data. These collisional cross sections are then incorporated into the current self absorbing radiative model and the predicted spectrum is compared to actual spectral data collected from the Stennis Space Center Diagnostic Test Facility rocket engine. The second paper included in this report investigates an analytical method for determining the cross sections for collision line broadening by molecular perturbers, using effective central force interaction potentials. These cross sections are determined for several atomic species with H2, one of the principal constituents of the SSME plume environment, and compared with experimental data.

Contact resonances of U-shaped atomic force microscope probes

DOE Office of Scientific and Technical Information (OSTI.GOV)

Rezaei, E.; Turner, J. A., E-mail: jaturner@unl.edu

Recent approaches used to characterize the elastic or viscoelastic properties of materials with nanoscale resolution have focused on the contact resonances of atomic force microscope (CR-AFM) probes. The experiments for these CR-AFM methods involve measurement of several contact resonances from which the resonant frequency and peak width are found. The contact resonance values are then compared with the noncontact values in order for the sample properties to be evaluated. The data analysis requires vibration models associated with the probe during contact in order for the beam response to be deconvolved from the measured spectra. To date, the majority of CR-AFMmore » research has used rectangular probes that have a relatively simple vibration response. Recently, U-shaped AFM probes have created much interest because they allow local sample heating. However, the vibration response of these probes is much more complex such that CR-AFM is still in its infancy. In this article, a simplified analytical model of U-shaped probes is evaluated for contact resonance applications relative to a more complex finite element (FE) computational model. The tip-sample contact is modeled using three orthogonal Kelvin-Voigt elements such that the resonant frequency and peak width of each mode are functions of the contact conditions. For the purely elastic case, the frequency results of the simple model are within 8% of the FE model for the lowest six modes over a wide range of contact stiffness values. Results for the viscoelastic contact problem for which the quality factor of the lowest six modes is compared show agreement to within 13%. These results suggest that this simple model can be used effectively to evaluate CR-AFM experimental results during AFM scanning such that quantitative mapping of viscoelastic properties may be possible using U-shaped probes.« less

The pressure dependence of physical properties of (W2/3Ti1/3)3AlC2 and its counterpart W3AlC2 by first-principles calculations

NASA Astrophysics Data System (ADS)

Li, Yefei; Sun, Liang; Xing, Jiandong; Ma, Shengqiang; Zheng, Qiaoling; Liu, Yangzhen

2017-12-01

First-principles calculations based on density functional theory (DFT) were used to investigate the mechanical properties, elastic anisotropy, electronic structure, optical properties and thermodynamic properties of a new quaternary MAX phase (W2/3Ti1/3)3AlC2 and its counterpart W3AlC2 under hydrostatic pressure. The results indicate that the volumetric shrinkage of (W2/3Ti1/3)3AlC2 is faster than that of axial shrinkage under hydrostatic pressure. The stress-strain method and Voigt-Reuss-Hill approximation were used to calculate elastic constants and moduli, respectively. These compounds are mechanically stable under hydrostatic pressure. Moreover, the moduli of (W2/3Ti1/3)3AlC2 and W3AlC2 increase with an increase in pressure. The anisotropic indexes and surface constructions of bulk and Young’s moduli were used to illustrate the mechanical anisotropy under hydrostatic pressure. Electronic structure and optical property of (W2/3Ti1/3)3AlC2 and W3AlC2 have also been discussed. The results of Debye temperature reveal that the covalent bonds among atoms in (W2/3Ti1/3)3AlC2 may be stronger than that of W3AlC2. The heat capacity, Cp-Cv, and thermal expansion coefficient of (W2/3Ti1/3)3AlC2 and W3AlC2 were discussed in the ranges of 0-30 GPa and 0-2000 K using quasi-harmonic Debye model considering the phonon effects.

Linear oscillation of gas bubbles in a viscoelastic material under ultrasound irradiation

DOE Office of Scientific and Technical Information (OSTI.GOV)

Hamaguchi, Fumiya; Ando, Keita, E-mail: kando@mech.keio.ac.jp

2015-11-15

Acoustically forced oscillation of spherical gas bubbles in a viscoelastic material is studied through comparisons between experiments and linear theory. An experimental setup has been designed to visualize bubble dynamics in gelatin gels using a high-speed camera. A spherical gas bubble is created by focusing an infrared laser pulse into (gas-supersaturated) gelatin gels. The bubble radius (up to 150 μm) under mechanical equilibrium is controlled by gradual mass transfer of gases across the bubble interface. The linearized bubble dynamics are studied from the observation of spherical bubble oscillation driven by low-intensity, planar ultrasound driven at 28 kHz. It follows frommore » the experiment for an isolated bubble that the frequency response in its volumetric oscillation was shifted to the high frequency side and its peak was suppressed as the gelatin concentration increases. The measurement is fitted to the linearized Rayleigh–Plesset equation coupled with the Voigt constitutive equation that models the behavior of linear viscoelastic solids; the fitting yields good agreement by tuning unknown values of the viscosity and rigidity, indicating that more complex phenomena including shear thinning, stress relaxation, and retardation do not play an important role for the small-amplitude oscillations. Moreover, the cases for bubble-bubble and bubble-wall systems are studied. The observed interaction effect on the linearized dynamics can be explained as well by a set of the Rayleigh–Plesset equations coupled through acoustic radiation among these systems. This suggests that this experimental setup can be applied to validate the model of bubble dynamics with more complex configuration such as a cloud of bubbles in viscoelastic materials.« less

An Experimental and Theoretical Study of Nitrogen-Broadened Acetylene Lines

NASA Technical Reports Server (NTRS)

Thibault, Franck; Martinez, Raul Z.; Bermejo, Dionisio; Ivanov, Sergey V.; Buzykin, Oleg G.; Ma, Qiancheng

2014-01-01

We present experimental nitrogen-broadening coefficients derived from Voigt profiles of isotropic Raman Q-lines measured in the 2 band of acetylene (C2H2) at 150 K and 298 K, and compare them to theoretical values obtained through calculations that were carried out specifically for this work. Namely, full classical calculations based on Gordon's approach, two kinds of semi-classical calculations based on Robert Bonamy method as well as full quantum dynamical calculations were performed. All the computations employed exactly the same ab initio potential energy surface for the C2H2N2 system which is, to our knowledge, the most realistic, accurate and up-to-date one. The resulting calculated collisional half-widths are in good agreement with the experimental ones only for the full classical and quantum dynamical methods. In addition, we have performed similar calculations for IR absorption lines and compared the results to bibliographic values. Results obtained with the full classical method are again in good agreement with the available room temperature experimental data. The quantum dynamical close-coupling calculations are too time consuming to provide a complete set of values and therefore have been performed only for the R(0) line of C2H2. The broadening coefficient obtained for this line at 173 K and 297 K also compares quite well with the available experimental data. The traditional Robert Bonamy semi-classical formalism, however, strongly overestimates the values of half-width for both Qand R-lines. The refined semi-classical Robert Bonamy method, first proposed for the calculations of pressure broadening coefficients of isotropic Raman lines, is also used for IR lines. By using this improved model that takes into account effects from line coupling, the calculated semi-classical widths are significantly reduced and closer to the measured ones.

Some Historical Points of Interest in Göttingen

NASA Astrophysics Data System (ADS)

Hentschel, Klaus

The Georgia Augusta University of Göttingen, founded in 1737, was a child of the Enlightenment, and the new sciences have always played a major role here.1 Among the teachers of physics, physical chemistry, astronomy, and related subjects we find Johann Christian Polykarp Erxleben, Georg Christoph Lichtenberg, Johann Tobias Mayer, Carl Friedrich Gauss, Johann B. Listing, Wilhelm Eduard Weber, Woldemar Voigt, Friedrich Kohlrausch, Eduard Riecke, Walther Nernst and Peter Debye — the last two subsequently moved on to Berlin. In the 1920s, physics students were jestingly referred to as “Frankierte, Bornierte und Polierte” (loosely translated as stamped, limited and polished), in allusion to their teachers, the theoretical physicist Max Born and the experimentalists James Franck and Robert Wichard Pohl, the first two being important figures in the history of quantum theory, the third, one of the founding fathers of experimental solid state physics.2 The National Socialist’s rise to power had a devastating effect on this world-renowned center for physics and mathematics. Most of its high-caliber scientists either were dismissed on the basis of the racist “Law for the Restoration of the Professional Civil Service” or themselves felt compelled to emigrate: About a dozen members of the physics faculty, including Born and Franck, and ten from the mathematics faculty left Göttingen.3 After the war, Richard Becker, who in 1936 had received a compulsory order to take the chair for theoretical physics vacant since Born’s emigration, and Friedrich Hund, who was also an enthusiastic historian of science, distinguished themselves as physics teachers there but the university as a whole never recovered its international standing of before 1933 (see Figs. 1 and 2).

Measurements of the CO2 line parameters in the 10000-10300 cm-1 region

NASA Astrophysics Data System (ADS)

Solodov, A. M.; Petrova, T. M.; Solodov, A. A.; Borkov, Yu. G.; Tashkun, S. A.; Perevalov, V. I.

2017-12-01

The absorption spectra of carbon dioxide have been recorded in the near infrared region from 10,000 to 10,300 cm-1, using the Bruker IFS 125 HR Fourier transform spectrometer and a 30 m multipass cell with the White type optical system. The spectra were recorded at a spectral resolution of 0.03 cm-1, room temperature, a path length of 953.6 m and at two pressures of 294 and 523 mbar. The achieved sensitivity (noise equivalent absorption) at the level of kν=1.38×10-10 cm-1 allowed detection of a number of new transitions with the intensity values down to 10-29 cm/molecule at 296 K. Two bands 60014-00001 and 60015-00001 of 12C16O2 were detected for the first time. The line positions and intensities of these bands were determined using the Voigt profile as a line shape. The uncertainty of the line position determination was estimated to be about 0.003 cm-1 for the unblended lines with a high value of the signal-to-noise ratio. The uncertainty of the line intensity determination varies from 4% to 40% depending on the strength of the line and the extent of the line overlapping. The measured line intensities of the 60014-00001 and 60015-00001 bands together with those published earlier for the ΔP=15 series of transitions were used to fit the effective dipole moment parameters of this series. Here P=2V1+V2+3V3 is the polyad number (Vi (i=1,2,3) are the harmonic oscillators quantum numbers). The fitted parameters reproduce the measured line intensities within their experimental uncertainties. Using the effective Hamiltonian parameters published earlier and the fitted effective dipole moment parameters the line positions and intensities of the 6001i-00001 (i=1,2,3,4,5,6,7) bands have been calculated. A comparison of the measured line positions and intensities to those contained in the new version (huang.seti.org) AMES line list as well as in the High-T line list are given.

Observing the baryon cycle in hydrodynamic cosmological simulations

NASA Astrophysics Data System (ADS)

Vander Vliet, Jacob Richard

An understanding of galaxy evolution requires an understanding of the flow of baryons in and out of a galaxy. The accretion of baryons is required for galaxies to form stars, while stars eject baryons out of the galaxy through stellar feedback mechanisms such as supernovae, stellar winds, and radiation pressure. The interplay between outfiowing and infalling material form the circumgalactic medium (CGM). Hydrodynamic simulations provide understanding of the connection between stellar feedback and the distribution and kinematics of baryons in the CGM. To compare simulations and observations properly the simulated CGI must be observed in the same manner as the real CGM. I have developed the Mockspec code to generate synthetic quasar absorption line observations of the CGM in cosmological hydrodynamic simulations. Mockspec generates synthetic spectra based on the phase; lnetallicity, and kinematics of CGM gas and mimics instrumental effects. Mockspec includes automated analysis of the spectra and identifies the gas responsible for the absorption. Mockspec was applied to simulations of dwarf galaxies at low redshift to examine the observable effect different feedback models have on the CGM. While the different feedback models had strong effects on the galaxy, they all produced a similar CGM that failed match observations. Mockspec was applied to the VELA simulation suite of high redshift, high mass galaxies to examine the variance of the CGM across different galaxies in different environments. The observed CGM showed little variation between the different galaxies and almost no evolution from z=4 to z=1. The VELAs were not able to generate a CGM to match the observations. The properties of cells responsible for the absorption were compared to the derived properties from Voigt Profile decomposition. VP modeling was found to accurately describe the HI and MgII absorbing gas but failed for high ionization species such as CIV and OVI, which do not arise in the coherent structures assumed by modelling. The technique of mock QAL is useful for testing the accuracy of the simulated CGM and for verifying observational techniques. but not for differentiating between feedback prescriptions in dwarf galaxies.

Subsolidus cooling of mid-ocean ridge peridotites and implications for the oxygen fugacity of the oceanic upper mantle

NASA Astrophysics Data System (ADS)

Birner, S.; Davis, F. A.; Cottrell, E.; Warren, J. M.; Kelley, K. A.

2017-12-01

Peridotites dredged from mid-ocean ridges provide a window into the chemistry of Earth's upper mantle. At equilibrium, mineral assemblages within peridotite record intrinsic properties, including oxygen fugacity (fO2). During cooling below the solidus, however, reactions affect the chemical compositions and modal abundances of minerals, directly affecting the fO2 recorded by these mineral assemblages. The slow kinetics of subsolidus diffusion also prevent full re-equilibration of peridotite during cooling, and different reactions have different closure temperatures. As a result, peridotites measured at the surface record neither equilibrium nor asthenospheric conditions. In order to quantify the effect of subsolidus diffusion on fO2, we analyzed minerals from abyssal peridotites dredged from the Southwest Indian Ridge (SWIR), which we then used as a basis for modeling potential subsolidus reactions. We first examined exchange reactions where no modal changes occur. We considered both Fe-Mg exchange between olivine and spinel [1] and Al-Cr exchange between orthopyroxene and spinel [2], and combined these models with spinel oxybarometry [3] to determine the effect of these reactions on fO2. Our results indicate that as peridotites cool from 1300°C to 900°C, these exchange processes together increase recorded fO2 by 0.3 log units relative to the approach in which compositional changes are not considered. Some reactions additionally change mineral modal abundances during cooling, in particular the Tschermak exchange in orthopyroxene [2], which consumes olivine and Al-rich orthopyroxene and produces spinel and Al-poor orthopyroxene as temperature decreases. Depending on partitioning of Fe3+ between phases, this reaction may dilute the concentration of Fe3+ in spinel and decrease recorded fO2 as temperature decreases. Preliminary results suggest that the magnitude of this effect is strongly sensitive to both initial spinel mode and partitioning of Fe3+ between orthopyroxene and spinel. Finally, we compare the fO2 recorded by SWIR peridotites to the fO2 recorded by basalts, projected to source conditions. [1] Li et al., 1995; [2] Voigt and von der Handt, 2011; [3] Davis et al., 2017

A magnetospheric magnetic field model with flexible current systems driven by independent physical parameters

NASA Technical Reports Server (NTRS)

Hilmer, Robert V.; Voigt, Gerd-Hannes

1995-01-01

A tilt-dependent magnetic field model of the Earth's magnetosphere with variable magnetopause standoff distance is presented. Flexible analytic representations for the ring and cross-tail currents, each composed of the elements derived from the Tsyganenko and Usmanov (1982) model, are combined with the fully shielded vacuum dipole configurations of Voigt (1981). Although the current sheet does not warp in the y-z plane, changes in the shape and position of the neutral sheet with dipole tilt are consistent with both MHD equilibrium theory and observations. In addition, there is good agreement with observed Delta B profiles and the average equatorial contours of magnetic field magnitude. While the dipole field is rigorously shielded within the defined magnetopause, the ring and cross-tails currents are not similarly confined, consequently, the model's region of validity is limited to the inner magnetosphere. The model depends on four independent external parameters. We present a simple but limited method of simulating several substorm related magnetic field changes associated with the disrupion of the near-Earth cross-tail current sheet and collapse of the midnight magnetotail field region. This feature further facilitates the generation of magnetic field configuration time sequences useful in plasma convection simulations of real magnetospheric events.

Defect structure of epitaxial layers of III nitrides as determined by analyzing the shape of X-ray diffraction peaks

NASA Astrophysics Data System (ADS)

Kyutt, R. T.

2017-04-01

The shape of X-ray diffraction epitaxial layers with high dislocation densities has been studied experimentally. Measurements with an X-ray diffractometer were performed in double- and triple-crystal setups with both Cu K α and Mo K α radiation. Epitaxial layers (GaN, AlN, AlGaN, ZnO, etc.) with different degrees of structural perfection grown by various methods on sapphire, silicon, and silicon carbide substrates have been examined. The layer thickness varied in the range of 0.5-30 μm. It has been found that the center part of peaks is well approximated by the Voigt function with different Lorentz fractions, while the wing intensity drops faster and may be represented by a power function (with the index that varies from one structure to another). A well-marked dependence on the ordering of dislocations was observed. The drop in intensity in the majority of structures with a regular system and regular threading dislocations was close to the theoretically predicted law Δθ-3; the intensity in films with a chaotic distribution decreased much faster. The dependence of the peak shape on the order of reflection, the diffraction geometry, and the epitaxial layer thickness was also examined.

Intensity Distribution of the Three-Wave Diffraction from Dislocation Epitaxial Layers in the Reciprocal Space

NASA Astrophysics Data System (ADS)

Kyutt, R. N.

2018-04-01

The three-wave X-ray diffraction in strongly disordered epitaxial layers of GaN and ZnO is experimentally investigated. The charts of the intensity distribution in the reciprocal space are plotted in coordinates q θ and q ϕ for the most intensive three-wave combination (1010)/(1011) by means of subsequent θ- and ϕ-scanning. A nontrivial shape of the θ-sections of these contours at a distance from the ϕ center of reflection is revealed; it is different for different samples. For the θ-curves at the center of reflection, we observed a common peak that may be approximated by the Voigt function with a power-low decrease in the intensity at the wings; the decrease law (from-4.5 to-5.0) is found to be considerably greater than that for the similar curves of two-wave diffraction and not depending on the dislocation density and distribution in layers. In some films we observed a coarse-block structure; in addition, it follows from the distribution in the reciprocal space that these blocks are turned with respect to each other around a normal to the surface, which allows us to suggest the existence of low-angle boundaries between them, consisting exclusively of edge dislocations.

The slow ionized wind and rotating disklike system that are associated with the high-mass young stellar object G345.4938+01.4677

DOE Office of Scientific and Technical Information (OSTI.GOV)

Guzmán, Andrés E.; Garay, Guido; Bronfman, Leonardo

2014-12-01

We report the detection, made using ALMA, of the 92 GHz continuum and hydrogen recombination lines (HRLs) H40α, H42α, and H50β emission toward the ionized wind associated with the high-mass young stellar object G345.4938+01.4677. This is the luminous central dominating source located in the massive and dense molecular clump associated with IRAS 16562–3959. The HRLs exhibit Voigt profiles, which is a strong signature of Stark broadening. We successfully reproduce the observed continuum and HRLs simultaneously using a simple model of a slow ionized wind in local thermodynamic equilibrium, with no need for a high-velocity component. The Lorentzian line wings implymore » electron densities of 5 × 10{sup 7} cm{sup –3} on average. In addition, we detect SO and SO{sub 2} emission arising from a compact (∼3000 AU) molecular core associated with the central young star. The molecular core exhibits a velocity gradient that is perpendicular to the jet-axis, which we interpret as evidence of rotation. The set of observations toward G345.4938+01.4677 are consistent with it being a young high-mass star associated with a slow photo-ionized wind.« less

Temperature dependent of viscoelasticity measurement on fat emulsion phantom using acoustic radiation force elasticity imaging method

PubMed Central

Xie, Peng; Wang, Mengke; Guo, Yanrong; Wen, Huiying; Chen, Xin; Chen, Siping; Lin, Haoming

2018-01-01

During the past two decades, tissue elasticity has been extensively studied and has been used in clinical disease diagnosis. But biological soft tissues are viscoelastic in nature. Therefore, they should be simultaneously characterized in terms of elasticity and viscosity. In addition, the mechanical properties of soft tissues are temperature dependent. However, how the temperature influences the shear wave dispersion and the viscoelasticity of soft tissue are still unclear. The aim of this study is to compare viscoelasticity of fat emulsion phantom with different temperature using acoustic radiation force elasticity imaging method. In our experiment, we produced four proportions of ultrasonic phantom by adding fat emulsion gelatin. Through adjusting the component of the fat emulsion, we change the viscoelasticity of the ultrasonic phantom. We used verasonics system to gather data and voigt model to fit the elasticity and viscosity value of the ultrasonic phantom we made. The influence of temperature to the ultrasonic phantom also measured in our study. The results show that the addition of fat emulsion to the phantom can increase the viscosity of the phantom, and the shear wave phase velocity decreases gradually at each frequency with the temperature increases, which provides a new material for the production of viscoelastic phantom. PMID:29758968

Nuclear Spin Locking and Extended Two-Electron Spin Decoherence Time in an InAs Quantum Dot Molecule

NASA Astrophysics Data System (ADS)

Chow, Colin; Ross, Aaron; Steel, Duncan; Sham, L. J.; Bracker, Allan; Gammon, Daniel

2015-03-01

The spin eigenstates for two electrons confined in a self-assembled InAs quantum dot molecule (QDM) consist of the spin singlet state, S, with J = 0 and the triplet states T-, T0 and T+, with J = 1. When a transverse magnetic field (Voigt geometry) is applied, the two-electron system can be initialized to the different states with appropriate laser excitation. Under the excitation of a weak probe laser, non-Lorentzian lineshapes are obtained when the system is initialized to either T- or T+, where T- results in a ``resonance locking'' lineshape while T+ gives a ``resonance avoiding '' lineshape: two different manifestations of hysteresis showing the importance of memory in the system. These observations signify dynamic nuclear spin polarization (DNSP) arising from a feedback mechanism involving hyperfine interaction between lattice nuclei and delocalized electron spins, and Overhauser shift due to nuclear spin polarization. Using pump configurations that generate coherent population trapping, the isolation of the electron spin from the optical excitation shows the stabilization of the nuclear spin ensemble. The dark-state lineshape measures the lengthened electron spin decoherence time, from 1 ns to 1 μs. Our detailed spectra highlight the potential of QDM for realizing a two-qubit gate. This work is supported by NSF, ARO, AFOSR, DARPA, and ONR.

Biaxial experimental and analytical characterization of a dielectric elastomer

NASA Astrophysics Data System (ADS)

Helal, Alexander; Doumit, Marc; Shaheen, Robert

2018-01-01

Electroactive polymers (EAPs) have emerged as a strong contender for use in low-cost efficient actuators in multiple applications especially related to biomimetic and mobile-assistive devices. Dielectric elastomers (DE), a subcategory of these smart materials, have been of particular interest due to their large achievable deformation and favourable mechanical and electro-mechanical properties. Previous work has been completed to understand the behaviour of these materials; however, their properties require further investigation to properly integrate them into real-world applications. In this study, a biaxial tensile experimental evaluation of 3M™ VHB 4905 and VHB 4910 is presented with the purpose of illustrating the elastomers' transversely isotropic mechanical behaviours. These tests were applied to both tapes for equibiaxial stretch rates ranging between 0.025 and 0.300 s-1. Subsequently, a dynamic planar biaxial visco-hyperelastic constitutive relationship was derived from a Kelvin-Voigt rheological model and the general Hooke's law for transversely isotropic materials. The model was then fitted to the experimental data to obtain three general material parameters for either tapes. The model's ability to predict tensile stress response and internal energy dissipation, with respect to experimental data, is evaluated with good agreement. The model's ability to predict variations in mechanical behaviour due to changes in kinematic variables is then illustrated for different conditions.

Mechanochemical pattern formation in simple models of active viscoelastic fluids and solids

NASA Astrophysics Data System (ADS)

Alonso, Sergio; Radszuweit, Markus; Engel, Harald; Bär, Markus

2017-11-01

The cytoskeleton of the organism Physarum polycephalum is a prominent example of a complex active viscoelastic material wherein stresses induce flows along the organism as a result of the action of molecular motors and their regulation by calcium ions. Experiments in Physarum polycephalum have revealed a rich variety of mechanochemical patterns including standing, traveling and rotating waves that arise from instabilities of spatially homogeneous states without gradients in stresses and resulting flows. Herein, we investigate simple models where an active stress induced by molecular motors is coupled to a model describing the passive viscoelastic properties of the cellular material. Specifically, two models for viscoelastic fluids (Maxwell and Jeffrey model) and two models for viscoelastic solids (Kelvin-Voigt and Standard model) are investigated. Our focus is on the analysis of the conditions that cause destabilization of spatially homogeneous states and the related onset of mechano-chemical waves and patterns. We carry out linear stability analyses and numerical simulations in one spatial dimension for different models. In general, sufficiently strong activity leads to waves and patterns. The primary instability is stationary for all active fluids considered, whereas all active solids have an oscillatory primary instability. All instabilities found are of long-wavelength nature reflecting the conservation of the total calcium concentration in the models studied.

Temperature dependent of viscoelasticity measurement on fat emulsion phantom using acoustic radiation force elasticity imaging method.

PubMed

Xie, Peng; Wang, Mengke; Guo, Yanrong; Wen, Huiying; Chen, Xin; Chen, Siping; Lin, Haoming

2018-04-27

During the past two decades, tissue elasticity has been extensively studied and has been used in clinical disease diagnosis. But biological soft tissues are viscoelastic in nature. Therefore, they should be simultaneously characterized in terms of elasticity and viscosity. In addition, the mechanical properties of soft tissues are temperature dependent. However, how the temperature influences the shear wave dispersion and the viscoelasticity of soft tissue are still unclear. The aim of this study is to compare viscoelasticity of fat emulsion phantom with different temperature using acoustic radiation force elasticity imaging method. In our experiment, we produced four proportions of ultrasonic phantom by adding fat emulsion gelatin. Through adjusting the component of the fat emulsion, we change the viscoelasticity of the ultrasonic phantom. We used verasonics system to gather data and voigt model to fit the elasticity and viscosity value of the ultrasonic phantom we made. The influence of temperature to the ultrasonic phantom also measured in our study. The results show that the addition of fat emulsion to the phantom can increase the viscosity of the phantom, and the shear wave phase velocity decreases gradually at each frequency with the temperature increases, which provides a new material for the production of viscoelastic phantom.

Seismic anisotropy from compositional banding in granulites from the deep magmatic arc of Fiordland, New Zealand

NASA Astrophysics Data System (ADS)

Cyprych, Daria; Piazolo, Sandra; Almqvist, Bjarne S. G.

2017-11-01

We present calculated seismic velocities and anisotropies of mafic granulites and eclogites from the Cretaceous deep lower crust (∼40-65 km) of Fiordland, New Zealand. Both rock types show a distinct foliation defined by cm-scale compositional banding. Seismic properties are estimated using the Asymptotic Expansion Homogenisation - Finite Element (AEH-FE) method that, unlike the commonly used Voigt-Reuss-Hill homogenisation, incorporates the phase boundary network into calculations. The predicted mean P- and S-wave velocities are consistent with previously published data for similar lithologies from other locations (e.g., Kohistan Arc), although we find higher than expected anisotropies (AVP ∼ 5.0-8.0%, AVS ∼ 3.0-6.5%) and substantial S-wave splitting along foliation planes in granulites. This seismic signature of granulites results from a density and elasticity contrast between cm-scale pyroxene ± garnet stringers and plagioclase matrix rather than from crystallographic orientations alone. Banded eclogites do not show elevated anisotropies as the contrast in density and elastic constants of garnet and pyroxene is too small. The origin of compositional banding in Fiordland granulites is primarily magmatic and structures described here are expected to be typical for the base of present day magmatic arcs. Hence, we identify a new potential source of anisotropy within this geotectonic setting.

Immunocytological analysis of meiotic recombination in two anole lizards (Squamata, Dactyloidae).

PubMed

Lisachov, Artem P; Trifonov, Vladimir A; Giovannotti, Massimo; Ferguson-Smith, Malcolm A; Borodin, Pavel M

2017-01-01

Although the evolutionary importance of meiotic recombination is not disputed, the significance of interspecies differences in the recombination rates and recombination landscapes remains under-appreciated. Recombination rates and distribution of chiasmata have been examined cytologically in many mammalian species, whereas data on other vertebrates are scarce. Immunolocalization of the protein of the synaptonemal complex (SYCP3), centromere proteins and the mismatch-repair protein MLH1 was used, which is associated with the most common type of recombination nodules, to analyze the pattern of meiotic recombination in the male of two species of iguanian lizards, Anolis carolinensis Voigt, 1832 and Deiroptyx coelestinus (Cope, 1862). These species are separated by a relatively long evolutionary history although they retain the ancestral iguanian karyotype. In both species similar and extremely uneven distributions of MLH1 foci along the macrochromosome bivalents were detected: approximately 90% of crossovers were located at the distal 20% of the chromosome arm length. Almost total suppression of recombination in the intermediate and proximal regions of the chromosome arms contradicts the hypothesis that "homogenous recombination" is responsible for the low variation in GC content across the anole genome. It also leads to strong linkage disequilibrium between the genes located in these regions, which may benefit conservation of co-adaptive gene arrays responsible for the ecological adaptations of the anoles.

Observation of Mollow Triplets with Tunable Interactions in Double Lambda Systems of Individual Hole Spins.

NASA Astrophysics Data System (ADS)

Lagoudakis, K. G.; Fischer, K. A.; Sarmiento, T.; McMahon, P. L.; Radulaski, M.; Zhang, J. L.; Kelaita, Y.; Dory, C.; Mueller, K. M.; Vuckovic, J.

Although individual spins in quantum dots have been extensively used as qubits, their investigation under strong resonant driving in view of accessing Mollow physics is still an open question. We have grown high quality positively charged quantum dots (QD) embedded in a planar microcavity that enable enhanced light matter interactions. Applying a strong magnetic field in the Voigt configuration, individual positively charged quantum dots provide a double lambda level structure. Using a combination of above band and resonant excitation, we observe the formation of Mollow triplets. We investigate the regime where the Mollow sideband splittings are equal to the Zeeman splitting; we observe strong interactions between the Mollow sidebands of the inner transitions and the outer transitions in the form of very clear anticrossings. We investigated these anticrossings and we were able to modify the observed anticrossing splittings on demand by rotating the polarization of the resonant laser. We also developed a quantum-optical model of our system that fully captures the experimentally observed spectra and provides insight on the complicated level structure that results from the strong driving of our positively charged quantum dot. The authors acknowledge financial support from the Army Research Office (Grant No. W911NF1310309) and support from the National Science Foundation, Division of Materials Research (Grant No. 1503759).

Thermal and temporal evolution of microstructure in polycrystalline ZnO

DOE Office of Scientific and Technical Information (OSTI.GOV)

Kondal, Neha; Tiwari, Sanjiv Kumar, E-mail: sanjivkumar.tiwari@juit.ac.in

2016-05-06

Tug between electronics and spintronics has opened up new area of research named as dilute magnetic semiconductors (DMS), ZnO is one of the most reliable candidates for spintronic devices and DMS. Since, pure and transition metal doped polycrystalline ZnO shows room temperature ferromagnetism, therefore it is very important to gain insight into its microstructure (MS) evolution. We report thermal evolution of MS of pure ZnO on sintering it at 200 °C, 400 °C, 600 °C, and 800 °C in ambient atmosphere for two hours. Temporal evolution at fixed temperature was analyzed using mean field model of internal energy and entropy.more » Grain size of ZnO MS were analyzed using integral breadth method of X-ray diffraction (XRD) lines using Voigt profile fit,. XRD line corresponding to [101] plane shifts from 36.17° to 36.28° whereas grain size increases from 67.5 nm to 93.7 nm with increase of temperature from 23°C to 800°C respectively. Grain growth with increase of temperature show Arrhenius type behavior with activation energy of 30.77 kJ-mol{sup −1} and temporal growth shows diffusive behavior with exponent 0.5.« less

Measurement of viscoelastic properties of in vivo swine myocardium using Lamb Wave Dispersion Ultrasound Vibrometry (LDUV)

PubMed Central

Urban, Matthew W.; Pislaru, Cristina; Nenadic, Ivan Z.; Kinnick, Randall R.; Greenleaf, James F.

2012-01-01

Viscoelastic properties of the myocardium are important for normal cardiac function and may be altered by disease. Thus, quantification of these properties may aid with evaluation of the health of the heart. Lamb Wave Dispersion Ultrasound Vibrometry (LDUV) is a shear wave-based method that uses wave velocity dispersion to measure the underlying viscoelastic material properties of soft tissue with plate-like geometries. We tested this method in eight pigs in an open-chest preparation. A mechanical actuator was used to create harmonic, propagating mechanical waves in the myocardial wall. The motion was tracked using a high frame rate acquisition sequence, typically 2500 Hz. The velocities of wave propagation were measured over the 50–400 Hz frequency range in 50 Hz increments. Data were acquired over several cardiac cycles. Dispersion curves were fit with a viscoelastic, anti-symmetric Lamb wave model to obtain estimates of the shear elasticity, μ1, and viscosity, μ2 as defined by the Kelvin-Voigt rheological model. The sensitivity of the Lamb wave model was also studied using simulated data. We demonstrated that wave velocity measurements and Lamb wave theory allow one to estimate the variation of viscoelastic moduli of the myocardial walls in vivo throughout the course of the cardiac cycle. PMID:23060325

Emission spectra of a pulse needle-to-plane corona-like discharge in conductive aqueous solutions

NASA Astrophysics Data System (ADS)

Šimek, Milan; Člupek, Martin; Babický, Václav; Lukeš, Petr; Šunka, Pavel

2012-10-01

We explored basic optical and electrical characteristics of a positive corona-like discharge produced in conductive aqueous solutions by periodic high-voltage pulses. Emission spectra of the discharge were acquired in a needle-to-plate electrode geometry and analysed in the UV-vis-NIR spectral range with nanosecond time resolution for the solution conductivity of 100 and 500 µS cm-1. The most important emission features are due to electronic excitation of HI, OI, OII and OH species. We found evidence of significant time-dependent line-shape broadening of selected HI and OI transitions. The observed broadening is attributed to the dynamic Stark and pressure broadening mechanisms and significantly increases with the aqueous solution conductivity. Electron densities were estimated by fitting a single Voigt peak function to the observed Hα profiles, and can reach as much as ne ≅ 4 × 1018 cm-3 (tD = 300 ns at 100 µS cm-1 solution conductivity) and ne ≅ 5 × 1018 cm-3 (tD = 1 µs at 500 µS cm-1). Temporal evolution of the partially resolved rotational structure of the OH emission reaches a maximum during the discharge decay, with the onset significantly delayed with respect to the streamer ignition.

The Reference Forward Model (RFM)

NASA Astrophysics Data System (ADS)

Dudhia, Anu

2017-01-01

The Reference Forward Model (RFM) is a general purpose line-by-line radiative transfer model, currently supported by the UK National Centre for Earth Observation. This paper outlines the algorithms used by the RFM, focusing on standard calculations of terrestrial atmospheric infrared spectra followed by a brief summary of some additional capabilities and extensions to microwave wavelengths and extraterrestrial atmospheres. At its most basic level - the 'line-by-line' component - it calculates molecular absorption cross-sections by applying the Voigt lineshape to all transitions up to ±25 cm-1 from line-centre. Alternatively, absorptions can be directly interpolated from various forms of tabulated data. These cross-sections are then used to construct infrared radiance or transmittance spectra for ray paths through homogeneous cells, plane-parallel or circular atmospheres. At a higher level, the RFM can apply instrumental convolutions to simulate measurements from Fourier transform spectrometers. It can also calculate Jacobian spectra and so act as a stand-alone forward model within a retrieval scheme. The RFM is designed for robustness, flexibility and ease-of-use (particularly by the non-expert), and no claims are made for superior accuracy, or indeed novelty, compared to other line-by-line codes. Its main limitations at present are a lack of scattering and simplified modelling of surface reflectance and line-mixing.

Seismic anisotropy of the crust: electron-backscatter diffraction measurements from the Basin and Range

NASA Astrophysics Data System (ADS)

Erdman, Monica E.; Hacker, Bradley R.; Zandt, George; Seward, Gareth

2013-11-01

Crystal preferred orientations were measured in a suite of rocks from three locations in the Basin and Range using electron-backscatter diffraction. Anisotropic velocities were calculated for all rocks using single-crystal stiffnesses, the Christoffel equation and Voigt-Reuss-Hill averaging. Anisotropic velocities were calculated for all three crustal sections using these values combined with rock proportions as exposed in the field. One suite of rocks previously measured in the laboratory was used as a benchmark to evaluate the accuracy of the calculated velocities. Differences in the seismic anisotropy of the Funeral Mountains, Ruby Mountains and East Humboldt Range sections arise because of differences in mineralogy and strain, with the calc-silicate dominated Ruby Mountains section having higher P-wave speeds and VP/VS ratios because of the reduced quartz content. In all cases, the velocities show either transverse isotropy or nearly so, with a unique slow axis normal to the foliation. Velocity anisotropy can thus be used to infer the flow plane, but not the flow direction in typical crustal rocks. Areas with a subhorizontal foliation have minimal shear wave splitting for vertically propagating waves and are thus good places to measure mantle anisotropy using SKS-splitting.

Diode laser-induced infrared fluorescence of water vapour

NASA Astrophysics Data System (ADS)

Li, Hejie; Hanson, Ronald K.; Jeffries, Jay B.

2004-07-01

Infrared laser-induced fluorescence (LIF) of water vapour was investigated for its potential as a spatially resolved gasdynamic diagnostic. A cw diode laser operating near 1392 nm was scanned across a single absorption transition in the ngr1 + ngr3 band of H2O in a static cell, and the resulting fluorescence signal was collected near 2.7 µm (both ngr1 and ngr3 bands). Experiments were conducted at low pressure in pure water vapour and mixtures of water vapour and N2 using a 20 mW laser in a double-pass arrangement. A simple analytical model was developed to relate LIF intensity to gas properties as a function of laser power. The spectrally resolved, single-line excitation spectrum was fitted with a Voigt profile, allowing inference of the water vapour temperature from the Doppler-broadened component of the measured fluorescence lineshape. A two-line excitation scheme was also investigated as a means of measuring temperature with reduced measurement time. From these initial measurements, we estimate that a practical sensor for atmospheric pressure applications would require a minimum of 1-2 W of laser power for two-line, fixed-wavelength temperature measurements and a minimum of about 70 W of power for scanned-wavelength measurements.

Viscoelastic shear lag model to predict the micromechanical behavior of tendon under dynamic tensile loading.

PubMed

Wu, Jiayu; Yuan, Hong; Li, Longyuan; Fan, Kunjie; Qian, Shanguang; Li, Bing

2018-01-21

Owing to its viscoelastic nature, tendon exhibits stress rate-dependent breaking and stiffness function. A Kelvin-Voigt viscoelastic shear lag model is proposed to illustrate the micromechanical behavior of the tendon under dynamic tensile conditions. Theoretical closed-form expressions are derived to predict the deformation and stress transfer between fibrils and interfibrillar matrix while tendon is dynamically stretched. The results from the analytical solutions demonstrate that how the fibril overlap length and fibril volume fraction affect the stress transfer and mechanical properties of tendon. We find that the viscoelastic property of interfibrillar matrix mainly results in collagen fibril failure under fast loading rate or creep rupture of tendon. However, discontinuous fibril model and hierarchical structure of tendon ensure relative sliding under slow loading rate, helping dissipate energy and protecting fibril from damage, which may be a key reason why regularly staggering alignment microstructure is widely selected in nature. According to the growth, injury, healing and healed process of tendon observed by many researchers, the conclusions presented in this paper agrees well with the experimental findings. Additionally, the emphasis of this paper is on micromechanical behavior of tendon, whereas this analytical viscoelastic shear lag model can be equally applicable to other soft or hard tissues, owning the similar microstructure. Copyright © 2017 Elsevier Ltd. All rights reserved.

Measurement of Young’s Modulus and Internal Damping of Pork Muscle in Dynamic Mode

NASA Astrophysics Data System (ADS)

Chakroun, Moez; Ghozlen, Med Hédi Ben

2016-09-01

Automotive shocks involve various tiers’ speed for different human body tissues. Knowing the behavior of these tissues, including muscles, in different vibration frequency is therefore necessary. The muscle has viscoelatic properties. Dynamically, this material has variable mechanical properties depending on the vibration frequency. A novel technique is being employed to examine the variation of the mechanical impedance of pork muscle as a function of frequency. A force is imposed on the lower surface of the sample and acceleration is measured on its upper surface. These two parameters are measured using sensors. The sample is modeled by Kelvin-Voigt model. These measures allow deducing the change in the mechanical impedance modulus (/Zexp/ = /Force: Acceleration/) of pork muscle as a function of vibration frequency. The measured impedance has a resonance of approximately 60Hz. Best-fit parameters of theoretical impedance can be deduced by superposition with the experiment result. The variation of Young’s modulus and internal damping of pig’s muscle as a function of frequency are determined. The results obtained between 5Hz and 30Hz are the same as determined by Aimedieu and al in 2003, therefore validating our technique. The Young’s modulus of muscle increases with the frequency, on the other hand, we note a rating decrease of internal damping.

Speed-Dependent Broadening and Line-Mixing in CH_4 Perturbed by Air Near 1.64 μm for the French/german Climate Mission MERLIN

NASA Astrophysics Data System (ADS)

Delahaye, Thibault; Tran, Thi Ngoc Ha; Reed, Zachary; Maxwell, Stephen E.; Hodges, Joseph

2015-06-01

Climate change is one of the greatest challenges presently facing mankind, and methane is one of the most powerful anthropogenic greenhouse gases. For a better understanding of future climate trends, a satellite dedicated to the measurements of atmospheric methane is under joint development by the French and German space research centers (CNES and DLR). The so-called MERLIN mission (Methane Remote Sensing Lidar Mission, 2019) aims at providing global information on atmospheric methane concentration with a relative uncertainty less than 2% and with a spatial resolution of 50 km Such spectroscopic monitoring of gases in the atmosphere of the Earth, requires a precise description of absorption lines shapes that goes beyond the usual Voigt profile (VP). In the case of methane, the differences between the measured profiles and those given by the VP can be very important, making the VP completely incompatible with the reliable detection of sources and sinks from space. In this work, we present the first results on the modeling of methane lines broadened by air in the 1.64 μm region and the associated spectroscopic parameters, taking into account various collisional effects between molecules that are neglected by the VP: collisional interference between the lines (line-mixing), collision-induced velocity changes (Dicke narrowing effect) and speed dependence of the collisional broadening and shifting. These results were obtained by simultaneously fitting the model parameters to high sensitivity and high-resolution cavity ring-down spectroscopy (CRDS) spectra recorded at the National Institute of Standards and Technology (NIST) over a wide pressure range (5 to 100 kPa). These spectroscopic data and the associated model to calculate the spectrum absorption coefficient will be then used to analyze ground-based atmospheric spectra at the TCCON facility in Park Falls, Wisconsin. C. Kiemle, M. Quatrevalet, G. Ehret et al., Atmos. Meas. Tech. 4 (2011) H. Tran, J.-M. Hartmann, G. Toon et al., Journal of Quant. Spectrosc. Radia. Trans. 111 (2010)

The Biot coefficient for a low permeability heterogeneous limestone

NASA Astrophysics Data System (ADS)

Selvadurai, A. P. S.

2018-04-01

This paper presents the experimental and theoretical developments used to estimate the Biot coefficient for the heterogeneous Cobourg Limestone, which is characterized by its very low permeability. The coefficient forms an important component of the Biot poroelastic model that is used to examine coupled hydro-mechanical and thermo-hydro-mechanical processes in the fluid-saturated Cobourg Limestone. The constraints imposed by both the heterogeneous fabric and its extremely low intact permeability [K \\in (10^{-23},10^{-20}) m2 ] require the development of alternative approaches to estimate the Biot coefficient. Large specimen bench-scale triaxial tests (150 mm diameter and 300 mm long) that account for the scale of the heterogeneous fabric are complemented by results for the volume fraction-based mineralogical composition derived from XRD measurements. The compressibility of the solid phase is based on theoretical developments proposed in the mechanics of multi-phasic elastic materials. An appeal to the theory of multi-phasic elastic solids is the only feasible approach for examining the compressibility of the solid phase. The presence of a number of mineral species necessitates the use of the theories of Voigt, Reuss and Hill along with the theories proposed by Hashin and Shtrikman for developing bounds for the compressibility of the multi-phasic geologic material composing the skeletal fabric. The analytical estimates for the Biot coefficient for the Cobourg Limestone are compared with results for similar low permeability rocks reported in the literature.

Resonance fluorescence spectrum of a p-doped quantum dot coupled to a metallic nanoparticle

NASA Astrophysics Data System (ADS)

Carreño, F.; Antón, M. A.; Arrieta-Yáñez, Francisco

2013-11-01

The resonance fluorescence spectrum (RFS) of a hybrid system consisting of a p-doped semiconductor quantum dot (QD) coupled to a metallic nanoparticle (MNP) is analyzed. The quantum dot is described as a four-level atomlike system using the density matrix formalism. The lower levels are Zeeman-split hole spin states and the upper levels correspond to positively charged excitons containing a spin-up, spin-down hole pair and a spin electron. A linearly polarized laser field drives two of the optical transitions of the QD and produces localized surface plasmons in the nanoparticle, which act back upon the QD. The frequencies of these localized plasmons are very different along the two principal axes of the nanoparticle, thus producing an anisotropic modification of the spontaneous emission rates of the allowed optical transitions, which is accompanied by very minor local field corrections. This manifests into dramatic modifications in the RFS of the hybrid system in contrast to the one obtained for the isolated QD. The RFS is analyzed as a function of the nanoparticle's aspect ratio, the external magnetic field applied in the Voigt geometry, and the Rabi frequency of the driving field. It is shown that the spin of the QD is imprinted onto certain sidebands of the RFS, and that the signal at these sidebands can be optimized by engineering the shape of the MNP.

Ultrasonic measurements of breast viscoelasticity.

PubMed

Sridhar, Mallika; Insana, Michael F

2007-12-01

In vivo measurements of the viscoelastic properties of breast tissue are described. Ultrasonic echo frames were recorded from volunteers at 5 fps while applying a uniaxial compressive force (1-20 N) within a 1 s ramp time and holding the force constant for up to 200 s. A time series of strain images was formed from the echo data, spatially averaged viscous creep curves were computed, and viscoelastic strain parameters were estimated by fitting creep curves to a second-order Voigt model. The useful strain bandwidth from this quasi-static ramp stimulus was 10(-2) < or = omega < or = 10(0) rad/s (0.0016-0.16 Hz). The stress-strain curves for normal glandular tissues are linear when the surface force applied is between 2 and 5 N. In this range, the creep response was characteristic of biphasic viscoelastic polymers, settling to a constant strain (arrheodictic) after 100 s. The average model-based retardance time constants for the viscoelastic response were 3.2 +/- 0.8 and 42.0 +/- 28 s. Also, the viscoelastic strain amplitude was approximately equal to that of the elastic strain. Above 5 N of applied force, however, the response of glandular tissue became increasingly nonlinear and rheodictic, i.e., tissue creep never reached a plateau. Contrasting in vivo breast measurements with those in gelatin hydrogels, preliminary ideas regarding the mechanisms for viscoelastic contrast are emerging.

Viscoelasticity imaging using ultrasound: parameters and error analysis

PubMed Central

Sridhar, M; Liu, J

2009-01-01

Techniques are being developed to image viscoelastic features of soft tissues from time-varying strain. A compress-hold-release stress stimulus commonly used in creep-recovery measurements is applied to samples to form images of elastic strain and strain retardance times. While the intended application is diagnostic breast imaging, results in gelatin hydrogels are presented to demonstrate the techniques. The spatiotemporal behaviour of gelatin is described by linear viscoelastic theory formulated for polymeric solids. Measured creep responses of polymers are frequently modelled as sums of exponentials whose time constants describe the delay or retardation of the full strain response. We found the spectrum of retardation times τ to be continuous and bimodal, where the amplitude at each τ represents the relative number of molecular bonds with a given strength and conformation. Such spectra indicate that the molecular weight of the polymer fibres between bonding points is large. Imaging parameters are found by summarizing these complex spectral distributions at each location in the medium with a second-order Voigt rheological model. This simplification reduces the dimensionality of the data for selecting imaging parameters while preserving essential information on how the creeping deformation describes fluid flow and collagen matrix restructuring in the medium. The focus of this paper is on imaging parameter estimation from ultrasonic echo data, and how jitter from hand-held force applicators used for clinical applications propagate through the imaging chain to generate image noise. PMID:17440244

Viscoelastic Properties of Collagen-Adhesive Composites under Water Saturated and Dry Conditions

PubMed Central

Singh, Viraj; Misra, Anil; Parthasarathy, Ranganathan; Ye, Qiang; Spencer, Paulette

2014-01-01

To investigate the time and rate dependent mechanical properties of collagen-adhesive composites, creep and monotonic experiments are performed under dry and wet conditions. The composites are prepared by infiltration of dentin adhesive into a demineralized bovine dentin. Experimental results show that for small stress level under dry conditions, both the composite and neat adhesive have similar behavior. On the other hand, in wet conditions, the composites are significantly soft and weak compared to the neat adhesives. The behavior in the wet condition is found to be affected by the hydrophilicity of both the adhesive and collagen. Since the adhesive-collagen composites area part of the complex construct that forms the adhesive-dentin interface, their presence will affect the overall performance of the restoration. We find that Kelvin-Voigt model with at least 4-elements is required to fit the creep compliance data, indicating that the adhesive-collagen composites are complex polymers with several characteristics time-scales whose mechanical behavior will be significantly affected by loading rates and frequencies. Such mechanical properties have not been investigated widely for these types of materials. The derived model provides an additional advantage that it can be exploited to extract other viscoelastic properties which are, generally, time consuming to obtain experimentally. The calibrated model is utilized to obtain stress relaxation function, frequency-dependent storage and loss modulus, and rate dependent elastic modulus. PMID:24753362

Ultrasonic measurements of breast viscoelasticity

PubMed Central

Sridhar, Mallika; Insana, Michael F.

2009-01-01

In vivo measurements of the viscoelastic properties of breast tissue are described. Ultrasonic echo frames were recorded from volunteers at 5 fps while applying a uniaxial compressive force (1–20 N) within a 1 s ramp time and holding the force constant for up to 200 s. A time series of strain images was formed from the echo data, spatially averaged viscous creep curves were computed, and viscoelastic strain parameters were estimated by fitting creep curves to a second-order Voigt model. The useful strain bandwidth from this quasi-static ramp stimulus was 10−2 ≤ ω ≤ 100 rad/s (0.0016–0.16 Hz). The stress-strain curves for normal glandular tissues are linear when the surface force applied is between 2 and 5 N. In this range, the creep response was characteristic of biphasic viscoelastic polymers, settling to a constant strain (arrheodictic) after 100 s. The average model-based retardance time constants for the viscoelastic response were 3.2±0.8 and 42.0±28 s. Also, the viscoelastic strain amplitude was approximately equal to that of the elastic strain. Above 5 N of applied force, however, the response of glandular tissue became increasingly nonlinear and rheodictic, i.e., tissue creep never reached a plateau. Contrasting in vivo breast measurements with those in gelatin hydrogels, preliminary ideas regarding the mechanisms for viscoelastic contrast are emerging. PMID:18196803

Application of the Hartmann-Tran profile to analysis of H2O spectra

NASA Astrophysics Data System (ADS)

Lisak, D.; Cygan, A.; Bermejo, D.; Domenech, J. L.; Hodges, J. T.; Tran, H.

2015-10-01

The Hartmann-Tran profile (HTP), which has been recently recommended as a new standard in spectroscopic databases, is used to analyze spectra of several lines of H2O diluted in N2, SF6, and in pure H2O. This profile accounts for various mechanisms affecting the line-shape and can be easily computed in terms of combinations of the complex Voigt profile. A multi-spectrum fitting procedure is implemented to simultaneously analyze spectra of H2O transitions acquired at different pressures. Multi-spectrum fitting of the HTP to a theoretical model confirms that this profile provides an accurate description of H2O line-shapes in terms of residuals and accuracy of fitted parameters. This profile and its limiting cases are also fit to measured spectra for three H2O lines in different vibrational bands. The results show that it is possible to obtain accurate HTP line-shape parameters when measured spectra have a sufficiently high signal-to-noise ratio and span a broad range of collisional-to-Doppler line widths. Systematic errors in the line area and differences in retrieved line-shape parameters caused by the overly simplistic line-shape models are quantified. Also limitations of the quadratic speed-dependence model used in the HTP are demonstrated in the case of an SF6 broadened H2O line, which leads to a strongly asymmetric line-shape.

GARLIC - A general purpose atmospheric radiative transfer line-by-line infrared-microwave code: Implementation and evaluation

NASA Astrophysics Data System (ADS)

Schreier, Franz; Gimeno García, Sebastián; Hedelt, Pascal; Hess, Michael; Mendrok, Jana; Vasquez, Mayte; Xu, Jian

2014-04-01

A suite of programs for high resolution infrared-microwave atmospheric radiative transfer modeling has been developed with emphasis on efficient and reliable numerical algorithms and a modular approach appropriate for simulation and/or retrieval in a variety of applications. The Generic Atmospheric Radiation Line-by-line Infrared Code - GARLIC - is suitable for arbitrary observation geometry, instrumental field-of-view, and line shape. The core of GARLIC's subroutines constitutes the basis of forward models used to implement inversion codes to retrieve atmospheric state parameters from limb and nadir sounding instruments. This paper briefly introduces the physical and mathematical basics of GARLIC and its descendants and continues with an in-depth presentation of various implementation aspects: An optimized Voigt function algorithm combined with a two-grid approach is used to accelerate the line-by-line modeling of molecular cross sections; various quadrature methods are implemented to evaluate the Schwarzschild and Beer integrals; and Jacobians, i.e. derivatives with respect to the unknowns of the atmospheric inverse problem, are implemented by means of automatic differentiation. For an assessment of GARLIC's performance, a comparison of the quadrature methods for solution of the path integral is provided. Verification and validation are demonstrated using intercomparisons with other line-by-line codes and comparisons of synthetic spectra with spectra observed on Earth and from Venus.

HITRAN Application Programming Interface (hapi): Extending HITRAN Capabilities

NASA Astrophysics Data System (ADS)

Kochanov, Roman V.; Gordon, Iouli E.; Rothman, Laurence S.; Wcislo, Piotr; Hill, Christian; Wilzewski, Jonas

2016-06-01

In this talk we present an update on the HITRAN Application Programming Interface (HAPI). HAPI is a free Python library providing a flexible set of tools to work with the most up-to-date spectroscopic data provided by HITRANonline (www.hitran.org) HAPI gives access to the spectroscopic parameters which are continuously being added to HITRANonline. For instance, these include non-Voigt profile parameters, foreign broadenings and shifts, and line mixing. HAPI enables more accurate spectra calculations for the spectroscopic and astrophysical applications requiring the detailed modeling of the broadener. HAPI implements an expert algorithm for the line profile selection for a single-layer radiative transfer calculation, and can be extended by custom line profiles and algorithms of their calculations, partition sums, instrumental functions, and temperature and pressure dependences. Possible HAPI applications include spectroscopic data validation and analysis as well as radiative-transfer calculations, experiment verification and spectroscopic code benchmarking. Kochanov RV, Gordon IE, et al. Submitted to JQSRT HighRus Special Issue 2016 Kochanov RV, Hill C, et al. ISMS 2015. http://hdl.handle.net/2142/79241 Hill C, Gordon IE, et al. Accepted to JQSRT HighRus Special Issue 2016. Wcislo P, Gordon IE, et al. Accepted to JQSRT HighRus Special Issue 2016. Wilzewski JS, Gordon IE, et al. JQSRT 2016;168:193-206. Kochanov RV, Gordon IE, et al. Clim Past 2015;11:1097-105.

The role of different network modifying cations on the speciation of the Co2 + complex in silicates and implication in the investigation of historical glasses

NASA Astrophysics Data System (ADS)

Fornacelli, Cristina; Ceglia, Andrea; Bracci, Susanna; Vilarigues, Marcia

2018-01-01

In the last decades the speciation of the cobalt complex in a glass matrix has been extensively studied. Bivalent cobalt ions in glasses of different composition commonly adopt a tetrahedral coordination, though hexa- or penta-coordinated species are also possible. Changes in the absorbance spectrum of Co-doped glasses were attested in previous studies according to the introduction of different modifying cations. A shifting of the first sub-band characterizing the typical triplets of tetrahedral Co2 + ions in both the visible and near infrared regions was observed, but discrepancies in literature suggested a relevant role of glass composition on the definition of the optical signature of cobalt. Co-doped glasses with different composition (soda-lime, potash-lime, mixed alkali and ZnO-Na2O-CaO-SiO2) were studied via Fiber Optic Reflectance Spectroscopy (FORS). Pseudo-Voigt functions were used for the deconvolution of the absorbance spectra and the features of the bands characteristic of each cobalt complex were investigated. The structural role played by each modifying cation and the fundamental implications of glass basicity on the speciation of different Co-complexes were stressed. Changes in glass structure resulted in different equilibria between the three absorbing species whose specific optical signatures in the 480-530 nm region interact to determine the resulting absorbance spectrum.

Line strength measurements and relative isotopic ratio 13C/12C measurements in carbon dioxide using cavity ring down spectroscopy

NASA Astrophysics Data System (ADS)

Kiseleva, M.; Mandon, J.; Persijn, S.; Harren, F. J. M.

2018-01-01

Accurate intensity measurements were performed for several lines of the two main isotopologues of carbon dioxide, using cavity ring down spectroscopy. Absorption spectra of the R52e line at 6112.8902 cm-1 (30014←00001 band) of 12CO2 and the P6e line at 6114.8580 cm-1 (30013←00001 band) of 13CO2 were recorded at pressures between 15 and 50 mbar at 298 K. Line shape analysis shows that Galatry profile, taking into account Dicke narrowing of spectral lines, better describes the measured spectra at all pressures than the Voigt profile. The values of Dicke narrowing parameter for both lines were found to be significantly smaller than those predicted based on the mass diffusion constant. The values of the line strength for R52e line of 12CO2 and P6e line of 13CO2 were determined with an uncertainty of 0.5%. These values were found to be in good agreement with the corresponding data available in literature, in particular with the most recent ab initio calculations. The results of relative isotopic ratio 13CO2/12CO2 measurements are also presented in pure carbon dioxide samples and in 400 μmol/mol carbon dioxide in air samples, using cavity ring down spectroscopy.

Ab-initio study of C15-type Laves phase superconductor LaRu2

NASA Astrophysics Data System (ADS)

Kholil, Md. Ibrahim; Islam, Md. Shahinur; Rahman, Md. Atikur

2017-01-01

Structural, elastic, electronic, optical, thermodynamic, and superconducting properties of the Laves phase superconductor LaRu2 with Tc 1.63 K were investigated using the first-principles calculations for the first time. The corresponding evaluated structural parameters are in good agreement with the available theoretical values. The different elastic properties like as, elastic constants, bulk modulus B, shear modulus G, Young's modulus E, and Poisson ratio ν were calculated using the Voigt-Reuss-Hill approximation. The ductility nature appears in both values of Cauchy pressure and Pugh's ratio. The band structure and Cauchy pressure shows that the material behaves metallic nature. The calculated total density of state is 6.80 (electrons/eV) of LaRu2. The optical properties such as reflectivity, absorption spectrum, refractive index, dielectric function, conductivity, and energy loss spectrum are also calculated. The photoconductivity reveals the metallic nature of LaRu2 and absorption coefficient is good in the infrared region. The evaluated density and Debye temperature are 9.55 gm/cm3 and 110.51 K, respectively. In addition, the study of thermodynamic properties like as minimum thermal conductivity, melting temperature, and Dulong-Petit limit are 0.26 (Wm-1 K-1), 1,471.65 K, and 74.80 (J/mole K), respectively. Finally, the investigated electron-phonon coupling constant is 0.66 of LaRu2 superconductor.

Shape measurement biases from underfitting and ellipticity gradients

DOE PAGES

Bernstein, Gary M.

2010-08-21

With this study, precision weak gravitational lensing experiments require measurements of galaxy shapes accurate to <1 part in 1000. We investigate measurement biases, noted by Voigt and Bridle (2009) and Melchior et al. (2009), that are common to shape measurement methodologies that rely upon fitting elliptical-isophote galaxy models to observed data. The first bias arises when the true galaxy shapes do not match the models being fit. We show that this "underfitting bias" is due, at root, to these methods' attempts to use information at high spatial frequencies that has been destroyed by the convolution with the point-spread function (PSF)more » and/or by sampling. We propose a new shape-measurement technique that is explicitly confined to observable regions of k-space. A second bias arises for galaxies whose ellipticity varies with radius. For most shape-measurement methods, such galaxies are subject to "ellipticity gradient bias". We show how to reduce such biases by factors of 20–100 within the new shape-measurement method. The resulting shear estimator has multiplicative errors < 1 part in 10 3 for high-S/N images, even for highly asymmetric galaxies. Without any training or recalibration, the new method obtains Q = 3000 in the GREAT08 Challenge of blind shear reconstruction on low-noise galaxies, several times better than any previous method.« less

Seismic properties and mineral crystallographic preferred orientations from EBSD data: Results from a crustal-scale detachment system, Aegean region

NASA Astrophysics Data System (ADS)

Cossette, Élise; Schneider, David; Audet, Pascal; Grasemann, Bernhard; Habler, Gerlinde

2015-05-01

The crystallographic preferred orientations (CPOs) were measured on a suite of samples representative of different structural depths along the West Cycladic Detachment System, Greece. Electron backscatter diffraction (EBSD) analyses were conducted on calcitic and mica schists, impure quartzites, and a blueschist, and the average seismic properties of the rocks were calculated with the Voigt-Reuss-Hill average of the single minerals' elastic stiffness tensor. The calcitic and quartzitic rocks have P- and S-wave velocity anisotropies (AVp, AVs) averaging 8.1% and 7.1%, respectively. The anisotropy increases with depth represented by the blueschist, with AVp averaging 20.3% and AVs averaging 14.5%, due to the content of aligned glaucophane and mica, which strongly control the seismic properties of the rocks. Localised anisotropies of very high magnitudes are caused by the presence of mica schists as they possess the strongest anisotropies, with values of ~ 25% for AVp and AVs. The direction of the fast and slow P-wave velocities occurs parallel and perpendicular to the foliation, respectively, for most samples. The fast propagation has the same NE-SW orientation as the lithospheric stretching direction experienced in the Cyclades since the Late Oligocene. The maximum shear wave anisotropy is subhorizontal, similarly concordant with mineral alignment that developed during extension in the Aegean. Radial anisotropy in the Aegean mid-crust is strongly favoured to azimuthal anisotropy by our results.

Microstructural characterisation of proton irradiated niobium using X-ray diffraction technique

NASA Astrophysics Data System (ADS)

Dutta, Argha; Gayathri, N.; Neogy, S.; Mukherjee, P.

2018-04-01

The microstructural parameters in pure Nb, irradiated with 5 MeV proton beam have been evaluated as a function of dose using X-ray diffraction line profile analysis. In order to assess the microstructural changes in the homogeneous region and in the peak damage region of the damage energy deposition profile, X-ray diffraction patterns have been collected using two different geometries (Bragg-Brentano and parallel beam geometries). Different X-ray line profile analysis like Williamson-Hall (W-H) analysis, modified W-H analysis, double-Voigt analysis, modified Rietveld technique and convolutional multiple whole profile fitting have been employed to extract the microstructural parameters like coherent domain size, microstrain within the domain, dislocation density and arrangement of dislocations. The coherent domain size decreases drastically along with increase in microstrain and dislocation density in the first dose for both the geometries. With increasing dose, a decreasing trend in microstrain associated with decrease in dislocation density is observed for both the geometries. This is attributed to the formation of defect clusters due to irradiation which with increasing dose collapse to dislocation loops to minimise the strain in the matrix. This is corroborated with the observation of black dots and loops in the TEM images. No significant difference is observed in the trend of microstructural parameters between the homogeneous and peak damage region of the damage profile.

Computational Modeling of Seismic Wave Propagation Velocity-Saturation Effects in Porous Rocks

NASA Astrophysics Data System (ADS)

Deeks, J.; Lumley, D. E.

2011-12-01

Compressional and shear velocities of seismic waves propagating in porous rocks vary as a function of the fluid mixture and its distribution in pore space. Although it has been possible to place theoretical upper and lower bounds on the velocity variation with fluid saturation, predicting the actual velocity response of a given rock with fluid type and saturation remains an unsolved problem. In particular, we are interested in predicting the velocity-saturation response to various mixtures of fluids with pressure and temperature, as a function of the spatial distribution of the fluid mixture and the seismic wavelength. This effect is often termed "patchy saturation' in the rock physics community. The ability to accurately predict seismic velocities for various fluid mixtures and spatial distributions in the pore space of a rock is useful for fluid detection, hydrocarbon exploration and recovery, CO2 sequestration and monitoring of many subsurface fluid-flow processes. We create digital rock models with various fluid mixtures, saturations and spatial distributions. We use finite difference modeling to propagate elastic waves of varying frequency content through these digital rock and fluid models to simulate a given lab or field experiment. The resulting waveforms can be analyzed to determine seismic traveltimes, velocities, amplitudes, attenuation and other wave phenomena for variable rock models of fluid saturation and spatial fluid distribution, and variable wavefield spectral content. We show that we can reproduce most of the published effects of velocity-saturation variation, including validating the Voigt and Reuss theoretical bounds, as well as the Hill "patchy saturation" curve. We also reproduce what has been previously identified as Biot dispersion, but in fact in our models is often seen to be wave multi-pathing and broadband spectral effects. Furthermore, we find that in addition to the dominant seismic wavelength and average fluid patch size, the smoothness of the fluid patches are a critical factor in determining the velocity-saturation response; this is a result that we have not seen discussed in the literature. Most importantly, we can reproduce all of these effects using full elastic wavefield scattering, without the need to resort to more complicated squirt-flow or poroelastic models. This is important because the physical properties and parameters we need to model full elastic wave scattering, and predict a velocity-saturation curve, are often readily available for projects we undertake; this is not the case for poroelastic or squirt-flow models. We can predict this velocity saturation curve for a specific rock type, fluid mixture distribution and wavefield spectrum.

3D seismic modeling in geothermal reservoirs with a distribution of steam patch sizes, permeabilities and saturations, including ductility of the rock frame

NASA Astrophysics Data System (ADS)

Carcione, José M.; Poletto, Flavio; Farina, Biancamaria; Bellezza, Cinzia

2018-06-01

Seismic propagation in the upper part of the crust, where geothermal reservoirs are located, shows generally strong velocity dispersion and attenuation due to varying permeability and saturation conditions and is affected by the brittleness and/or ductility of the rocks, including zones of partial melting. From the elastic-plastic aspect, the seismic properties (seismic velocity, quality factor and density) depend on effective pressure and temperature. We describe the related effects with a Burgers mechanical element for the shear modulus of the dry-rock frame. The Arrhenius equation combined to the octahedral stress criterion define the Burgers viscosity responsible of the brittle-ductile behaviour. The effects of permeability, partial saturation, varying porosity and mineral composition on the seismic properties is described by a generalization of the White mesoscopic-loss model to the case of a distribution of heterogeneities of those properties. White model involves the wave-induced fluid flow attenuation mechanism, by which seismic waves propagating through small-scale heterogeneities, induce pressure gradients between regions of dissimilar properties, where part of the energy of the fast P-wave is converted to slow P (Biot)-wave. We consider a range of variations of the radius and size of the patches and thin layers whose probability density function is defined by different distributions. The White models used here are that of spherical patches (for partial saturation) and thin layers (for permeability heterogeneities). The complex bulk modulus of the composite medium is obtained with the Voigt-Reuss-Hill average. Effective pressure effects are taken into account by using exponential functions. We then solve the 3D equation of motion in the space-time domain, by approximating the White complex bulk modulus with that of a set of Zener elements connected in series. The Burgers and generalized Zener models allows us to solve the equations with a direct grid method by the introduction of memory variables. The algorithm uses the Fourier pseudospectral method to compute the spatial derivatives. It is tested against an analytical solution obtained with the correspondence principle. We consider two main cases, namely the same rock frame (uniform porosity and permeability) saturated with water and a distribution of steam patches, and water-saturated background medium with thin layers of dissimilar permeability. Our model indicates how seismic properties change with the geothermal reservoir temperature and pressure, showing that both seismic velocity and attenuation can be used as a diagnostic tool to estimate the in situ conditions.

The CO2 absorption continuum by high pressure CRDS in the 1.74 μm window

NASA Astrophysics Data System (ADS)

Mondelain, D.; Campargue, A.; Čermák, P.; Gamache, R. R.; Kassi, S.; Tashkun, S. A.; Tran, H.

2017-12-01

The very weak absorption continuum of CO2 is studied by Cavity Ring Down Spectroscopy in three 20 cm-1 wide spectral intervals near the centre of the 1.74 μm window (5693-5795 cm-1). For each spectral interval, a set of room temperature spectra is recorded at pressures between 0 and 10 bar thanks to a high pressure CRDS spectrometer. The absorption continuum is retrieved after subtraction of the contributions due to Rayleigh scattering and to local lines of CO2 and water (present as an impurity in the sample) from the measured extinction. Due to some deficiencies of the CO2 HITRAN2012 line list, a composite line list had to be built on the basis of the Ames calculated line list with line positions adjusted according to the Carbon Dioxide Spectroscopic Databank and self-broadening and pressure shift coefficients calculated with the Complex Robert Bonamy method. The local line contribution of the CO2 monomer is calculated using this list and a Voigt profile truncated at ±25 cm-1 from the line centre. Line mixing effects were taken into account through the use of the impact and Energy Corrected Sudden approximations. The density dependence of the retrieved continuum absorption was found to be purely quadratic in the low frequency interval below 5710 cm-1 but a small significant linear contribution was required to reproduce the observations above this value. This linear increase is tentatively attributed to the foreign-continuum of water vapor present in CO2 sample with a relative concentration of some tens ppm. The retrieved binary coefficient is observed to vary smoothly with the wavenumber with a minimum value of 6×10-10 cm-1 amagat-2. By gathering the present data with the results reported in Kassi et al. J Quant Spectrosc Radiat Transf 2015;167:97, a recommended set of binary coefficients is provided for the 5700-5950 cm-1 region.

Influence of sickle hemoglobin polymerization and membrane properties on deformability of sickle erythrocytes in the microcirculation.

PubMed Central

Dong, C; Chadwick, R S; Schechter, A N

1992-01-01

The rheological properties of normal erythrocytes appear to be largely determined by those of the red cell membrane. In sickle cell disease, the intracellular polymerization of sickle hemoglobin upon deoxygenation leads to a marked increase in intracellular viscosity and elastic stiffness as well as having indirect effects on the cell membrane. To estimate the components of abnormal cell rheology due to the polymerization process and that due to the membrane abnormalities, we have developed a simple mathematical model of whole cell deformability in narrow vessels. This model uses hydrodynamic lubrication theory to describe the pulsatile flow in the gap between a cell and the vessel wall. The interior of the cell is modeled as a Voigt viscoelastic solid with parameters for the viscous and elastic moduli, while the membrane is assigned an elastic shear modulus. In response to an oscillatory fluid shear stress, the cell--modeled as a cylinder of constant volume and surface area--undergoes a conical deformation which may be calculated. We use published values of normal and sickle cell membrane elastic modulus and of sickle hemoglobin viscous and elastic moduli as a function of oxygen saturation, to estimate normalized tip displacement, d/ho, and relative hydrodynamic resistance, Rr, as a function of polymer fraction of hemoglobin for sickle erythrocytes. These results show the transition from membrane to internal polymer dominance of deformability as oxygen saturation is lowered. More detailed experimental data, including those at other oscillatory frequencies and for cells with higher concentrations of hemoglobin S, are needed to apply fully this approach to understanding the deformability of sickle erythrocytes in the microcirculation. The model should be useful for reconciling the vast and disparate sets of data available on the abnormal properties of sickle cell hemoglobin and sickle erythrocyte membranes, the two main factors that lead to pathology in patients with this disease. PMID:1420913

The asymptotic homogenization elasticity tensor properties for composites with material discontinuities

NASA Astrophysics Data System (ADS)

Penta, Raimondo; Gerisch, Alf

2017-01-01

The classical asymptotic homogenization approach for linear elastic composites with discontinuous material properties is considered as a starting point. The sharp length scale separation between the fine periodic structure and the whole material formally leads to anisotropic elastic-type balance equations on the coarse scale, where the arising fourth rank operator is to be computed solving single periodic cell problems on the fine scale. After revisiting the derivation of the problem, which here explicitly points out how the discontinuity in the individual constituents' elastic coefficients translates into stress jump interface conditions for the cell problems, we prove that the gradient of the cell problem solution is minor symmetric and that its cell average is zero. This property holds for perfect interfaces only (i.e., when the elastic displacement is continuous across the composite's interface) and can be used to assess the accuracy of the computed numerical solutions. These facts are further exploited, together with the individual constituents' elastic coefficients and the specific form of the cell problems, to prove a theorem that characterizes the fourth rank operator appearing in the coarse-scale elastic-type balance equations as a composite material effective elasticity tensor. We both recover known facts, such as minor and major symmetries and positive definiteness, and establish new facts concerning the Voigt and Reuss bounds. The latter are shown for the first time without assuming any equivalence between coarse and fine-scale energies ( Hill's condition), which, in contrast to the case of representative volume elements, does not identically hold in the context of asymptotic homogenization. We conclude with instructive three-dimensional numerical simulations of a soft elastic matrix with an embedded cubic stiffer inclusion to show the profile of the physically relevant elastic moduli (Young's and shear moduli) and Poisson's ratio at increasing (up to 100 %) inclusion's volume fraction, thus providing a proxy for the design of artificial elastic composites.

Numerical modeling of the deformations associated with large subduction earthquakes through the seismic cycle

NASA Astrophysics Data System (ADS)

Fleitout, L.; Trubienko, O.; Garaud, J.; Vigny, C.; Cailletaud, G.; Simons, W. J.; Satirapod, C.; Shestakov, N.

2012-12-01

A 3D finite element code (Zebulon-Zset) is used to model deformations through the seismic cycle in the areas surrounding the last three large subduction earthquakes: Sumatra, Japan and Chile. The mesh featuring a broad spherical shell portion with a viscoelastic asthenosphere is refined close to the subduction zones. The model is constrained by 6 years of postseismic data in Sumatra area and over a year of data for Japan and Chile plus preseismic data in the three areas. The coseismic displacements on the subduction plane are inverted from the coseismic displacements using the finite element program and provide the initial stresses. The predicted horizontal postseismic displacements depend upon the thicknesses of the elastic plate and of the low viscosity asthenosphere. Non-dimensionalized by the coseismic displacements, they present an almost uniform value between 500km and 1500km from the trench for elastic plates 80km thick. The time evolution of the velocities is function of the creep law (Maxwell, Burger or power-law creep). Moreover, the forward models predict a sizable far-field subsidence, also with a spatial distribution which varies with the geometry of the asthenosphere and lithosphere. Slip on the subduction interface does not induce such a subsidence. The observed horizontal velocities, divided by the coseismic displacement, present a similar pattern as function of time and distance from trench for the three areas, indicative of similar lithospheric and asthenospheric thicknesses and asthenospheric viscosity. This pattern cannot be fitted with power-law creep in the asthenosphere but indicates a lithosphere 60 to 90km thick and an asthenosphere of thickness of the order of 100km with a burger rheology represented by a Kelvin-Voigt element with a viscosity of 3.1018Pas and μKelvin=μelastic/3. A second Kelvin-Voigt element with very limited amplitude may explain some characteristics of the short time-scale signal. The postseismic subsidence is conspicuous over Thailand and Malaysia (Satirapod et al., ASR, 2012). A low viscosity wedge, with a viscosity of the order of 3. 1018 Pas is necessary to explain data in the middle-field (volcanic arc area). Post-seismic slip on the fault plane (15% of the cosismic slip) in the months after the earthquakes explains near-field deformations. The creep law and geometry deduced from postseismic data can be used to predict deformations through the seismic cycle. Far away (500 to 1500km) sizable (5mm/yr to 1cm/yr) interseismic horizontal velocities are expected. Although one should not deny the presence of long-term intraplate geologic deformations, the seismic cycle contributes significantly to the intraplate compressive preseismic deformations in the Sunda and Amurian plates. The interseismic peak in vertical velocity, predicted by elastic backslip models over the end of the locked portion of the interface can be, in viscoelastic models, pushed over the continentward border of the LVW. This may explain the pattern of vertical velocities in Northern Honshu previous to Tohoku earthquake. The deviatoric stresses associated with the seismic cycle add up to the long-term tectonic stresses and are predicted to induce a peak in extensional stress in the subducting and overriding plates with a time delay which increases with the distance to the subduction zone.

Fourier Transform Spectroscopy of two trace gases namely Methane and Carbon monoxide for planetary and atmospheric research application

NASA Astrophysics Data System (ADS)

Hashemi, R.; Dudaryonok, A. S.; Lavrentieva, N. N.; Vandaele, A. C.; Vander Auwera, J.; Tyuterev, AV Nikitin G., VI; Sung, K.; Smith, M. A. H.; Devi, V. M.; Predoi-Cross, A.

2017-02-01

Two atmospheric trace gases, namely methane and carbon monoxide have been considered in this study. Fourier transform absorption spectra of the 2-0 band of 12C16O mixed with CO2 have been recorded at total pressures from 156 to 1212 hPa and at 4 different temperatures between 240 K and 283 K. CO2 pressure-induced line broadening and line shift coefficients, and the associated temperature dependence have been measured in an multi-spectrum non-linear least squares analysis using Voigt profiles with an asymmetric profile due to line mixing. The measured CO2-broadening and CO2-shift parameters were compared with theoretical values, calculated by collaborators. In addition, the CO2-broadening and shift coefficients have been calculated for individual temperatures using the Exponential Power Gap (EPG) semi-empirical method. We also discuss the retrieved line shape parameters for Methane transitions in the spectral range known as the Methane Octad. We used high resolution spectra of pure methane and of dilute mixtures of methane in dry air, recorded with high signal to noise ratio at temperatures between 148 K and room temperature using the Bruker IFS 125 HR Fourier transform spectrometer (FTS) at the Jet Propulsion Laboratory, Pasadena, California. Theoretical calculations for line parameters have been performed and the results are compared with the previously published values and with the line parameters available in the GEISA2015 [1] and HITRAN2012 [2] databases.

Measurements of axisymmetric temperature and H2O concentration distributions on a circular flat flame burner based on tunable diode laser absorption tomography

NASA Astrophysics Data System (ADS)

Xia, Huihui; Kan, Ruifeng; Xu, Zhenyu; Liu, Jianguo; He, Yabai; Yang, Chenguang; Chen, Bing; Wei, Min; Yao, Lu; Zhang, Guangle

2016-10-01

In this paper, the reconstruction of axisymmetric temperature and H2O concentration distributions in a flat flame burner is realized by tunable diode laser absorption spectroscopy (TDLAS) and filtered back-projection (FBP) algorithm. Two H2O absorption transitions (7154.354/7154.353 cm-1 and 7467.769 cm-1) are selected as line pair for temperature measurement, and time division multiplexing technology is adopted to scan this two H2O absorption transitions simultaneously at 1 kHz repetition rate. In the experiment, FBP algorithm can be used for reconstructing axisymmetric distributions of flow field parameters with only single view parallel-beam TDLAS measurements, and the same data sets from the given parallel beam are used for other virtual projection angles and beams scattered between 0° and 180°. The real-time online measurements of projection data, i.e., integrated absorbance both for pre-selected transitions on CH4/air flat flame burner are realized by Voigt on-line fitting, and the fitting residuals are less than 0.2%. By analyzing the projection data from different views based on FBP algorithm, the distributions of temperature and concentration along radial direction can be known instantly. The results demonstrate that the system and the proposed innovative FBP algorithm are capable for accurate reconstruction of axisymmetric temperature and H2O concentration distribution in combustion systems and facilities.

The CO2 absorption spectrum in the 2.3 μm transparency window by high sensitivity CRDS: (II) Self-absorption continuum

NASA Astrophysics Data System (ADS)

Mondelain, D.; Vasilchenko, S.; Čermák, P.; Kassi, S.; Campargue, A.

2017-01-01

The CO2 absorption continuum near 2.3 μm is determined for a series of sub atmospheric pressures (250-750 Torr) by high sensitivity Cavity Ring Down Spectroscopy. An experimental procedure consisting in injecting successively a gas flow of CO2 and synthetic air, keeping constant the gas pressure in the CRDS cell, has been developed. This procedure insures a high stability of the spectra baseline by avoiding changes of the optical alignment due to pressure changes. The CO2 continuum was obtained as the difference between the CO2 absorption coefficient and a local lines simulation using a Voigt profile truncated at ±25 cm-1. Following the results of the preceding analysis of the CO2 rovibrational lines (Vasilchenko S et al. J Quant Spectrosc Radiat Transfer 10.1016/j.jqsrt.2016.07.002, a CO2 line list with intensities obtained by variational calculations and empirical line positions was preferred to the HITRAN line list. A quadratic pressure dependence of the absorption continuum is observed, with an average binary absorption coefficient increasing from 2 to 4×10-8 cm-1 amagat-2 between 4320 and 4380 cm-1. The obtained continuum is found in good agreement with a previous measurement using much higher densities (20 amagat) and a low resolution grating spectrograph and is consistent with values currently used in the analysis of Venus spectra.

Study of structural, elastic, electronic and optical properties of seven SrZrO{sub 3} phases: First-principles calculations

DOE Office of Scientific and Technical Information (OSTI.GOV)

Liu, Qi-Jun, E-mail: dianerliu@yahoo.com.cn; Liu, Zheng-Tang; Feng, Li-Ping

2012-12-15

On the plane-wave ultrasoft pseudopotential technique based on the first-principles density functional theory (DFT), we calculated the structural, elastic, electronic and optical properties of the seven different phases of SrZrO{sub 3}. The obtained ground-state properties are in good agreement with previous experiments and calculations, which indicate that the most stable phase is orthorhombic Pnma structure. Seven phases of SrZrO{sub 3} are mechanically stable with cubic, tetragonal and orthorhombic structures. The mechanical and thermodynamic properties have been obtained by using the Voigt-Reuss-Hill approach and Debye-Grueneisen model. The electronic structures and optical properties are obtained and compared with the available experimental andmore » theoretical data. - Graphical abstract: Energy versus volume of seven phases SrZrO{sub 3} shows the Pnma phase has the minimum ground-state energy. Highlights: Black-Right-Pointing-Pointer We calculated the physical and chemical properties of seven SrZrO{sub 3} polymorphs. Black-Right-Pointing-Pointer The order of stability is Pnma>Imma>Cmcm>I4/mcm>P4/mbm>P4mm>Pm3-bar m. Black-Right-Pointing-Pointer The most stable phase is orthorhombic Pnma structure. Black-Right-Pointing-Pointer Seven phases of SrZrO{sub 3} are mechanically stable. Black-Right-Pointing-Pointer The relationship between n and {rho}{sub m} is n=1+0.18{rho}{sub m}.« less

Elastic properties of transparent nano-polycrystalline diamond measured by GHz-ultrasonic interferometry and resonant sphere methods

NASA Astrophysics Data System (ADS)

Chang, Yun-Yuan; Jacobsen, Steven D.; Kimura, Masaki; Irifune, Tetsuo; Ohno, Ichiro

2014-03-01

The sound velocities and elastic moduli of transparent nano-polycrystalline diamond (NPD) have been determined by GHz-ultrasonic interferometry on three different bulk samples, and by resonant spectroscopy on a spherically fabricated NPD sample. We employ a newly-developed optical contact micrometer to measure the thickness of ultrasonic samples to ±0.05 μm with a spatial resolution of ∼50 μm in the same position of the GHz-ultrasonic measurements, resulting in acoustic-wave sound velocity measurements with uncertainties of 0.005-0.02%. The isotropic and adiabatic bulk and shear moduli of NPD measured by GHz-ultrasonic interferometry are KS0 = 442.5 (±0.5) GPa and G0 = 532.4 (±0.5) GPa. By rotating the shear-wave polarization direction, we observe no transverse anisotropy in this NPD. Using resonant sphere spectroscopy, we obtain KS0 = 440.3 (±0.5) GPa and G0 = 532.7 (±0.4) GPa. For comparison, we also measured by GHz-ultrasonic interferometry the elastic constants of a natural single-crystal type-IA diamond with about one-half the experimental uncertainty of previous measurements. The resulting Voigt-Reuss-Hill averaged bulk and shear moduli of natural diamond are KS0 = 441.8 (±0.8) GPa and G0 = 532.6 (±0.5) GPa, demonstrating that the bulk-elastic properties of transparent NPD are equivalent to natural single-crystal diamond as calculated from polycrystalline averaging of its elastic constants.

Hydrogen Balmer Line Broadening in Solar and Stellar Flares

NASA Technical Reports Server (NTRS)

Kowalski, Adam F.; Allred, Joel C.; Uitenbroek, Han; Tremblay, Pier-Emmanuel; Brown, Stephen; Carlsson, Mats; Osten, Rachel A.; Wisniewski, John P.; Hawley, Suzanne L.

2017-01-01

The broadening of the hydrogen lines during flares is thought to result from increased charge (electron, proton) density in the flare chromosphere. However, disagreements between theory and modeling prescriptions have precluded an accurate diagnostic of the degree of ionization and compression resulting from flare heating in the chromosphere. To resolve this issue, we have incorporated the unified theory of electric pressure broadening of the hydrogen lines into the non-LTE radiative-transfer code RH. This broadening prescription produces a much more realistic spectrum of the quiescent, A0 star Vega compared to the analytic approximations used as a damping parameter in the Voigt profiles. We test recent radiative-hydrodynamic (RHD) simulations of the atmospheric response to high nonthermal electron beam fluxes with the new broadening prescription and find that the Balmer lines are overbroadened at the densest times in the simulations. Adding many simultaneously heated and cooling model loops as a 'multithread' model improves the agreement with the observations. We revisit the three component phenomenological flare model of the YZ CMi Megaflare using recent and new RHD models. The evolution of the broadening, line flux ratios, and continuum flux ratios are well-reproduced by a multithread model with high-flux nonthermal electron beam heating, an extended decay phase model, and a 'hot spot' atmosphere heated by an ultra relativistic electron beam with reasonable filling factors: approximately 0.1%, 1%, and 0.1% of the visible stellar hemisphere, respectively. The new modeling motivates future work to understand the origin of the extended gradual phase emission.

Characterization of a hyper-viscoelastic phantom mimicking biological soft tissue using an abdominal pneumatic driver with Magnetic Resonance Elastography (MRE)

PubMed Central

Leclerc, Gwladys E.; Debernard, Laetitia; Foucart, Félix; Robert, Ludovic; Pelletier, Kay M.; Charleux, Fabrice; Ehman, Richard; Tho, Marie-Christine Ho Ba; Bensamoun, Sabine F.

2012-01-01

The purpose of this study was to create a polymer phantom mimicking the mechanical properties of soft tissues using experimental tests and rheological models. Multifrequency Magnetic Resonance Elastography (MMRE) tests were performed on the present phantom with a pneumatic driver to characterize the viscoelastic (μ, η) properties using Voigt, Maxwell, Zener and Springpot models. To optimize the MMRE protocol, the driver behavior was analyzed with a vibrometer. Moreover, the hyperelastic properties of the phantom were determined using compressive tests and Mooney-Rivlin model. The range of frequency to be used with the round driver was found between 60 Hz and 100 Hz as it exhibits one type of vibration mode for the membrane. MRE analysis revealed an increase in the shear modulus with frequency reflecting the viscoelastic properties of the phantom showing similar characteristic of soft tissues. Rheological results demonstrated that Springpot model better revealed the viscoelastic properties (μ = 3.45 kPa, η = 6.17 Pa.s) of the phantom and the Mooney-Rivlin coefficients were C10 = 1.09.10-2 MPa and C01 = −8.96.10-3 MPa corresponding to μ = 3.95 kPa. These studies suggest that the phantom, mimicking soft tissue, could be used for preliminary MRE tests to identify the optimal parameters necessary for in vivo investigations. Further developments of the phantom may allow clinicians to more accurately mimic healthy and pathological soft tissues using MRE. PMID:22284992

Characterization of a hyper-viscoelastic phantom mimicking biological soft tissue using an abdominal pneumatic driver with magnetic resonance elastography (MRE).

PubMed

Leclerc, Gwladys E; Debernard, Laëtitia; Foucart, Félix; Robert, Ludovic; Pelletier, Kay M; Charleux, Fabrice; Ehman, Richard; Ho Ba Tho, Marie-Christine; Bensamoun, Sabine F

2012-04-05

The purpose of this study was to create a polymer phantom mimicking the mechanical properties of soft tissues using experimental tests and rheological models. Multifrequency Magnetic Resonance Elastography (MMRE) tests were performed on the present phantom with a pneumatic driver to characterize the viscoelastic (μ, η) properties using Voigt, Maxwell, Zener and Springpot models. To optimize the MMRE protocol, the driver behavior was analyzed with a vibrometer. Moreover, the hyperelastic properties of the phantom were determined using compressive tests and Mooney-Rivlin model. The range of frequency to be used with the round driver was found between 60 Hz and 100 Hz as it exhibits one type of vibration mode for the membrane. MRE analysis revealed an increase in the shear modulus with frequency reflecting the viscoelastic properties of the phantom showing similar characteristic of soft tissues. Rheological results demonstrated that Springpot model better revealed the viscoelastic properties (μ=3.45 kPa, η=6.17 Pas) of the phantom and the Mooney-Rivlin coefficients were C(10)=1.09.10(-2) MPa and C(01)=-8.96.10(-3) MPa corresponding to μ=3.95 kPa. These studies suggest that the phantom, mimicking soft tissue, could be used for preliminary MRE tests to identify the optimal parameters necessary for in vivo investigations. Further developments of the phantom may allow clinicians to more accurately mimic healthy and pathological soft tissues using MRE. Copyright © 2012 Elsevier Ltd. All rights reserved.

Structural and magnetic properties of turmeric functionalized CoFe2O4 nanocomposite powder

NASA Astrophysics Data System (ADS)

Mehran, E.; Farjami Shayesteh, S.; Sheykhan, M.

2016-10-01

The structural and magnetic properties of the synthesized pure and functionalized CoFe2O4 magnetic nanoparticles (NPs) are studied by analyzing the results from the x-ray diffraction (XRD), transmission electron microscopy (TEM), FT-IR spectroscopy, thermogravimetry (TG), and vibrating sample magnetometer (VSM). To extract the structure and lattice parameters from the XRD analysis results, we first apply the pseudo-Voigt model function to the experimental data obtained from XRD analysis and then the Rietveld algorithm is used in order to optimize the model function to estimate the true intensity values. Our simulated intensities are in good agreement with the experimental peaks, therefore, all structural parameters such as crystallite size and lattice constant are achieved through this simulation. Magnetic analysis reveals that the synthesized functionalized NPs have a saturation magnetization almost equal to that of pure nanoparticles (PNPs). It is also found that the presence of the turmeric causes a small reduction in coercivity of the functionalized NPs in comparison with PNP. Our TGA and FTIR results show that the turmeric is bonded very well to the surface of the NPs. So it can be inferred that a nancomposite (NC) powder of turmeric and nanoparticles is produced. As an application, the anti-arsenic characteristic of turmeric makes the synthesized functionalized NPs or NC powder a good candidate for arsenic removal from polluted industrial waste water. Project supported by the University of Guilan and the Iran Nanotechnology Initiative Council.

Perfluorocarbon induces alveolar epithelial cell response through structural and mechanical remodeling.

PubMed

André Dias, Sofia; Planus, Emmanuelle; Angely, Christelle; Lotteau, Luc; Tissier, Renaud; Filoche, Marcel; Louis, Bruno; Pelle, Gabriel; Isabey, Daniel

2018-02-15

During total liquid ventilation, lung cells are exposed to perfluorocarbon (PFC) whose chemophysical properties highly differ from standard aqueous cell feeding medium (DMEM). We herein perform a systematic study of structural and mechanical properties of A549 alveolar epithelial cells in order to characterize their response to PFC exposure, using DMEM as control condition. Changes in F-actin structure, focal adhesion density and glycocalyx distribution are evaluated by confocal fluorescent microscopy. Changes in cell mechanics and adhesion are measured by multiscale magnetic twisting cytometry (MTC). Two different microrheological models (single Voigt and power law) are used to analyze the cell mechanics characterized by cytoskeleton (CSK) stiffness and characteristic relaxation times. Cell-matrix adhesion is analyzed using a stochastic multibond deadhesion model taking into account the non-reversible character of the cell response, allowing us to quantify the adhesion weakness and the number of associated bonds. The roles of F-actin structure and glycocalyx layer are evaluated by depolymerizing F-actin and degrading glycocalyx, respectively. Results show that PFC exposure consistently induces F-actin remodeling, CSK softening and adhesion weakening. These results demonstrate that PFC triggers an alveolar epithelial cell response herein evidenced by a decay in intracellular CSK tension, an adhesion weakening and a glycocalyx layer redistribution. These PFC-induced cell adjustments are consistent with the hypothesis that cells respond to a decrease in adhesion energy at cell surface. This adhesion energy can be even further reduced in the presence of surfactant adsorbed at the cell surface.

The role of different network modifying cations on the speciation of the Co2+ complex in silicates and implication in the investigation of historical glasses.

PubMed

Fornacelli, Cristina; Ceglia, Andrea; Bracci, Susanna; Vilarigues, Marcia

2018-01-05

In the last decades the speciation of the cobalt complex in a glass matrix has been extensively studied. Bivalent cobalt ions in glasses of different composition commonly adopt a tetrahedral coordination, though hexa- or penta-coordinated species are also possible. Changes in the absorbance spectrum of Co-doped glasses were attested in previous studies according to the introduction of different modifying cations. A shifting of the first sub-band characterizing the typical triplets of tetrahedral Co 2+ ions in both the visible and near infrared regions was observed, but discrepancies in literature suggested a relevant role of glass composition on the definition of the optical signature of cobalt. Co-doped glasses with different composition (soda-lime, potash-lime, mixed alkali and ZnO-Na 2 O-CaO-SiO 2 ) were studied via Fiber Optic Reflectance Spectroscopy (FORS). Pseudo-Voigt functions were used for the deconvolution of the absorbance spectra and the features of the bands characteristic of each cobalt complex were investigated. The structural role played by each modifying cation and the fundamental implications of glass basicity on the speciation of different Co-complexes were stressed. Changes in glass structure resulted in different equilibria between the three absorbing species whose specific optical signatures in the 480-530nm region interact to determine the resulting absorbance spectrum. Copyright © 2017 Elsevier B.V. All rights reserved.

Internal viscoelastic loading in cat papillary muscle.

PubMed Central

Chiu, Y L; Ballou, E W; Ford, L E

1982-01-01

The passive mechanical properties of myocardium were defined by measuring force responses to rapid length ramps applied to unstimulated cat papillary muscles. The immediate force changes following these ramps recovered partially to their initial value, suggesting a series combination of viscous element and spring. Because the stretched muscle can bear force at rest, the viscous element must be in parallel with an additional spring. The instantaneous extension-force curves measured at different lengths were nonlinear, and could be made to superimpose by a simple horizontal shift. This finding suggests that the same spring was being measured at each length, and that this spring was in series with both the viscous element and its parallel spring (Voigt configuration), so that the parallel spring is held nearly rigid by the viscous element during rapid steps. The series spring in the passive muscle could account for most of the series elastic recoil in the active muscle, suggesting that the same spring is in series with both the contractile elements and the viscous element. It is postulated that the viscous element might be coupled to the contractile elements by a compliance, so that the load imposed on the contractile elements by the passive structures is viscoelastic rather than purely viscous. Such a viscoelastic load would give the muscle a length-independent, early diastolic restoring force. The possibility is discussed that the length-independent restoring force would allow some of the energy liberated during active shortening to be stored and released during relaxation. Images FIGURE 7 FIGURE 8 PMID:7171707

Crystallographic Texture and Elemental Composition Mapped in Bovine Root Dentin at the 200 nm Level

PubMed Central

Deymier-Black, A. C.; Veis, A.; Cai, Z.; Stock, S. R.

2015-01-01

Summary The relationship between the mineralization of peritubular dentin (PTD) and intertubular dentin (ITD) is not well understood. Tubules are quite small, diameter ~2 μm, and this makes the near-tubule region of dentin difficult to study. Here, advanced characterization techniques are applied in a novel way to examine what organic or nanostructural signatures may indicate the end of ITD or the beginning of PTD mineralization. X-ray fluorescence intensity (Ca, P, and Zn) and X-ray diffraction patterns from carbonated apatite (cAp) were mapped around dentintubules at resolutions ten times smaller than the feature size (200 nm pixels), representing a 36% increase in resolution over earlier work. In the near tubule volumes of near-pulp, root dentin, Zn intensity was higher than in ITD remote from the tubules. This increase in Zn2+, as determined by X-ray absorption near edge structure analysis, may indicate the presence of metalloenzymes or transcription factors important to ITD or PTD mineralization. The profiles of the cAp 00.2 X-ray diffraction rings were fitted with a pseudo-Voigt function, and the spatial and azimuthal distribution of these rings’ integrated intensities indicated that the cAp platelets were arranged with their c-axes aligned tangential to the edge of the tubule lumen. This texture was continuous throughout the dentin indicating a lack of structural difference between in the Zn rich near-tubular region and the remote ITD. PMID:23630059

Potent α-amylase inhibitory activity of Indian Ayurvedic medicinal plants.

PubMed

P, Sudha; Zinjarde, Smita S; Bhargava, Shobha Y; Kumar, Ameeta R

2011-01-20

Indian medicinal plants used in the Ayurvedic traditional system to treat diabetes are a valuable source of novel anti-diabetic agents. Pancreatic α-amylase inhibitors offer an effective strategy to lower the levels of post-prandial hyperglycemia via control of starch breakdown. In this study, seventeen Indian medicinal plants with known hypoglycemic properties were subjected to sequential solvent extraction and tested for α-amylase inhibition, in order to assess and evaluate their inhibitory potential on PPA (porcine pancreatic α-amylase). Preliminary phytochemical analysis of the lead extracts was performed in order to determine the probable constituents. Analysis of the 126 extracts, obtained from 17 plants (Aloe vera (L.) Burm.f., Adansonia digitata L., Allium sativum L., Casia fistula L., Catharanthus roseus (L.) G. Don., Cinnamomum verum Persl., Coccinia grandis (L.) Voigt., Linum usitatisumum L., Mangifera indica L., Morus alba L., Nerium oleander L., Ocimum tenuiflorum L., Piper nigrum L., Terminalia chebula Retz., Tinospora cordifolia (Willd.) Miers., Trigonella foenum-graceum L., Zingiber officinale Rosc.) for PPA inhibition was initially performed qualitatively by starch-iodine colour assay. The lead extracts were further quantified with respect to PPA inhibition using the chromogenic DNSA (3, 5-dinitrosalicylic acid) method. Phytochemical constituents of the extracts exhibiting≥ 50% inhibition were analysed qualitatively as well as by GC-MS (Gas chromatography-Mass spectrometry). Of the 126 extracts obtained from 17 plants, 17 extracts exhibited PPA inhibitory potential to varying degrees (10%-60.5%) while 4 extracts showed low inhibition (< 10%). However, strong porcine pancreatic amylase inhibitory activity (> 50%) was obtained with 3 isopropanol extracts. All these 3 extracts exhibited concentration dependent inhibition with IC50 values, viz., seeds of Linum usitatisumum (540 μgml-1), leaves of Morus alba (1440 μgml-1) and Ocimum tenuiflorum (8.9 μgml-1). Acarbose as the standard inhibitor exhibited an IC50 (half maximal inhibitory concentration)value of 10.2 μgml-1. Phytochemical analysis revealed the presence of alkaloids, tannins, cardiac glycosides, flavonoids, saponins and steroids with the major phytoconstituents being identified by GC-MS. This study endorses the use of these plants for further studies to determine their potential for type 2 diabetes management. Results suggests that extracts of Linum usitatisumum, Morus alba and Ocimum tenuiflorum act effectively as PPA inhibitors leading to a reduction in starch hydrolysis and hence eventually to lowered glucose levels.

Potent α-amylase inhibitory activity of Indian Ayurvedic medicinal plants

PubMed Central

2011-01-01

Background Indian medicinal plants used in the Ayurvedic traditional system to treat diabetes are a valuable source of novel anti-diabetic agents. Pancreatic α-amylase inhibitors offer an effective strategy to lower the levels of post-prandial hyperglycemia via control of starch breakdown. In this study, seventeen Indian medicinal plants with known hypoglycemic properties were subjected to sequential solvent extraction and tested for α-amylase inhibition, in order to assess and evaluate their inhibitory potential on PPA (porcine pancreatic α-amylase). Preliminary phytochemical analysis of the lead extracts was performed in order to determine the probable constituents. Methods Analysis of the 126 extracts, obtained from 17 plants (Aloe vera (L.) Burm.f., Adansonia digitata L., Allium sativum L., Casia fistula L., Catharanthus roseus (L.) G. Don., Cinnamomum verum Persl., Coccinia grandis (L.) Voigt., Linum usitatisumum L., Mangifera indica L., Morus alba L., Nerium oleander L., Ocimum tenuiflorum L., Piper nigrum L., Terminalia chebula Retz., Tinospora cordifolia (Willd.) Miers., Trigonella foenum-graceum L., Zingiber officinale Rosc.) for PPA inhibition was initially performed qualitatively by starch-iodine colour assay. The lead extracts were further quantified with respect to PPA inhibition using the chromogenic DNSA (3, 5-dinitrosalicylic acid) method. Phytochemical constituents of the extracts exhibiting≥ 50% inhibition were analysed qualitatively as well as by GC-MS (Gas chromatography-Mass spectrometry). Results Of the 126 extracts obtained from 17 plants, 17 extracts exhibited PPA inhibitory potential to varying degrees (10%-60.5%) while 4 extracts showed low inhibition (< 10%). However, strong porcine pancreatic amylase inhibitory activity (> 50%) was obtained with 3 isopropanol extracts. All these 3 extracts exhibited concentration dependent inhibition with IC50 values, viz., seeds of Linum usitatisumum (540 μgml-1), leaves of Morus alba (1440 μgml-1) and Ocimum tenuiflorum (8.9 μgml-1). Acarbose as the standard inhibitor exhibited an IC50 (half maximal inhibitory concentration)value of 10.2 μgml-1. Phytochemical analysis revealed the presence of alkaloids, tannins, cardiac glycosides, flavonoids, saponins and steroids with the major phytoconstituents being identified by GC-MS. Conclusions This study endorses the use of these plants for further studies to determine their potential for type 2 diabetes management. Results suggests that extracts of Linum usitatisumum, Morus alba and Ocimum tenuiflorum act effectively as PPA inhibitors leading to a reduction in starch hydrolysis and hence eventually to lowered glucose levels. PMID:21251279

Transformative Relation of Kinematical Descriptive Quantities Defined by Different Spatial Referential Frame, Its Property and Application

NASA Astrophysics Data System (ADS)

Luo, Ji

2012-08-01

Quantitative transformations between corresponding kinetic quantities defined by any two spatial referential frames, whose relative kinematics relations (purely rotational and translational movement) are known, are presented based on necessarily descriptive definitions of the fundamental concepts (instant, time, spatial referential frame that distinguishes from Maths. Coordination, physical point) had being clarified by directly empirical observation with artificially descriptive purpose. Inductive investigation of the transformation reveals that all physical quantities such as charge, temperature, time, volume, length, temporal rate of the quantities and relations like temporal relation between signal source and observer as such are independent to spatial frames transformation except above kinematical quantities transformations, kinematics related dynamics such as Newton ’ s second law existing only in inertial frames and exchange of kinetic energy of mass being valid only in a selected inertial frame. From above bas is, we demonstrate a series of inferences and applications such as phase velocity of light being direct respect to medium (including vacuum) rather than to the frame, using spatial referential frame to describe any measurable field (electric field, magnetic field, gravitational field) and the field ’ s variation; and have tables to contrast and evaluate all aspects of those hypotheses related with spacetime such as distorted spacetime around massive stellar, four dimension spacetime, gravitational time dilation and non - Euclid geometry with new one. The demonstration strongly suggests all the hypotheses are invalid in capable tested concepts ’ meaning and relations. The conventional work on frame transformation and its property, hypothesized by Voigt, Heaviside, Lorentz, Poincare and Einstein a century ago with some mathematical speculation lacking rigorous definition of the fundamental concepts such as instant, time, spatial reference, straight line, plane area, merely good in building up patchwork to do self p referred explanation by making up derivative concepts or accumulating new hypothesis, has disturbed people to describe the physical nature by setting up the sound basis of concept and relations with capable tested method, it’s time to be replaced by empirically effective alternative.

Measurements and modeling of 16O12C17O spectroscopic parameters at 2 μm

NASA Astrophysics Data System (ADS)

Jacquemart, David; Sung, Keeyoon; Coleman, Max; Crawford, Timothy; Brown, Linda R.; Mantz, Arlan W.; Smith, Mary Ann H.

2017-12-01

The lack of spectroscopic measurements for rare CO2 isotopologues was the main motivation of this work. In our present study we report line intensity measurements for 16O12C17O made with a high resolution Fourier transform spectrometer (Bruker IFS-125HR) and a 21 m path cryogenic Herriott cell at Jet Propulsion Laboratory. For this, a 17O-enriched CO2 gas sample was used, which comes as a mixture of primary and several minor CO2 isotopologues. The mole fraction of the 16O12C17O isotopologue in the mixture was determined to be 0.3991 by mass spectrometry from a Stable Isotope Ratio Mass Spectrometer (SIRMS) under stochastic distribution assumption at thermal equilibrium. Since the collisional narrowing effect was observed, the Rautian molecular line shape profile was systematically adopted instead of the Voigt profile. Absolute line positions were also investigated by performing a wavenumber calibration based on CO, HCl and a few well-known 16O12C16O transitions. Finally, around 1000 transitions were studied between 4604 and 5126 cm-1 involving 15 bands of the 16O12C17O isotopologue. All the measured line intensities were renormalized to be the values for 100% pure isotopologue sample. Transition dipole moments and Herman-Wallis factors were derived enabling a global comparison with theoretical calculations and predictions for the 15 bands of the 16O12C17O isotopologue. For the measured line positions, the absolute accuracy is around 2×10-4 cm-1. The accuracies of retrieved line intensities are 2 - 5% for five cold and two hot bands, and 6-30% for eight other weaker hot bands. Results from this work were in a good agreement with HITRAN 2012 for positions, but showed rather significant discrepancies for line intensities. An extensive line list was generated from new experimental measurements in order to improve and validate spectroscopic knowledge of 12C16O17O isotopologue in support of atmospheric remote sensing for the Earth (e.g., OCO-2 mission), Mars and Venus.

Geodynamic modelling of the rift-drift transition: Application to the Red Sea

NASA Astrophysics Data System (ADS)

Fierro, E.; Schettino, A.; Capitanio, F. A.; Ranalli, G.

2017-12-01

The onset of oceanic accretion after a rifting phase is generally accompanied by an initial fast pulse of spreading in the case of volcanic margins, such that the effective spreading rate exceeds the relative far-field velocity between the two plates for a short time interval. This pulse has been attributed to edge-driven convention (EDC), although our numerical modelling shows that the shear stress at the base of the lithosphere cannot exceed 1 MPa. In general, we have developed a 2D numerical model of the mantle instabilities during the rifting phase, in order to determine the geodynamic conditions at the rift-drift transition. The model was tested using Underworld II software, variable rheological parameters, and temperature and stress-dependent viscosity. Our results show an increase of strain rates at the top of the lithosphere with the lithosphere thickness as well as with the initial width of the margin up to 300 km. Beyond this value, the influence of the initial rift width can be neglected. An interesting outcome of the numerical model is the existence of an axial zone characterized by higher strain rates, which is flanked by two low-strain stripes. As a consequence, the model suggests the existence of an area of syn-rift compression within the rift valley. Regarding the post-rift phase, we propose that at the onset of a seafloor spreading, a phase of transient creep allows the release of the strain energy accumulated in the mantle lithosphere during the rifting phase, through anelastic relaxation. Then, the conjugated margins would be subject to post-rift contraction and eventually to tectonic inversion of the rift structures. To explore the tenability of this model, we introduce an anelastic component in the lithosphere rheology, assuming both the classical linear Kelvin-Voigt rheology and a non-linear Kelvin model. The non-linear model predicts viable relaxation times ( 1-2Myrs) to explain the post-rift tectonic inversion observed along the Arabian continental margin and the episodic initial fast seafloor spreading in the central Red Sea, where the role of EDC has been invoked.

Application of the Hartmann–Tran profile to precise experimental data sets of 12C 2H 2

DOE PAGES

Forthomme, D.; Cich, M. J.; Twagirayezu, S.; ...

2015-06-25

Self- and nitrogen-broadened line shape data for the P e(11) line of the ν₁ + ν₃ band of acetylene, recorded using a frequency comb-stabilized laser spectrometer, have been analyzed using the Hartmann–Tran profile (HTP) line shape model in a multispectrum fitting. In total, the data included measurements recorded at temperatures between 125 K and 296 K and at pressures between 4 and 760 Torr. New, sub-Doppler, frequency comb-referenced measurements of the positions of multiple underlying hot band lines have also been made. These underlying lines significantly affect the P e(11) line profile at temperatures above 240 K and poorly knownmore » frequencies previously introduced errors into the line shape analyses. Thus, the behavior of the HTP model was compared to the quadratic speed dependent Voigt profile (QSDVP) expressed in the frequency and time domains. A parameter uncertainty analysis was carried out using a Monte Carlo method based on the estimated pressure, transmittance and frequency measurement errors. From the analyses, the P e(11) line strength was estimated to be 1.2014(50) × 10 -20 in cm.molecules⁻¹ units at 296 K with the standard deviation in parenthesis. For analyzing these data, we found that a reduced form of the HTP, equivalent to the QSDVP, was most appropriate because the additional parameters included in the full HTP were not well determined. As a supplement to this work, expressions for analytic derivatives and a lineshape fitting code written in Matlab for the HTP are available.« less

Artificial intelligence applied to the automatic analysis of absorption spectra. Objective measurement of the fine structure constant

NASA Astrophysics Data System (ADS)

Bainbridge, Matthew B.; Webb, John K.

2017-06-01

A new and automated method is presented for the analysis of high-resolution absorption spectra. Three established numerical methods are unified into one `artificial intelligence' process: a genetic algorithm (Genetic Voigt Profile FIT, gvpfit); non-linear least-squares with parameter constraints (vpfit); and Bayesian model averaging (BMA). The method has broad application but here we apply it specifically to the problem of measuring the fine structure constant at high redshift. For this we need objectivity and reproducibility. gvpfit is also motivated by the importance of obtaining a large statistical sample of measurements of Δα/α. Interactive analyses are both time consuming and complex and automation makes obtaining a large sample feasible. In contrast to previous methodologies, we use BMA to derive results using a large set of models and show that this procedure is more robust than a human picking a single preferred model since BMA avoids the systematic uncertainties associated with model choice. Numerical simulations provide stringent tests of the whole process and we show using both real and simulated spectra that the unified automated fitting procedure out-performs a human interactive analysis. The method should be invaluable in the context of future instrumentation like ESPRESSO on the VLT and indeed future ELTs. We apply the method to the zabs = 1.8389 absorber towards the zem = 2.145 quasar J110325-264515. The derived constraint of Δα/α = 3.3 ± 2.9 × 10-6 is consistent with no variation and also consistent with the tentative spatial variation reported in Webb et al. and King et al.

Anisotropic Thermal Expansion of Zirconium Diboride: An Energy-Dispersive X-Ray Diffraction Study

DOE Office of Scientific and Technical Information (OSTI.GOV)

Paxton, William A.; Özdemir, Tevfik E.; Şavklıyıldız, İlyas

Zirconiumore » m diboride (ZrB 2) is an attractive material due to its thermal and electrical properties. In recent years, ZrB 2has been investigated as a superior replacement for sapphire when used as a substrate for gallium nitride devices. Like sapphire, ZrB 2has an anisotropic hexagonal structure which defines its directionally dependent properties. However, the anisotropic behavior of ZrB 2is not well understood. In this paper, we use energy-dispersive synchrotron X-ray diffraction to measure the thermal expansion of polycrystalline ZrB 2powder from 300 to 1150 K. Nine Bragg reflections are fit using Pseudo-Voigt peak profiles and used to compute the a and c lattice parameters using a nonlinear least-squares approximation. The temperature-dependent instantaneous thermal expansion coefficients are determined for each a -axis and c -axis direction and are described by the following equations: α a = ( 4.1507 × 10 - 6 + 5.1086 × 10 - 9 ( T - 293.15 ) )/( 1 + 4.1507 × 10 - 6 ( T - 293.15 ) + 2.5543 × 10 - 9 ( T - 293.15 ) 2 ) and α c = ( 4.5374 × 10 - 6 + 4.3004 × 10 - 9 ( T - 293.15 ) )/( 1 + 4.5374 × 10 - 6 ( T - 293.15 ) + 2.1502 × 10 - 9 ( T - 293.15 ) 2 ). Our results are within range of previously reported values but describe the temperature anisotropy in more detail. We show that anisotropic expansion coefficients converge to the same value at about 780 K and diverge at higher temperatures. Results are compared with other reported values.« less

Application of the Hartmann-Tran profile to precise experimental data sets of 12C2H2

NASA Astrophysics Data System (ADS)

Forthomme, D.; Cich, M. J.; Twagirayezu, S.; Hall, G. E.; Sears, T. J.

2015-11-01

Self- and nitrogen-broadened line shape data for the Pe(11) line of the ν1 +ν3 band of acetylene, recorded using a frequency comb-stabilized laser spectrometer, have been analyzed using the Hartmann-Tran profile (HTP) line shape model in a multispectrum fitting. In total, the data included measurements recorded at temperatures between 125 K and 296 K and at pressures between 4 and 760 Torr. New, sub-Doppler, frequency comb-referenced measurements of the positions of multiple underlying hot band lines have also been made. These underlying lines significantly affect the Pe(11) line profile at temperatures above 240 K and poorly known frequencies previously introduced errors into the line shape analyses. The behavior of the HTP model was compared to the quadratic speed dependent Voigt profile (QSDVP) expressed in the frequency and time domains. A parameter uncertainty analysis was carried out using a Monte Carlo method based on the estimated pressure, transmittance and frequency measurement errors. From the analyses, the Pe(11) line strength was estimated to be 1.2014(50) ×10-20 in cmmolecule-1 units at 296 K with the standard deviation in parenthesis. For analyzing these data, we found that a reduced form of the HTP, equivalent to the QSDVP, was most appropriate because the additional parameters included in the full HTP were not well determined. As a supplement to this work, expressions for analytic derivatives and a lineshape fitting code written in Matlab for the HTP are available.

Highly Ionized Fe-K Absorption Line from Cygnus X-1 in the High/Soft State Observed with Suzaku

NASA Astrophysics Data System (ADS)

Yamada, S.; Torii, S.; Mineshige, S.; Ueda, Y.; Kubota, A.; Gandhi, P.; Done, C.; Noda, H.; Yoshikawa, A.; Makishima, K.

2013-04-01

We present observations of a transient He-like Fe Kα absorption line in Suzaku observations of the black hole binary Cygnus X-1 on 2011 October 5 near superior conjunction during the high/soft state, which enable us to map the full evolution from the start to the end of the episodic accretion phenomena or dips for the first time. We model the X-ray spectra during the event and trace their evolution. The absorption line is rather weak in the first half of the observation, but instantly deepens for ~10 ks, and weakens thereafter. The overall change in equivalent width is a factor of ~3, peaking at an orbital phase of ~0.08. This is evidence that the companion stellar wind feeding the black hole is clumpy. By analyzing the line with a Voigt profile, it is found to be consistent with a slightly redshifted Fe XXV transition, or possibly a mixture of several species less ionized than Fe XXV. The data may be explained by a clump located at a distance of ~1010-12 cm with a density of ~10(- 13)-(- 11) g cm-3, which accretes onto and/or transits the line of sight to the black hole, causing an instant decrease in the observed degree of ionization and/or an increase in density of the accreting matter. Continued monitoring for individual events with future X-ray calorimeter missions such as ASTRO-H and AXSIO will allow us to map out the accretion environment in detail and how it changes between the various accretion states.

[Measurement of atomic number of alkali vapor and pressure of buffer gas based on atomic absorption].

PubMed

Zheng, Hui-jie; Quan, Wei; Liu, Xiang; Chen, Yao; Lu, Ji-xi

2015-02-01

High sensitivitymagnetic measurementscanbe achieved by utilizing atomic spinmanipulation in the spin-exchange-relaxation-free (SERF) regime, which uses an alkali cell as a sensing element. The atomic number density of the alkali vapor and the pressure of the buffer gasare among the most important parameters of the cell andrequire accurate measurement. A method has been proposed and developedto measure the atomic number density and the pressure based on absorption spectroscopy, by sweeping the absorption line and fittingthe experiment data with a Lorentzian profile to obtainboth parameters. Due to Doppler broadening and pressure broadening, which is mainly dominated by the temperature of the cell and the pressure of buffer gas respectively, this work demonstrates a simulation of the errorbetween the peaks of the Lorentzian profile and the Voigt profile caused by bothfactors. The results indicates that the Doppler broadening contribution is insignificant with an error less than 0.015% at 313-513 K for a 4He density of 2 amg, and an error of 0.1% in the presence of 0.6-5 amg at 393 K. We conclude that the Doppler broadening could be ignored under above conditions, and that the Lorentzianprofile is suitably applied to fit the absorption spectrumobtainingboth parameters simultaneously. In addition we discuss the resolution and the instability due to thelight source, wavelength and the temperature of the cell. We find that the cell temperature, whose uncertainty is two orders of magnitude larger than the instability of the light source and the wavelength, is one of the main factors which contributes to the error.

On the dynamics of viscous masonry beams

NASA Astrophysics Data System (ADS)

Lucchesi, M.; Pintucchi, B.; Šilhavý, M.; Zani, N.

2015-05-01

In this paper, we consider the longitudinal and transversal vibrations of the masonry beams and arches. The basic motivation is the seismic vulnerability analysis of masonry structures that can be modeled as monodimensional elements. The Euler-Bernoulli hypothesis is employed for the system of forces in the beam. The axial force and the bending moment are assumed to consist of the elastic and viscous parts. The elastic part is described by the no-tension material, i.e., the material with no resistance to tension and which accounts for the cases of limitless, as well as bounded compressive strength. The adaptation of this material to beams has been developed in Orlandi (Analisi non lineare di strutture ad arco in muratura. Thesis, 1999) and Zani (Eur J Mech A/Solids 23:467-484, 2004). The viscous part amounts to the Kelvin-Voigt damping depending linearly on the time derivatives of the linearized strain and curvature. The dynamical equations are formulated, and a mathematical analysis of them is presented. Specifically, following Gajewski et al. (Nichtlineare Operatorgleichungen und Operatordifferentialgleichungen. Akademie-Verlag, Berlin, 1974), the theorems of existence, uniqueness and regularity of the solution of the dynamical equations are recapitulated and specialized for our purposes, to support the numerical analysis applied previously in Lucchesi and Pintucchi (Eur J Mech A/Solids 26:88-105, 2007 ). As usual, for that the Galerkin method has been used. As an illustration, two numerical examples (slender masonry tower and masonry arch) are presented in this paper with the applied forces corresponding to the acceleration in the earthquake in Emilia Romagna in May 29, 2012.

Using Nice-Ohvms Lineshapes to Study Relaxation Rates and Transition Dipole Moments

NASA Astrophysics Data System (ADS)

Hodges, James N.; McCall, Benjamin J.

2016-06-01

Noise Immune Cavity Enhanced Optical Heterodyne Velocity Modulation Spectroscopy (NICE-OHVMS) is a successful technique that we have developed to sensitively, precisely, and accurately record transitions of molecular ions. It has been used exclusively as a method for precise transition frequency measurement via saturation and fitting of the resultant Lamb dips. NICE-OHVMS has been employed to improve the uncertainties on H_3^+, CH_5^+, HeH^+, and OH^+, reducing the transition frequency uncertainties by two orders of magnitude. Because NICE-OHVMS is a saturation technique, this provides a unique opportunity to access information about the ratio of the transition dipole moment to the relaxation rate of the transition. This can be done in two ways, either through comparison of Lamb dip depth to the transition profile or comparison of the absorption intensity and dispersion intensity. Due to the complexity of the modulation scheme, there are many parameters that affect the apparent intensity of the recorded lineshape. A complete understanding of the lineshape is required to make the measurements of interest. Here we present a model that accounts for the heterodyne modulation and velocity modulation, assuming that the fundamental lineshape is represented by a Voigt profile. Fits to data are made and interpreted in order to extract the saturation parameter. K.N. Crabtree et al., Chem. Phys. Lett. 551, 1 (2012). J.N. Hodges et al., J. Chem. Phys. 139, 164201 (2013). A.J. Perry et al., J. Mol. Spectrosc. 317, 71 (2015). A.J. Perry et al., J. Chem. Phys. 141, 101101 (2014). C.R. Marcus et al., Astrophys. J. 817, 138 (2016).

In vivo time-harmonic multifrequency elastography of the human liver

NASA Astrophysics Data System (ADS)

Tzschätzsch, Heiko; Ipek-Ugay, Selcan; Guo, Jing; Streitberger, Kaspar-Josche; Gentz, Enno; Fischer, Thomas; Klaua, Robert; Schultz, Michael; Braun, Jürgen; Sack, Ingolf

2014-04-01

Elastography is capable of noninvasively detecting hepatic fibrosis by imposing mechanical stress and measuring the viscoelastic response in the liver. Magnetic resonance elastography (MRE) relies on time-harmonic vibrations, while most dynamic ultrasound elastography methods employ transient stimulation methods. This study attempts to benefit from the advantages of time-harmonic tissue stimulation, i.e. relative insensitivity to obesity and ascites and mechanical approachability of the entire liver, and the advantages of ultrasound, i.e. time efficiency, low costs, and wide availability, by introducing in vivo time-harmonic elastography (THE) of the human liver using ultrasound and a broad range of harmonic stimulation frequencies. THE employs continuous harmonic shear vibrations at 7 frequencies from 30 to 60 Hz in a single examination and determines the elasticity and the viscosity of the liver from the dispersion of the shear wave speed within the applied frequency range. The feasibility of the method is demonstrated in the livers of eight healthy volunteers and a patient with cirrhosis. Multifrequency MRE at the same drive frequencies was used as elastographic reference method. Similar values of shear modulus and shear viscosity according the Kelvin-Voigt model were obtained by MRE and THE, indicating that the new method is suitable for in vivo quantification of the shear viscoelastic properties of the liver, however, in real-time and at a fraction of the costs of MRE. In conclusion, THE may provide a useful tool for fast assessment of the viscoelastic properties of the liver at low costs and without limitations in obesity, ascites or hemochromatosis.

Calculations of single crystal elastic constants for yttria partially stabilised zirconia from powder diffraction data

NASA Astrophysics Data System (ADS)

Lunt, A. J. G.; Xie, M. Y.; Baimpas, N.; Zhang, S. Y.; Kabra, S.; Kelleher, J.; Neo, T. K.; Korsunsky, A. M.

2014-08-01

Yttria Stabilised Zirconia (YSZ) is a tough, phase-transforming ceramic that finds use in a wide range of commercial applications from dental prostheses to thermal barrier coatings. Micromechanical modelling of phase transformation can deliver reliable predictions in terms of the influence of temperature and stress. However, models must rely on the accurate knowledge of single crystal elastic stiffness constants. Some techniques for elastic stiffness determination are well-established. The most popular of these involve exploiting frequency shifts and phase velocities of acoustic waves. However, the application of these techniques to YSZ can be problematic due to the micro-twinning observed in larger crystals. Here, we propose an alternative approach based on selective elastic strain sampling (e.g., by diffraction) of grain ensembles sharing certain orientation, and the prediction of the same quantities by polycrystalline modelling, for example, the Reuss or Voigt average. The inverse problem arises consisting of adjusting the single crystal stiffness matrix to match the polycrystal predictions to observations. In the present model-matching study, we sought to determine the single crystal stiffness matrix of tetragonal YSZ using the results of time-of-flight neutron diffraction obtained from an in situ compression experiment and Finite Element modelling of the deformation of polycrystalline tetragonal YSZ. The best match between the model predictions and observations was obtained for the optimized stiffness values of C11 = 451, C33 = 302, C44 = 39, C66 = 82, C12 = 240, and C13 = 50 (units: GPa). Considering the significant amount of scatter in the published literature data, our result appears reasonably consistent.

Metallicity Evolution of Damped Lyα Systems Out to z ~ 5

NASA Astrophysics Data System (ADS)

Rafelski, Marc; Wolfe, Arthur M.; Prochaska, J. Xavier; Neeleman, Marcel; Mendez, Alexander J.

2012-08-01

We present chemical abundance measurements for 47 damped Lyα (DLA) systems, 30 at z > 4, observed with the Echellette Spectrograph and Imager and the High Resolution Echelle Spectrometer on the Keck telescopes. H I column densities of the DLAs are measured with Voigt profile fits to the Lyα profiles, and we find an increased number of false DLA identifications with Sloan Digital Sky Survey at z > 4 due to the increased density of the Lyα forest. Ionic column densities are determined using the apparent optical depth method, and we combine our new metallicity measurements with 195 from previous surveys to determine the evolution of the cosmic metallicity of neutral gas. We find the metallicity of DLAs decreases with increasing redshift, improving the significance of the trend and extending it to higher redshifts, with a linear fit of -0.22 ± 0.03 dex per unit redshift from z = 0.09-5.06. The metallicity "floor" of ≈1/600 solar continues out to z ~ 5, despite our sensitivity for finding DLAs with much lower metallicities. However, this floor is not statistically different from a steep tail to the distribution. We also find that the intrinsic scatter of metallicity among DLAs of ~0.5 dex continues out to z ~ 5. In addition, the metallicity distribution and the α/Fe ratios of z > 2 DLAs are consistent with being drawn from the same parent population with those of halo stars. It is therefore possible that the halo stars in the Milky Way formed out of gas that commonly exhibits DLA absorption at z > 2.

The puzzling spectrum of HD 94509. Sounding out the extremes of Be shell star spectral morphology

NASA Astrophysics Data System (ADS)

Cowley, C. R.; Przybilla, N.; Hubrig, S.

2015-06-01

Context. The spectral features of HD 94509 are highly unusual, adding an extreme to the zoo of Be and shell stars. The shell dominates the spectrum, showing lines typical for spectral types mid-A to early-F, while the presence of a late/mid B-type central star is indicated by photospheric hydrogen line wings and helium lines. Numerous metallic absorption lines have broad wings but taper to narrow cores. They cannot be fit by Voigt profiles. Aims: We describe and illustrate unusual spectral features of this star, and make rough calculations to estimate physical conditions and abundances in the shell. Furthermore, the central star is characterized. Methods: We assume mean conditions for the shell. An electron density estimate is made from the Inglis-Teller formula. Excitation temperatures and column densities for Fe i and Fe ii are derived from curves of growth. The neutral H column density is estimated from high Paschen members. The column densities are compared with calculations made with the photoionization code Cloudy. Atmospheric parameters of the central star are constrained employing non-LTE spectrum synthesis. Results: Overall chemical abundances are close to solar. Column densities of the dominant ions of several elements, as well as excitation temperatures and the mean electron density are well accounted for by a simple model. Several features, including the degree of ionization, are less well described. Conclusions: HD 94509 is a Be star with a stable shell, close to the terminal-age main sequence. The dynamical state of the shell and the unusually shaped, but symmetric line profiles, require a separate study.

Hydrogen Balmer Line Broadening in Solar and Stellar Flares

NASA Astrophysics Data System (ADS)

Kowalski, Adam F.; Allred, Joel C.; Uitenbroek, Han; Tremblay, Pier-Emmanuel; Brown, Stephen; Carlsson, Mats; Osten, Rachel A.; Wisniewski, John P.; Hawley, Suzanne L.

2017-03-01

The broadening of the hydrogen lines during flares is thought to result from increased charge (electron, proton) density in the flare chromosphere. However, disagreements between theory and modeling prescriptions have precluded an accurate diagnostic of the degree of ionization and compression resulting from flare heating in the chromosphere. To resolve this issue, we have incorporated the unified theory of electric pressure broadening of the hydrogen lines into the non-LTE radiative-transfer code RH. This broadening prescription produces a much more realistic spectrum of the quiescent, A0 star Vega compared to the analytic approximations used as a damping parameter in the Voigt profiles. We test recent radiative-hydrodynamic (RHD) simulations of the atmospheric response to high nonthermal electron beam fluxes with the new broadening prescription and find that the Balmer lines are overbroadened at the densest times in the simulations. Adding many simultaneously heated and cooling model loops as a “multithread” model improves the agreement with the observations. We revisit the three-component phenomenological flare model of the YZ CMi Megaflare using recent and new RHD models. The evolution of the broadening, line flux ratios, and continuum flux ratios are well-reproduced by a multithread model with high-flux nonthermal electron beam heating, an extended decay phase model, and a “hot spot” atmosphere heated by an ultrarelativistic electron beam with reasonable filling factors: ˜0.1%, 1%, and 0.1% of the visible stellar hemisphere, respectively. The new modeling motivates future work to understand the origin of the extended gradual phase emission.

Noise, fluctuation, and HADAMARD-transform spectrometry

NASA Astrophysics Data System (ADS)

Nitzsche, Guenter; Riesenberg, Rainer

2003-05-01

The HADAMARD principle is known in optics as a multiplex technique. It describes the mode with the most advantageous increase of the signal-to-noise ratio (SNR) in terms of scanning (Fellget advantage). The maximum increase of SNR, we call it gain, is (n+1)/(2On), where n is the number of multiplexing. It is valid in the case of pure detector noise. The multiplex encoding Hadamard pattern in case of n = 7 is 1110100, whereby 1 stands for a switched on channel performed by a field selector. The signals of all (switched on) channels are detected by a single detector. n measurement steps with a cyclic change of the pattern is necessary to perform the Hadamard transformation and to get the result of each individual channel. In case of n = 7 the theoretical gain is 1.51. For all possible multiplex pattern (1100000, 1110000 and so on) the gain is theoretically investigated. A multiplexing advantage (gain > 1) is reached only by the Hadamard pattern, the inverse Hadamard pattern and for (0111111)-pattern (gain=1.08). Most of the multiplex pattern are disadvantageous. The reason for maximum gain of the HADAMARD transformation is analysed theoretically. Signal fluctuations during the measurement caused by fluctuations of the illumination or by the object under test, reduce the multiplex gain, too. So the limits for realizing a gain are estimated theoretically. Essential is the transformation procedure and its influence on the error propagation. The results could be verified by experiments with array spectrometeres. Requirements are derived by numerical simulation concerning the stability of the signals to be multiplexed. It is simulated the needed stability of the signals with increasing order of multiplexing. So the increase of the multiplex gain is limited by signal fluctuations. A realized 96 channel spectral reader is presented as a modern application of an optical multiplexing arrangement. ! M. Harvid, N. J. A. Sloane, Hadamard Transform Optics, Academic Press, 1979 ! R.A. De Verse, R.M. Hammaker, W. G. Fately, J.A.Graham, J.D.Tate, "Spectrometry and imaging using a digital micromirror array" American Laboratory, Vol. 30, 21, pp. 112-120, 1998 ! R. Riesenberg, A. Wuttig, B. Harnisch, "Optical MEMS Technology for Multiplexing in High-End Micro-Scpectrometers", Proc. SPIE 4928, 6-14, 2002 ! A. Wuttig, R. Riesenberg, "Hyperspectral imager with a facile MEMS", Proc. SPIE 4881A, 2002, to be published ! R. Riesenberg, G. Nitzsche, W. Voigt, 'HADAMARD Encoding and other optical Multiplexing', VDI-Berichte 1694, pp. 345-350, 2002 ! A. Wuttig, R. Riesenberg, G. Nitzsche, "Subpixel Analysis of Double Array Grating Spectrometer", Proc. SPIE 4480, pp. 334-344, 2002 ! A. Wuttig, R. Riesenberg, G. Nitzsche, "Integral Field and Multi Object Spectrometry with MEMS", Proc. SPIE 4480, pp. 367-376, 2002 ! R. Riesenberg, G. Nitzsche, A. Wuttig, B. Harnisch, "Micro Spectrometer and MEMS for Space" in "Smaller Satellites: Bigger Business?", edited by M. Rycroft, N. Crosby, Kluwer Academic Publisher, pp. 403-406, 2002 ! R. Riesenberg, A. Wuttig, "Optical sensors with MEMS, slit masks and micromechanical devices", Proc. SPIE 4561, pp. 315-322, 2001 ! R. Riesenberg, "MicroMechanical Slit Positioning System as a transmissive spatial Light Modulator", Proc. SPIE 4457, pp.197-203, 2001 ! R. Riesenberg, J. Lonschinski, "HADAMARD-Minispectrometer made by a Micro Device", Proc. "3rd Round Table on Micro/NanoTechnologies for Space", ESTEC, Noordwijk, The Netherlands, pp. 291 - 297, 2000 ! R. Riesenberg, U. Dillner, "HADAMARD Imaging Spectrometers", Proc. SPIE 3753, pp. 203-213, 1999 ! R. Riesenberg, Th. Seifert, "Design of spatial Light Modulator Microdevices - Micro Slit Arrays", Proc. SPIE 3680, Part One, pp. 406-414, 1999 ! R. Riesenberg, W. Voigt, J. Schoneich, "Compact Spectrometers made by Micro System Technology", Sensor 97, Proc. Vol. 2, pp. 145-150,1997

COS-Weak: probing the CGM using analogues of weak Mg II absorbers at z < 0.3

NASA Astrophysics Data System (ADS)

Muzahid, S.; Fonseca, G.; Roberts, A.; Rosenwasser, B.; Richter, P.; Narayanan, A.; Churchill, C.; Charlton, J.

2018-06-01

We present a sample of 34 weak metal line absorbers at z < 0.3 selected by the simultaneous >3σ detections of the Si IIλ1260 and C IIλ1334 absorption lines, with Wr(Si II)<0.2 Å and Wr(C II)<0.3 Å, in archival HST/COS spectra. Our sample increases the number of known low-z `weak absorbers' by a factor of >5. The column densities of H I and low-ionization metal lines obtained from Voigt profile fitting are used to build simple photoionization models. The inferred densities and line-of-sight thicknesses of the absorbers are in the ranges of -3.3 < log nH/cm-3 < -2.4 and ˜1 pc-50 kpc (median ≈500 pc), respectively. Most importantly, 85 per cent (50 per cent) of these absorbers show a metallicity of [Si/H] > -1.0 (0.0). The fraction of systems showing near-/supersolar metallicity in our sample is significantly higher than in the H I-selected sample of Wotta et al., and the galaxy-selected sample of Prochaska et al., of absorbers probing the circum-galactic medium at similar redshift. A search for galaxies has revealed a significant galaxy-overdensity around these weak absorbers compared to random positions with a median impact parameter of 166 kpc from the nearest galaxy. Moreover, we find the presence of multiple galaxies in ≈80 per cent of the cases, suggesting group environments. The observed dN/dz of 0.8 ± 0.2 indicates that such metal-enriched, compact, dense structures are ubiquitous in the haloes of low-z group galaxies. We suggest that these are transient structures that are related to galactic outflows and/or stripping of metal-rich gas from galaxies.

On the relevance of modeling viscoelastic bending behavior in finite element forming simulation of continuously fiber reinforced thermoplastics

NASA Astrophysics Data System (ADS)

Dörr, Dominik; Schirmaier, Fabian J.; Henning, Frank; Kärger, Luise

2017-10-01

Finite Element (FE) forming simulation offers the possibility of a detailed analysis of the deformation behavior of multilayered thermoplastic blanks during forming, considering material behavior and process conditions. Rate-dependent bending behavior is a material characteristic, which is so far not considered in FE forming simulation of pre-impregnated, continuously fiber reinforced polymers (CFRPs). Therefore, an approach for modeling viscoelastic bending behavior in FE composite forming simulation is presented in this work. The presented approach accounts for the distinct rate-dependent bending behavior of e.g. thermoplastic CFRPs at process conditions. The approach is based on a Voigt-Kelvin (VK) and a generalized Maxwell (GM) approach, implemented within a FE forming simulation framework implemented in several user-subroutines of the commercially available FE solver Abaqus. The VK, GM, as well as purely elastic bending modeling approaches are parameterized according to dynamic bending characterization results for a PA6-CF UD-tape. It is found that only the GM approach is capable to represent the bending deformation characteristic for all of the considered bending deformation rates. The parameterized bending modeling approaches are applied to a hemisphere test and to a generic geometry. A comparison of the forming simulation results of the generic geometry to experimental tests show a good agreement between simulation and experiments. Furthermore, the simulation results reveal that especially a correct modeling of the initial bending stiffness is relevant for the prediction of wrinkling behavior, as a similar onset of wrinkles is observed for the GM, the VK and an elastic approach, fitted to the stiffness observed in the dynamic rheometer test for low curvatures. Hence, characterization and modeling of rate-dependent bending behavior is crucial for FE forming simulation of thermoplastic CFRPs.

Signal-to-noise enhancement techniques for quantum cascade absorption spectrometers employing optimal filtering and other approaches

NASA Astrophysics Data System (ADS)

Disselkamp, R. S.; Kelly, J. F.; Sams, R. L.; Anderson, G. A.

Optical feedback to the laser source in tunable diode laser spectroscopy (TDLS) is known to create intensity modulation noise due to elatoning and optical feedback (i.e. multiplicative technical noise) that usually limits spectral signal-to-noise (S/N). The large technical noise often limits absorption spectroscopy to noise floors 100-fold greater than the Poisson shot noise limit due to fluctuations in the laser intensity. The high output powers generated from quantum cascade (QC) lasers, along with their high gain, makes these injection laser systems especially susceptible to technical noise. In this article we discuss a method of using optimal filtering to reduce technical noise. We have observed S/N enhancements ranging from 20% to a factor of 50. The degree to which optimal filtering enhances S/N depends on the similarity between the Fourier components of the technical noise and those of the signal, with lower S/N enhancements observed for more similar Fourier decompositions of the signal and technical noise. We also examine the linearity of optimal filtered spectra in both time and intensity. This was accomplished by creating a synthetic spectrum for the species being studied (CH4, N2O, CO2 and H2O in ambient air) utilizing line positions and linewidths with an assumed Voigt profile from a commercial database (HITRAN). Agreement better than 0.036% in wavenumber and 1.64% in intensity (up to a 260-fold intensity ratio employed) was observed. Our results suggest that rapid ex post facto digital optimal filtering can be used to enhance S/N for routine trace gas detection.

Pulse wave propagation in a model human arterial network: Assessment of 1-D visco-elastic simulations against in vitro measurements.

PubMed

Alastruey, Jordi; Khir, Ashraf W; Matthys, Koen S; Segers, Patrick; Sherwin, Spencer J; Verdonck, Pascal R; Parker, Kim H; Peiró, Joaquim

2011-08-11

The accuracy of the nonlinear one-dimensional (1-D) equations of pressure and flow wave propagation in Voigt-type visco-elastic arteries was tested against measurements in a well-defined experimental 1:1 replica of the 37 largest conduit arteries in the human systemic circulation. The parameters required by the numerical algorithm were directly measured in the in vitro setup and no data fitting was involved. The inclusion of wall visco-elasticity in the numerical model reduced the underdamped high-frequency oscillations obtained using a purely elastic tube law, especially in peripheral vessels, which was previously reported in this paper [Matthys et al., 2007. Pulse wave propagation in a model human arterial network: Assessment of 1-D numerical simulations against in vitro measurements. J. Biomech. 40, 3476-3486]. In comparison to the purely elastic model, visco-elasticity significantly reduced the average relative root-mean-square errors between numerical and experimental waveforms over the 70 locations measured in the in vitro model: from 3.0% to 2.5% (p<0.012) for pressure and from 15.7% to 10.8% (p<0.002) for the flow rate. In the frequency domain, average relative errors between numerical and experimental amplitudes from the 5th to the 20th harmonic decreased from 0.7% to 0.5% (p<0.107) for pressure and from 7.0% to 3.3% (p<10(-6)) for the flow rate. These results provide additional support for the use of 1-D reduced modelling to accurately simulate clinically relevant problems at a reasonable computational cost. Copyright © 2011 Elsevier Ltd. All rights reserved.

MODTRAN3: Suitability as a flux-divergence code

DOE Office of Scientific and Technical Information (OSTI.GOV)

Anderson, G.P.; Chetwynd, J.H.; Wang, J.

1995-04-01

The Moderate Resolution Atmospheric Radiance and Transmittance Model (MODTRAN3) is the developmental version of MODTRAN and MODTRAN2. The Geophysics Directorate, Phillips Laboratory, released a beta version of this model in October 1994. It encompasses all the capabilities of LOWTRAN7, the historic 20 cm{sup -1} resolution (full width at half maximum, FWHM) radiance code, but incorporates a much more sensitive molecular band model with 2 cm{sup -1} resolution. The band model is based directly upon the HITRAN spectral parameters, including both temperature and pressure (line shape) dependencies. Validation against full Voigt line-by-line calculations (e.g., FASCODE) has shown excellent agreement. In addition,more » simple timing runs demonstrate potential improvement of more than a factor of 100 for a typical 500 cm{sup -1} spectral interval and comparable vertical layering. Not only is MODTRAN an excellent band model for {open_quotes}full path{close_quotes} calculations (that is, radiance and/or transmittance from point A to point B), but it replicates layer-specific quantities to a very high degree of accuracy. Such layer quantities, derived from ratios and differences of longer path MODTRAN calculations from point A to adjacent layer boundaries, can be used to provide inversion algorithm weighting functions or similarly formulated quantities. One of the most exciting new applications is the rapid calculation of reliable IR cooling rates, including species, altitude, and spectral distinctions, as well as the standard spectrally integrated quantities. Comparisons with prior line-by-line cooling rate calculations are excellent, and the techniques can be extended to incorporate global climatologies of both standard and trace atmospheric species.« less

Estimation of Viscoelastic Properties of Cells Using Acoustic Tweezing Cytometry.

PubMed

Yang, Chunmei; Chen, Di; Hong, Xiaowei

2016-12-01

Recently developed acoustic tweezing cytometry uses ultrasound-responsive targeted microbubbles for biomechanical stimulation of live cells at the subcellular level. The purpose of this research was to estimate the viscoelastic characteristics of cells from the displacements of cell-bound microbubbles in response to ultrasound pulses on acoustic tweezing cytometry. Microbubbles were bound to NIH/3T3 fibroblasts and ATDC5 cells through an integrin-cytoskeleton linkage. The evolution of microbubble behaviors under irradiation by ultrasound pulses was captured by a high-speed camera and tracked by a customized algorithm. The total damping constant, stiffness, and rigidity of the cells were estimated by fitting the measured temporal displacement profiles to a Kelvin-Voigt-based model. The mean maximum displacement of the microbubbles attached to NIH/3T3 fibroblasts was much greater than that for ATDC5 cells. The mean fitted damping constant and stiffness ± SD for ATDC5 cells were 28.16 ± 7.08 mg/s and 0.5041 ± 0.1381 mN/m, respectively, and the values for NIH/3T3 fibroblasts were 13.12 ± 4.23 mg/s and 0.2591 ± 0.0715 mN/m. The rigidity for ATDC5 cells was 331.46 ± 106.50 MPa, whereas that for NIH/3T3 fibroblasts was 117.92 ± 34.83 MPa. The Arg-Gly-Asp-integrin-cytoskeleton system of NIH/3T3 fibroblasts appears to be softer than that of ATDC5 cells. The rigidity of ATDC5 cells was significantly greater than that of NIH/3T3 fibroblasts at the 95% confidence level. This strategy provides a novel way to determine the viscoelastic properties of the live cells. © 2016 by the American Institute of Ultrasound in Medicine.

Quantification of hardness, elasticity and viscosity of the skin of patients with systemic sclerosis using a novel sensing device (Vesmeter): a proposal for a new outcome measurement procedure.

PubMed

Kuwahara, Y; Shima, Y; Shirayama, D; Kawai, M; Hagihara, K; Hirano, T; Arimitsu, J; Ogata, A; Tanaka, T; Kawase, I

2008-07-01

No objective method to measure skin involvement in SSc has been established. We developed a novel method using a computer-linked device to simultaneously quantify physical properties of the skin such as hardness, elasticity and viscosity. Skin hardness was calculated by measuring the depth of an indenter pressed onto the skin. The Voigt model was used to calculate skin elasticity, viscosity, visco-elastic ratio and relaxation time by analysing the waveform of skin surface behaviour. The results were compared with the modified Rodnan skin score (mRSS) obtained at 17 sites on the bodies of 20 SSc patients and 20 healthy controls. A functional assessment questionnaire was administered to determine how skin hardness represents a patient's disability. We also examined intra- and inter-observer variability to determine the reliability of this method. The crude hardness obtained with this device correlated well with the standard hardness specified by the American Society for Testing and Materials (ASTM, r = 0.957). A close relationship between hardness and total mRSS was also observed (r = 0.832). Skin elasticity correlated positively, and relaxation time negatively with mRSS. Functional disability correlated more closely with skin hardness (r = 0.643) than with mRSS (r = 0.517). Intra- and inter-observer variabilities were 7.63 and 19.76%, respectively, which were lower than those reported for mRSS. Increases in hardness and elasticity as well as shortening of relaxation time constitute objective characteristics of skin involvement in SSc. The system devised by us proved to be able to assess skin abnormalities of SSc with high reliability.

An Ultrasound Surface Wave Technique for Assessing Skin and Lung Diseases.

PubMed

Zhang, Xiaoming; Zhou, Boran; Kalra, Sanjay; Bartholmai, Brian; Greenleaf, James; Osborn, Thomas

2018-02-01

Systemic sclerosis (SSc) is a multi-organ connective tissue disease characterized by immune dysregulation and organ fibrosis. Severe organ involvement, especially of the skin and lung, is the cause of morbidity and mortality in SSc. Interstitial lung disease (ILD) includes multiple lung disorders in which the lung tissue is fibrotic and stiffened. The purpose of this study was to translate ultrasound surface wave elastography (USWE) for assessing patients with SSc and/or ILD via measuring surface wave speeds of both skin and superficial lung tissue. Forty-one patients with both SSc and ILD and 30 healthy patients were enrolled in this study. An external harmonic vibration was used to generate the wave propagation on the skin or lung. Three excitation frequencies of 100, 150 and 200 Hz were used. An ultrasound probe was used to measure the wave propagation in the tissue non-invasively. Surface wave speeds were measured on the forearm and upper arm of both left and right arm, as well as the upper and lower lungs, through six intercostal spaces of patients and healthy patients. Viscoelasticity of the skin was calculated by the wave speed dispersion with frequency using the Voigt model. The magnitudes of surface wave speed and viscoelasticity of patients' skin were significantly higher than those of healthy patients (p <0.0001) for each location and each frequency. The surface wave speeds of patients' lung were significantly higher than those of healthy patients (p <0.0001) for each location and each frequency. USWE is a non-invasive and non-ionizing technique for measuring both skin and lung surface wave speed and may be useful for quantitative assessment of SSc and/or ILD. Copyright © 2018 World Federation for Ultrasound in Medicine and Biology. Published by Elsevier Inc. All rights reserved.

Characterization of macromolecular baseline of human brain using metabolite cycled semi-LASER at 9.4T.

PubMed

Giapitzakis, Ioannis-Angelos; Avdievich, Nikolai; Henning, Anke

2018-08-01

Macromolecular resonances (MM) arise mainly from cytosolic proteins and overlap with metabolites, influencing metabolite quantification. Macromolecules can serve as valuable biomarkers for diseases and pathologies. The objectives of this study were to characterize MM at 9.4T in the human brain (occipital and left parietal lobe) and to describe the RF coil setup used for MM acquisition in the two regions. An adiabatic inversion pulse was optimised for metabolite nulling at 9.4T using double inversion recovery and was combined for the first time with metabolite cycled (MC) semi-LASER and appropriate coil configuration. MM spectra (seven volunteers) from two brain locations were averaged and smoothed creating MM templates, which were then parametrized using simulated Voigt-shaped lines within LCModel. Quantification was performed on individual data sets, including corrections for different tissue composition and the T 1 and T 2 relaxation of water. Our coil configuration method resulted in efficient B1+ (>30 T/√kW) for both brain regions. The 15 MM components were detected and quantified in MM baselines of the two brain areas. No significant differences in concentration levels of MM between different regions were found. Two new MM peaks were reported (M7 & M8). Double inversion, which was combined with MC semi-LASER, enabled the acquisition of high spectral resolution MM spectra for both brain regions at 9.4T. The 15 MM components were detected and quantified. Two new MM peaks were reported for the first time (M7 & M8) and preliminarily assigned to β-methylene protons of aspartyl-groups. Magn Reson Med 80:462-473, 2018. © 2018 International Society for Magnetic Resonance in Medicine. © 2018 International Society for Magnetic Resonance in Medicine.

Gas inflow and outflow in an interacting high-redshift galaxy. The remarkable host environment of GRB 080810 at z = 3.35

NASA Astrophysics Data System (ADS)

Wiseman, P.; Perley, D. A.; Schady, P.; Prochaska, J. X.; de Ugarte Postigo, A.; Krühler, T.; Yates, R. M.; Greiner, J.

2017-11-01

We reveal multiple components of an interacting galaxy system at z ≈ 3.35 through a detailed analysis of the exquisite high-resolution Keck/HIRES spectrum of the afterglow of a gamma-ray burst (GRB). Through Voigt-profile fitting of absorption lines from the Lyman series, we constrain the neutral hydrogen column density to NH I ≤ 1018.35 cm-2 for the densest of four distinct systems at the host redshift of GRB 080810, which is among the lowest NH I ever observed in a GRB host, even though the line of sight passes within a projected 5 kpc of the galaxy centres. By detailed analysis of the corresponding metal absorption lines, we derive chemical, ionic, and kinematic properties of the individual absorbing systems, and thus build a picture of the host as a whole. Striking differences between the systems imply that the line of sight passes through several phases of gas: the star-forming regions of the GRB host; enriched material in the form of a galactic outflow; the hot and ionised halo of a second interacting galaxy falling towards the host at a line-of-sight velocity of 700 km s-1; and a cool metal-poor cloud that may represent one of the best candidates yet for the inflow of metal-poor gas from the intergalactic medium. The reduced spectrum is only available at the CDS via anonymous ftp to http://cdsarc.u-strasbg.fr (http://130.79.128.5) or via http://cdsarc.u-strasbg.fr/viz-bin/qcat?J/A+A/607/A107

Single-Crystal Elastic Constants of Yttria (Y2O3) Measured to High Temperatures

NASA Technical Reports Server (NTRS)

Sayir, Ali; Palko, James W.; Kriven, Waltraud M.; Sinogeikin, Sergey V.; Bass, Jay D.

2001-01-01

Yttria, or yttrium sesquioxide (Y2O3), has been considered for use in nuclear applications and has gained interest relatively recently for use in infrared optics. Single crystals of yttria have been grown successfully at the NASA Glenn Research Center using a laser-heated float zone technique in a fiber and rod. Such samples allow measurement of the single-crystal elastic properties, and these measurements provide useful property data for the design of components using single crystals. They also yield information as to what degree the elastic properties of yttria ceramics are a result of the intrinsic properties of the yttria crystal in comparison to characteristics that may depend on processing, such as microstructure and intergranular phases, which are common in sintered yttria. The single-crystal elastic moduli are valuable for designing such optical components. In particular, the temperature derivatives of elastic moduli allow the dimensional changes due to heating under physical constraints, as well as acoustic excitation, to be determined. The single-crystal elastic moduli of yttria were measured by Brillouin spectroscopy up to 1200 C. The room-temperature values obtained were C(sub 11) = 223.6 + 0.6 GPa, C(sub 44) = 74.6 + 0.5 GPa, and C(sub 12) = 112.4 + 1.0 GPa. The resulting bulk and (Voigt-Reuss-Hill) shear moduli were K = 149.5 + 1.0 GPa and G(sub VRH) = 66.3 + 0.8 GPa, respectively. Linear least-squares regressions to the variation of bulk and shear moduli with temperature resulted in derivatives of dK/dT = -17 + 2 MPa/C and dG(sub VRH)/dT = -8 + 2 MPa/ C. Elastic anisotropy was found to remain essentially constant over the temperature range studied.

The Temperature-Density Relation in the Intergalactic Medium at Redshift langzrang = 2.4

NASA Astrophysics Data System (ADS)

Rudie, Gwen C.; Steidel, Charles C.; Pettini, Max

2012-10-01

We present new measurements of the temperature-density (T-ρ) relation for neutral hydrogen in the 2.0 < z < 2.8 intergalactic medium (IGM) using a sample of ~6000 individual H I absorbers fitted with Voigt profiles constrained in all cases by multiple Lyman series transitions. We find model-independent evidence for a positive correlation between the column density of H I (N H I ) and the minimum observed velocity width of absorbers (b min). With minimal interpretation, this implies that the T-ρ relation in the IGM is not "inverted," contrary to many recent studies. Fitting b min as a function of N H I results in line-width-column-density dependence of the form b min = b 0(N H I /N H I,0)Γ-1 with a minimum line width at mean density (\\rho /\\bar{\\rho }= 1, N_H\\,\\mathsc{i, 0} = 10^{13.6} cm-2) of b 0 = 17.9 ± 0.2 km s-1 and a power-law index of (Γ - 1) = 0.15 ± 0.02. Using analytic arguments, these measurements imply an "equation of state" for the IGM at langzrang = 2.4 of the form T=T_0 \\left(\\rho /\\bar{\\rho }\\right)^{\\gamma -1} with a temperature at mean density of T 0 = [1.94 ± 0.05] × 104 K and a power-law index (γ - 1) = 0.46 ± 0.05. Based on data obtained at the W. M. Keck Observatory, which is operated as a scientific partnership among the California Institute of Technology, the University of California, and the National Aeronautics and Space Administration, and was made possible by the generous financial support of the W. M. Keck Foundation.

The ADER-DG method for seismic wave propagation and earthquake rupture dynamics

NASA Astrophysics Data System (ADS)

Pelties, Christian; Gabriel, Alice; Ampuero, Jean-Paul; de la Puente, Josep; Käser, Martin

2013-04-01

We will present the Arbitrary high-order DERivatives Discontinuous Galerkin (ADER-DG) method for solving the combined elastodynamic wave propagation and dynamic rupture problem. The ADER-DG method enables high-order accuracy in space and time while being implemented on unstructured tetrahedral meshes. A tetrahedral element discretization provides rapid and automatized mesh generation as well as geometrical flexibility. Features as mesh coarsening and local time stepping schemes can be applied to reduce computational efforts without introducing numerical artifacts. The method is well suited for parallelization and large scale high-performance computing since only directly neighboring elements exchange information via numerical fluxes. The concept of fluxes is a key ingredient of the numerical scheme as it governs the numerical dispersion and diffusion properties and allows to accommodate for boundary conditions, empirical friction laws of dynamic rupture processes, or the combination of different element types and non-conforming mesh transitions. After introducing fault dynamics into the ADER-DG framework, we will demonstrate its specific advantages in benchmarking test scenarios provided by the SCEC/USGS Spontaneous Rupture Code Verification Exercise. An important result of the benchmark is that the ADER-DG method avoids spurious high-frequency contributions in the slip rate spectra and therefore does not require artificial Kelvin-Voigt damping, filtering or other modifications of the produced synthetic seismograms. To demonstrate the capabilities of the proposed scheme we simulate an earthquake scenario, inspired by the 1992 Landers earthquake, that includes branching and curved fault segments. Furthermore, topography is respected in the discretized model to capture the surface waves correctly. The advanced geometrical flexibility combined with an enhanced accuracy will make the ADER-DG method a useful tool to study earthquake dynamics on complex fault systems in realistic rheologies.

A Roadmap for Reducing Cardiac Device Infections: a Review of Epidemiology, Pathogenesis, and Actionable Risk Factors to Guide the Development of an Infection Prevention Program for the Electrophysiology Laboratory.

PubMed

Branch-Elliman, Westyn

2017-08-16

Cardiovascular implantable electronic device (CIED) infections are highly morbid, common, and costly, and rates are increasing (Sohail et al. Arch Intern Med 171(20):1821-8 2011; Voigt et al. J Am Coll Cardiol 48(3):590-1 2006). Factors that contribute to the development of CIED infections include patient factors (comorbid conditions, self-care, microbiome), procedural details (repeat procedure, contamination during procedure, appropriate pre-procedural prep, and antimicrobial use), environmental and organizational factors (patient safety culture, facility barriers, such as lack of space to store essential supplies, quality of environmental cleaning), and microbial factors (type of organism, virulence of organism). Each of these can be specifically targeted with infection prevention interventions. Basic prevention practices, such as administration of systemic antimicrobials prior to incision and delaying the procedure in the setting of fever or elevated INR, are helpful for day-to-day prevention of cardiac device infections. Small single-center studies provide proof-of-concept that bundled prevention interventions can reduce infections, particularly in outbreak settings. However, data regarding which prevention strategies are the most important is limited as are data regarding the optimal prevention program for day-to-day prevention (Borer et al. Infect Control Hosp Epidemiol 25(6):492-7 2004; Ahsan et al. Europace 16(10):1482-9 2014). Evolution of infection prevention programs to include ambulatory and procedural areas is crucial as healthcare delivery is increasingly provided outside of hospitals and operating rooms. The focus on traditional operating rooms and inpatient care leaves the vast majority of healthcare delivery-including cardiac device implantations in the electrophysiology laboratory-uncovered.

Static Recovery Modeling of Dislocation Density in a Cold Rolled Clad Aluminum Alloy

NASA Astrophysics Data System (ADS)

Penlington, Alex

Clad alloys feature one or more different alloys bonded to the outside of a core alloy, with non-equilibrium, interalloy interfaces. There is limited understanding of the recovery and recrystallization behaviour of cold rolled clad aluminum alloys. In order to optimize the properties of such alloys, new heat treatment processes may be required that differ from what is used for the monolithic alloys. This study examines the recovery behaviour of a cold rolled Novelis Fusion(TM) alloy containing an AA6XXX core with an AA3003 cladding on one side. The bond between alloys appears microscopically discrete and continuous, but has a 30 microm wide chemical gradient. The as-deformed structure at the interalloy region consists of pancaked sub-grains with dislocations at the misorientation boundaries and a lower density organized within the more open interiors. X-ray line broadening was used to extract the dislocation density from the interalloy region and an equivalently deformed AA6XXX following static annealing using a modified Williamson-Hall analysis. This analysis assumed that Gaussian broadening contributions in a pseudo-Voigt function corresponded only to strain from dislocations. The kinetics of the dislocation density evolution to recrystallization were studied isothermally at 2 minute intervals, and isochronally at 175 and 205°C. The data fit the Nes model, in which the interalloy region recovered faster than AA6XXX at 175°C, but was slower at 205°C. This was most likely caused by change in texture and chemistry within this region such as over-aging of AA6XXX . Simulation of a continuous annealing and self homogenization process both with and without pre-recovery indicates a detectable, though small change in the texture and grain size in the interalloy region.

Thermal Volume Changes and Creep in the Callovo-Oxfordian Claystone

NASA Astrophysics Data System (ADS)

Belmokhtar, Malik; Delage, Pierre; Ghabezloo, Siavash; Conil, Nathalie

2017-09-01

The Callovo-Oxfordian (COx) claystone is considered as a potential host rock for high-level radioactive waste disposal at great depth in France. Given the exothermic nature of radioactive wastes, a temperature elevation planned to be smaller than 100 °C will affect the host rock around the disposal cells. To gain better understanding of the thermal volumetric response of the COx claystone, a new thermal isotropic compression cell was developed with particular attention devoted to monitoring axial and radial strains. To do so, a high-precision LVDTs system ensuring direct contact between the LVDT stem and the claystone sample through the membrane was developed. A short drainage length (10 mm) was also ensured so as to allow full saturation of the sample under stress conditions close to in situ, and fully drained conditions during compression. High-precision strain monitoring allowed to observe a volumetric creep under stress conditions close to in situ. A drained heating test under constant stress carried out afterwards up to 80 °C exhibited a thermoelastic expansion up to a temperature of 48 °C, followed by thermoplastic contraction at higher temperature. Creep volume changes, that appeared to be enhanced by temperature, were modelled by using a simple Kelvin-Voigt model, so as to estimate the instantaneous response of the COx claystone and to determine its thermal expansion coefficient. The temperature at which the transition between thermal expansion and contraction appeared is close to the maximum burial temperature of the Callovo-Oxfordian claystone, estimated at 50 °C. This is in agreement with what has been already observed on the Opalinus Clay by Monfared et al. (2012) that was interpreted as a thermal hardening phenomenon, showing that the material kept the memory of the highest temperature supported during its geological history.

TAS2R bitter taste receptors regulate thyroid function

PubMed Central

Clark, Adam A.; Dotson, Cedrick D.; Elson, Amanda E. T.; Voigt, Anja; Boehm, Ulrich; Meyerhof, Wolfgang; Steinle, Nanette I.; Munger, Steven D.

2015-01-01

Dysregulation of thyroid hormones triiodothyronine and thyroxine (T3/T4) can impact metabolism, body composition, and development. Thus, it is critical to identify novel mechanisms that impact T3/T4 production. We found that type 2 taste receptors (TAS2Rs), which are activated by bitter-tasting compounds such as those found in many foods and pharmaceuticals, negatively regulate thyroid-stimulating hormone (TSH)-dependent Ca2+ increases and TSH-dependent iodide efflux in thyrocytes. Immunohistochemical Tas2r-dependent reporter expression and real-time PCR analyses reveal that human and mouse thyrocytes and the Nthy-Ori 3-1 human thyrocyte line express several TAS2Rs. Five different agonists for thyrocyte-expressed TAS2Rs reduced TSH-dependent Ca2+ release in Nthy-Ori 3-1 cells, but not basal Ca2+ levels, in a dose-dependent manner. Ca2+ responses were unaffected by 6-n-propylthiouracil, consistent with the expression of an unresponsive variant of its cognate receptor, TAS2R38, in these cells. TAS2R agonists also inhibited basal and TSH-dependent iodide efflux. Furthermore, a common TAS2R42 polymorphism is associated with increased serum T4 levels in a human cohort. Our findings indicate that TAS2Rs couple the detection of bitter-tasting compounds to changes in thyrocyte function and T3/T4 production. Thus, TAS2Rs may mediate a protective response to overingestion of toxic materials and could serve as new druggable targets for therapeutic treatment of hypo- or hyperthyroidism.—Clark, A. A., Dotson, C. D., Elson, A. E. T., Voigt, A., Boehm, U., Meyerhof, W., Steinle, N. I., Munger, S. D. TAS2R bitter taste receptors regulate thyroid function. PMID:25342133

PROPERTIES OF QSO METAL-LINE ABSORPTION SYSTEMS AT HIGH REDSHIFTS: NATURE AND EVOLUTION OF THE ABSORBERS AND NEW EVIDENCE ON ESCAPE OF IONIZING RADIATION FROM GALAXIES

DOE Office of Scientific and Technical Information (OSTI.GOV)

Boksenberg, Alec; Sargent, Wallace L. W., E-mail: boksy@ast.cam.ac.uk

2015-05-15

Using Voigt-profile-fitting procedures on Keck High Resolution Spectrograph spectra of nine QSOs, we identify 1099 C IV absorber components clumped in 201 systems outside the Lyman forest over 1.6 ≲ z ≲ 4.4. With associated Si IV, C II, Si II  and N V where available, we investigate the bulk statistical and ionization properties of the components and systems and find no significant change in redshift for C IV and Si IV while C II, Si II  and N V change substantially. The C IV components exhibit strong clustering, but no clustering is detected for systems on scales from 150 kmmore » s{sup –1} out to 50,000 km s{sup –1}. We conclude that the clustering is due entirely to the peculiar velocities of gas present in the circumgalactic media of galaxies. Using specific combinations of ionic ratios, we compare our observations with model ionization predictions for absorbers exposed to the metagalactic ionizing radiation background augmented by proximity radiation from their associated galaxies and find that the generally accepted means of radiative escape by transparent channels from the internal star-forming sites is spectrally not viable for our stronger absorbers. We develop an active scenario based on runaway stars with resulting changes in the efflux of radiation that naturally enable the needed spectral convergence, and in turn provide empirical indicators of morphological evolution in the associated galaxies. Together with a coexisting population of relatively compact galaxies indicated by the weaker absorbers in our sample, the collective escape of radiation is sufficient to maintain the intergalactic medium ionized over the full range 1.9 < z ≲ 4.4.« less

ELEMENTAL DEPLETIONS IN THE MAGELLANIC CLOUDS AND THE EVOLUTION OF DEPLETIONS WITH METALLICITY

DOE Office of Scientific and Technical Information (OSTI.GOV)

Tchernyshyov, Kirill; Meixner, Margaret; Seale, Jonathan

2015-10-01

We present a study of the composition of gas and dust in the Large and Small Magellanic Clouds (LMC and SMC) using UV absorption spectroscopy. We measure P ii and Fe ii along 84 spatially distributed sightlines toward the MCs using archival Far Ultraviolet Spectroscopic Explorer observations. For 16 of those sightlines, we also measure Si ii, Cr ii, and Zn ii from new Hubble Space Telescope Cosmic Origins Spectrograph observations. We analyze these spectra using a new spectral line analysis technique based on a semi-parametric Voigt profile model. We have combined these measurements with H i and H{sub 2}more » column densities and reference stellar abundances from the literature to derive gas-phase abundances, depletions, and gas-to-dust ratios (GDRs). Of our 84 P and 16 Zn measurements, 80 and 13, respectively, are depleted by more than 0.1 dex, suggesting that P and Zn abundances are not accurate metallicity indicators at and above the metallicity of the SMC. Si, Cr, and Fe are systematically less depleted in the SMC than in the Milky Way (MW) or LMC. The minimum Si depletion in the SMC is consistent with zero. We find GDR ranges of 190–565 in the LMC and 480–2100 in the SMC, which is broadly consistent with GDRs from the literature. These ranges represent actual location to location variation and are evidence of dust destruction and/or growth in the diffuse neutral phase of the interstellar medium. Where they overlap in metallicity, the gas-phase abundances of the MW, LMC, and SMC and damped Lyα systems evolve similarly with metallicity.« less

Saturation Dip Measurements of High-J Transitions in the v_1+v_3 Band of C_2H_2: Absolute Frequencies and Self-Broadening

NASA Astrophysics Data System (ADS)

Sears, Trevor; Twagirayezu, Sylvestre; Hall, Gregory

2017-06-01

Saturation dip spectra of acetylene in the v_1 + v_3 band have been obtained for rotational lines with J = 31-37 inclusive, using a diode laser referenced to a frequency comb. The estimated accuracy and precision of the measurements is better than 10 kHz in 194 THz. Data were obtained as a function of sample pressure to investigate the broadening of the saturation features. The observed line shapes are well modeled by convolution of a fixed Gaussian transit-time and varying Lorentzian lifetime broadening, i.e. a Voigt-type profile. The lines exhibit a significantly larger collisional (lifetime) broadening than has been measured in conventional Doppler and pressure-broadened samples at ambient temperatures. The figure shows the fitted Lorentzian width versus sample pressure for P(31). The slope of this plot gives the pressure broadening coefficient, γ_{self} = 9.35(13) MHz/mbar. For comparison, the coefficient derived from conventional Doppler and pressure broadened spectra for this transition is 2.7 MHz/mbar. The sub-Doppler broadening coefficients are all significantly larger than the conventionally measured ones, due to the increased importance of velocity-changing collisions. The measurements therefore give information on the balance between hard phase- or state-changing and large cross-section velocity-changing collisions. Acknowledgments: Work at Brookhaven National Laboratory was carried out under Contract No. DE-SC0012704 with the U.S. Department of Energy, Office of Science, and supported by its Division of Chemical Sciences, Geosciences and Biosciences within the Office of Basic Energy Sciences. J. Molec. Spectrosc. 209, 216-227 (2001) and J. Quant. Spectrosc. Rad. Transf. 76, 237-267 (2003)

2.5-D frequency-domain viscoelastic wave modelling using finite-element method

NASA Astrophysics Data System (ADS)

Zhao, Jian-guo; Huang, Xing-xing; Liu, Wei-fang; Zhao, Wei-jun; Song, Jian-yong; Xiong, Bin; Wang, Shang-xu

2017-10-01

2-D seismic modelling has notable dynamic information discrepancies with field data because of the implicit line-source assumption, whereas 3-D modelling suffers from a huge computational burden. The 2.5-D approach is able to overcome both of the aforementioned limitations. In general, the earth model is treated as an elastic material, but the real media is viscous. In this study, we develop an accurate and efficient frequency-domain finite-element method (FEM) for modelling 2.5-D viscoelastic wave propagation. To perform the 2.5-D approach, we assume that the 2-D viscoelastic media are based on the Kelvin-Voigt rheological model and a 3-D point source. The viscoelastic wave equation is temporally and spatially Fourier transformed into the frequency-wavenumber domain. Then, we systematically derive the weak form and its spatial discretization of 2.5-D viscoelastic wave equations in the frequency-wavenumber domain through the Galerkin weighted residual method for FEM. Fixing a frequency, the 2-D problem for each wavenumber is solved by FEM. Subsequently, a composite Simpson formula is adopted to estimate the inverse Fourier integration to obtain the 3-D wavefield. We implement the stiffness reduction method (SRM) to suppress artificial boundary reflections. The results show that this absorbing boundary condition is valid and efficient in the frequency-wavenumber domain. Finally, three numerical models, an unbounded homogeneous medium, a half-space layered medium and an undulating topography medium, are established. Numerical results validate the accuracy and stability of 2.5-D solutions and present the adaptability of finite-element method to complicated geographic conditions. The proposed 2.5-D modelling strategy has the potential to address modelling studies on wave propagation in real earth media in an accurate and efficient way.

Calculations of single crystal elastic constants for yttria partially stabilised zirconia from powder diffraction data

DOE Office of Scientific and Technical Information (OSTI.GOV)

Lunt, A. J. G., E-mail: alexander.lunt@eng.ox.ac.uk; Xie, M. Y.; Baimpas, N.

2014-08-07

Yttria Stabilised Zirconia (YSZ) is a tough, phase-transforming ceramic that finds use in a wide range of commercial applications from dental prostheses to thermal barrier coatings. Micromechanical modelling of phase transformation can deliver reliable predictions in terms of the influence of temperature and stress. However, models must rely on the accurate knowledge of single crystal elastic stiffness constants. Some techniques for elastic stiffness determination are well-established. The most popular of these involve exploiting frequency shifts and phase velocities of acoustic waves. However, the application of these techniques to YSZ can be problematic due to the micro-twinning observed in larger crystals.more » Here, we propose an alternative approach based on selective elastic strain sampling (e.g., by diffraction) of grain ensembles sharing certain orientation, and the prediction of the same quantities by polycrystalline modelling, for example, the Reuss or Voigt average. The inverse problem arises consisting of adjusting the single crystal stiffness matrix to match the polycrystal predictions to observations. In the present model-matching study, we sought to determine the single crystal stiffness matrix of tetragonal YSZ using the results of time-of-flight neutron diffraction obtained from an in situ compression experiment and Finite Element modelling of the deformation of polycrystalline tetragonal YSZ. The best match between the model predictions and observations was obtained for the optimized stiffness values of C11 = 451, C33 = 302, C44 = 39, C66 = 82, C12 = 240, and C13 = 50 (units: GPa). Considering the significant amount of scatter in the published literature data, our result appears reasonably consistent.« less

Evaluation of copper, aluminum, and nickel interatomic potentials on predicting the elastic properties

NASA Astrophysics Data System (ADS)

Rassoulinejad-Mousavi, Seyed Moein; Mao, Yijin; Zhang, Yuwen

2016-06-01

Choice of appropriate force field is one of the main concerns of any atomistic simulation that needs to be seriously considered in order to yield reliable results. Since investigations on the mechanical behavior of materials at micro/nanoscale have been becoming much more widespread, it is necessary to determine an adequate potential which accurately models the interaction of the atoms for desired applications. In this framework, reliability of multiple embedded atom method based interatomic potentials for predicting the elastic properties was investigated. Assessments were carried out for different copper, aluminum, and nickel interatomic potentials at room temperature which is considered as the most applicable case. Examined force fields for the three species were taken from online repositories of National Institute of Standards and Technology, as well as the Sandia National Laboratories, the LAMMPS database. Using molecular dynamic simulations, the three independent elastic constants, C11, C12, and C44, were found for Cu, Al, and Ni cubic single crystals. Voigt-Reuss-Hill approximation was then implemented to convert elastic constants of the single crystals into isotropic polycrystalline elastic moduli including bulk modulus, shear modulus, and Young's modulus as well as Poisson's ratio. Simulation results from massive molecular dynamic were compared with available experimental data in the literature to justify the robustness of each potential for each species. Eventually, accurate interatomic potentials have been recommended for finding each of the elastic properties of the pure species. Exactitude of the elastic properties was found to be sensitive to the choice of the force fields. Those potentials that were fitted for a specific compound may not necessarily work accurately for all the existing pure species. Tabulated results in this paper might be used as a benchmark to increase assurance of using the interatomic potential that was designated for a problem.

Nonlinear Viscoelastic Mechanism for Aftershock Triggering and Decay

NASA Astrophysics Data System (ADS)

Shcherbakov, R.; Zhang, X.

2016-12-01

Aftershocks are ubiquitous in nature. They are the manifestation of relaxation phenomena observed in various physical systems. In one prominent example, they typically occur after large earthquakes. They also occur in other natural or experimental systems, for example, in solar flares, in fracture experiments on porous materials and acoustic emissions, after stock market crashes, in the volatility of stock prices returns, in internet traffic variability and e-mail spamming, to mention a few. The observed aftershock sequences usually obey several well defined non-trivial empirical laws in magnitude, temporal, and spatial domains. In many cases their characteristics follow scale-invariant distributions. The occurrence of aftershocks displays a prominent temporal behavior due to time-dependent mechanisms of stress and/or energy transfer. In this work, we consider a slider-block model to mimic the behavior of a seismogenic fault. In the model, we introduce a nonlinear viscoelastic coupling mechanism to capture the essential characteristics of crustal rheology and stress interaction between the blocks and the medium. For this purpose we employ nonlinear Kelvin-Voigt elements consisting of an elastic spring and a dashpot assembled in parallel to introduce viscoelastic coupling between the blocks and the driving plate. By mapping the model into a cellular automaton we derive the functional form of the stress transfer mechanism in the model. We show that the nonlinear viscoelasticity plays a critical role in triggering of aftershocks. It explains the functional form of the Omori-Utsu law and gives physical interpretation of its parameters. The proposed model also suggests that the power-law rheology of the fault gauge and underlying lower crust and upper mantle control the decay rate of aftershocks. To verify this, we analyze several prominent aftershock sequences to estimate their decay rates and correlate with the rheological properties of the underlying lower crust and mantle.

Spectroscopic analysis technique for arc-welding process control

NASA Astrophysics Data System (ADS)

Mirapeix, Jesús; Cobo, Adolfo; Conde, Olga; Quintela, María Ángeles; López-Higuera, José-Miguel

2005-09-01

The spectroscopic analysis of the light emitted by thermal plasmas has found many applications, from chemical analysis to monitoring and control of industrial processes. Particularly, it has been demonstrated that the analysis of the thermal plasma generated during arc or laser welding can supply information about the process and, thus, about the quality of the weld. In some critical applications (e.g. the aerospace sector), an early, real-time detection of defects in the weld seam (oxidation, porosity, lack of penetration, ...) is highly desirable as it can reduce expensive non-destructive testing (NDT). Among others techniques, full spectroscopic analysis of the plasma emission is known to offer rich information about the process itself, but it is also very demanding in terms of real-time implementations. In this paper, we proposed a technique for the analysis of the plasma emission spectrum that is able to detect, in real-time, changes in the process parameters that could lead to the formation of defects in the weld seam. It is based on the estimation of the electronic temperature of the plasma through the analysis of the emission peaks from multiple atomic species. Unlike traditional techniques, which usually involve peak fitting to Voigt functions using the Levenberg-Marquardt recursive method, we employ the LPO (Linear Phase Operator) sub-pixel algorithm to accurately estimate the central wavelength of the peaks (allowing an automatic identification of each atomic species) and cubic-spline interpolation of the noisy data to obtain the intensity and width of the peaks. Experimental tests on TIG-welding using fiber-optic capture of light and a low-cost CCD-based spectrometer, show that some typical defects can be easily detected and identified with this technique, whose typical processing time for multiple peak analysis is less than 20msec. running in a conventional PC.

HITRAN2016 : new and improved data and tools towards studies of planetary atmospheres

NASA Astrophysics Data System (ADS)

Gordon, Iouli; Rothman, Laurence S.; Wilzewski, Jonas S.; Kochanov, Roman V.; Hill, Christian; Tan, Yan; Wcislo, Piotr

2016-10-01

The HITRAN2016 molecular spectroscopic database is scheduled to be released this year. It will replace the current edition, HITRAN2012 [1], which has been in use, along with some intermediate updates, since 2012.We have added, revised, and improved many transitions and bands of molecular species and their isotopologues. Also, the amount of parameters has also been significantly increased, now incorporating, for instance, broadening by He, H2 and CO2 which are dominant in different planetary atmospheres [2]; non-Voigt line profiles [3]; and other phenomena. This poster will provide a summary of the updates, emphasizing details of some of the most important or drastic improvements or additions.To allow flexible incorporation of the new parameters and improve the efficiency of the database usage, the whole database has been reorganized into a relational database structure and presented to the user by means of a very powerful, easy-to-use internet program called HITRANonline [4] accessible at . This interface allows the user many queries in standard and user-defined formats. In addition, a powerful application called HAPI (HITRAN Application Programing Interface) [5] was developed. HAPI is a set of Python libraries that allows much more functionality for the user. Demonstration of the power of the new tools will also be offered.This work is supported by the NASA PATM (NNX13AI59G), PDART (NNX16AG51G) and AURA (NNX14AI55G) programs.References[1] L.S. Rothman et al, JQSRT 130, 4 (2013)[2] J. S. Wilzewski et al., JQSRT 168, 193 (2016)[3] P. Wcislo et al., JQSRT 177, 75 (2016)[4] C. Hill et al, JQSRT 177, 4 (2016)[5] R.V. Kochanov et al, JQSRT 177, 15 (2016)

A numerical and experimental investigation on seismic anisotropy of Finero Peridotite, Ivrea-Verbano Zone, northern Italy

NASA Astrophysics Data System (ADS)

Zhong, Xin; Frehner, Marcel; Zappone, Alba; Kunze, Karsten

2014-05-01

We present a combined experimental and numerical study on Finero Peridotite to investigate the major factors creating its seismic anisotropy. We extrapolate the ultrasonic seismic wave velocity measured in a hydrostatic pressure vessel to 0 MPa and 250 MPa confining pressure to compare with numerical simulations at atmospheric pressure and to restore the velocity at in-situ lower crustal conditions, respectively. A linear relation between confining pressure and seismic velocity above 80 MPa reveals the intrinsic mechanical property of the bulk rock without the interference of cracks. To visualize the crystallographic preferred orientation (CPO) we use the electron backscatter diffraction (EBSD) method and create crystallographic orientation maps and pole figures. The first also reveals the shape preferred orientation (SPO). We found that very weak CPO but significant SPO exist in most of the peridotite. The Voigt and Reuss bounds as well as the Hill average (VRH) are calculated from EBSD data to visualize seismic velocity and to calculate anisotropy in the form of velocity pole figures. We perform finite element (FE) simulations of wave propagation on the EBSD crystallographic orientation maps to calculate the effective wave velocity at different propagation angles, hence estimate the anisotropy numerically. In fracture-free models the FE simulation results agree well with the Hill average. In one case of a sample containing fractures the FE simulation yields similar minimal velocity as the laboratory measurement, which lies outside the VR bounds. This is a warning that care has to be taken when using VRH averages in fractured rocks. All three velocity estimates (hydrostatic pressure vessel, VRH average, and FE simulation) result in equally weak seismic anisotropy. This is mainly the consequence of weak CPO. Although SPO is significantly stronger it has minor influence on anisotropy. Hydrous minerals influence the seismic anisotropy only when their modal composition is large enough to allow waves to propagate preferentially through them. Unlike hornblende, phlogopite is not proven to be a major source for the seismic anisotropy due to its small modal composition. Seismic velocity is also influenced by the source frequency distribution. A lower-frequency source in the FE simulations results in lower effective velocity regardless of sample orientation. The frequency spectrum of the propagating wave is modified from source to receiver due to scattering at the mineral grains, thus leading to effective negative attenuation factors peaked at around 1-3 MHz depending on the source spectrum. However, compared with other factors, such as CPO, SPO, fractures, or hydrous mineral phases, the effect of the source frequency distribution is minor, but may be influential when extrapolated to seismic frequencies (Hz-kHz). This study provides a comprehensive method combining laboratory measurements, EBSD data, and numerical simulations to estimate seismic anisotropy. Future work may focus on modeling the influence of different pore fluids or more complex fracture geometries on seismic velocity and anisotropy. Acknowledgements This work was supported by the Swiss National Science Foundation (project UPseis, 200021_143319).

Ca Isotope Geochemistry in Marine Deep Sea Sediments of the Eastern Pacific

NASA Astrophysics Data System (ADS)

Wittke, A.; Gussone, N. C.; Derigs, D.; Schälling, M.; Teichert, B. M.

2017-12-01

Ca isotope ratio analysis (δ44/40Ca) is a powerful tool to investigate diagenetic reactions in marine sedimentary porewater systems, as it is sensitive to processes such as carbonate dissolution, precipitation, recrystallization, ion exchange and deep fluid sources, due to the isotopic difference between dissolved Ca and solid carbonate minerals (e.g. [1];[2]). We analyzed eight sediment cores of the (paleo-) Pacific equatorial age transect. Two sediment cores show decreasing Ca isotope profiles starting at the sediment/water interface with seawater-like values down to sediment-like values due to recrystallization and an increasing in the bottom part again to seawater-like values. The other studied cores show different degrees of flattening of this middle bulge. We interpret this pattern either as an effect of sediment composition and thickness, decreasing recrystallization rates and/or fluid flux or a combination of all of these factors at the respective sampling sites. Element concentration profiles and Sr-isotope variations on some of these sediment cores show a similar behavior, supporting our findings ([3]; [4]). Seawater influx at (inactive) seamounts is supposed to cause seawater-like values at the bottom of the sediment cores by fluids migrating through the oceanic basement (e.g. [5]). While [6] hypothesizes that two seamounts or bathymetric pits are connected, with a recharge and a discharge site [7] say that uptaken fluids could be released through the surrounding seafloor as well due to diffusive exchange with the underlying oceanic crust. Our Ca isotope results combined with a transport reaction model approach support the latter hypothesis. References: [1] Teichert B. M., Gussone N. and Torres M. E. (2009) [2] Ockert C., Gussone N., Kaufhold S. and Teichert B. (2013) [3] Pälike H., Lyle M., Nishi H., Raffi I., Gamage K. and Klaus A. (eds.) (2010) [4] Voigt J., Hathorne E. C., Frank M., Vollstaedt H. and Eisenhauer A. (2015) [5] Villinger H. W., Pichler T., Kaul N., Stephan S., Pälike H. and Stephan F. (2017) [6] Bekins B. A., Spivack A. J., Davis E. E. and Mayer L. A. (2007) [7] Mewes K., Mogollón J. M., Picard A., Rühlemann C., Eisenhauer A., Kuhn T., Ziebis W. and Kasten S. (2016)

Study of the Elasto-plastic Properties of Mineralized Biomaterials via Synchrotron High-energy X-ray Diffraction

NASA Astrophysics Data System (ADS)

Deymier-Black, Alix Christine

Synchrotron high-energy X-ray diffraction was employed to investigate the strains in the hydroxyapatite (HAP) platelets and mineralized collagen fibrils in bovine dentin and cortical bone. The HAP and the fibrillar apparent moduli, defined as the applied stress divided by the phase strain, in dentin were measured as 27+/-7.2 and 16+/-4.9 GPa. The HAP apparent modulus ( EHAPapp ) is less than the lower bound calculated for EHAPapp from the Voigt model. This discrepancy is probably due to stress concentrators or decreases in the HAP Young's modulus due to size or composition effects. EHAPapp and Efibapp in dentin vary significantly within a single tooth in both the apical-cervical direction and the buccal-lingual direction. However, the variation between teeth is minimal. The HAP and fibrillar apparent moduli are not affected by freezing in dentin or by X-ray irradiation in bone and dentin. X-ray irradiation causes a decrease in HAP residual strain in bone. This decrease suggests the presence of HAP-collagen interfacial damage. It was determined from the HAP 00.2 peak broadening that irradiation damage mostly affects the HAP unit cells which are under the highest strain. From this it was theorized that irradiation may damage highly-strained bonds at stress concentrators and/or calcium-mediated electrostatic bonds. The fact that the apparent modulus does not change with irradiation suggests that the interfacial damage must be reversible. Bone and dentin both undergo creep when loaded to high stresses. At low irradiation doses, both the fibrillar and HAP strains increase with creep time indicating that load is being transferred from the matrix to the HAP. However, at high doses, the strain on the HAP decreases with creep time. This supports the interfacial damage theory which would allow the HAP to release its elastic load upon interfacial debonding. At -80 MPa, beyond a dose of 50 kGy, the rate of change in HAP strain with time begins to increase, becoming positive at ˜115 kGy. After 300 kGy the HAP strain rate decreases and plateaus probably due to stiffening of the matrix through cross-linking. The HAP and fibrillar strain rate in irradiated bone and dentin samples increase with increased temperature and applied load.

A Global Fitting Approach For Doppler Broadening Thermometry

NASA Astrophysics Data System (ADS)

Amodio, Pasquale; Moretti, Luigi; De Vizia, Maria Domenica; Gianfrani, Livio

2014-06-01

Very recently, a spectroscopic determination of the Boltzmann constant, kB, has been performed at the Second University of Naples by means of a rather sophisticated implementation of Doppler Broadening Thermometry (DBT)1. Performed on a 18O-enriched water sample, at a wavelength of 1.39 µm, the experiment has provided a value for kB with a combined uncertainty of 24 parts over 106, which is the best result obtained so far, by using an optical method. In the spectral analysis procedure, the partially correlated speed-dependent hard-collision (pC-SDHC) model was adopted. The uncertainty budget has clearly revealed that the major contributions come from the statistical uncertainty (type A) and from the uncertainty associated to the line-shape model (type B)2. In the present work, we present the first results of a theoretical and numerical work aimed at reducing these uncertainty components. It is well known that molecular line shapes exhibit clear deviations from the time honoured Voigt profile. Even in the case of a well isolated spectral line, under the influence of binary collisions, in the Doppler regime, the shape can be quite complicated by the joint occurrence of velocity-change collisions and speed-dependent effects. The partially correlated speed-dependent Keilson-Storer profile (pC-SDKS) has been recently proposed as a very realistic model, capable of reproducing very accurately the absorption spectra for self-colliding water molecules, in the near infrared3. Unfortunately, the model is so complex that it cannot be implemented into a fitting routine for the analysis of experimental spectra. Therefore, we have developed a MATLAB code to simulate a variety of H218O spectra in thermodynamic conditions identical to the one of our DBT experiment, using the pC-SDKS model. The numerical calculations to determine such a profile have a very large computational cost, resulting from a very sophisticated iterative procedure. Hence, the numerically simulated spectra (with the addition of random noise) have been used to test the validity of simplified line shape models, such as the speed-dependent Galatry (SDG) profile and pC-SDHC model. In particular, we have used the global fitting procedure that is described in Amodio et al4. Such a procedure is very effective in reducing the uncertainty resulting from statistical correlation among free parameters. Therefore, the analysis of large amounts of simulated spectra has allowed us to study the influence of the choice of the model and quantify the achievable precision and accuracy levels, at the present value of the signal-to-noise ratio. freely redistributable under the GPL http://www.gnu.org.

Relating rheology to geometry in large-scale natural shear zones

NASA Astrophysics Data System (ADS)

Platt, John

2016-04-01

The geometry and width of the ductile roots of plate boundary scale faults are very poorly understood. Some field and geophysical data suggests widths of tens of km in the lower crust, possibly more in the upper mantle. Other observations suggest they are much narrower. Dip slip shear zones may flatten out and merge into zones of subhorizontal lower crustal or asthenospheric flow. The width of a ductile shear zone is simply related to relative velocity and strain rate. Strain rate is related to stress through the constitutive relationship. Can we constrain the stress, and do we understand the rheology of materials in ductile shear zones? A lot depends on how shear zones are initiated. If they are localized by pre-existing structures, width and/or rheology may be inherited, and we have too many variables. If shear zones are localized primarily by shear heating, initial shear stress has to be very high (> 1 GPa) to overcome conductive heat loss, and very large feedbacks (both positive and negative) make the system highly unstable. Microstructural weakening requires a minimum level of stress to cause deformation and damage in surrounding rock, thereby buffering the stress. Microstructural weakening leads to grain-size sensitive creep, for which we have constitutive laws, but these are complicated by phase mixing in polyphase materials, by viscous anisotropy, by hydration, and by changes in mineral assemblage. Here are some questions that need to be addressed. (1) If grain-size reduction by dynamic recrystallization results in a switch to grain-size sensitive creep (GSSC) in a stress-buffered shear zone, does dynamic recrystallization stop? Does grain growth set in? If grain-size is still controlled by dislocation processes, then the effective stress exponent for GSSC is 4-5, even though the dominant mechanism may be diffusion and/or grain-boundary sliding (GBS). (2) Is phase mixing in ultramylonites primarily a result of GBS + neighbour switching, creep cavitation and diffusion, or metamorphic reactions? (3) In two-phase / polyphase mixtures, does the strong phase generally form a load-bearing framework, favoring constant strain-rate (Voigt) bound behavior, or does the weak phase form through-going strain pathways, favoring constant stress (Reuss) bound behavior, or do the phases remain well mixed, favoring an intermediate behavior (e.g., Tullis et al model)? (4) How do we deal with the rheological effect of water? Is it simply an unconstrained variable in nature? Is the water fugacity model in flow laws adequate? (5) How can we better relate experimental results (often carried out at constant strain-rate, and not reaching microstructural steady state) to deformation in natural shear zones? Rheological observations on well-constrained natural shear zones are helping us answer some of these questions.

Self- and CO2-broadened line shape parameters for infrared bands of HDO

NASA Astrophysics Data System (ADS)

Smith, Mary-Ann H.; Malathy Devi, V.; Benner, D. Chris; Sung, Keeyoon; Mantz, Arlan W.; Gamache, Robert R.; Villanueva, Geronimo L.

2015-11-01

Knowledge of CO2-broadened HDO line widths and their temperature dependence is required to interpret infrared spectra of the atmospheres of Mars and Venus. However, this information is currently absent in most spectroscopic databases. We have analyzed nine high-resolution, high signal-to-noise spectra of HDO and HDO+CO2 mixtures to obtain broadening coefficients and other line shape parameters for transitions of the ν2 and ν3 vibrational bands located at 7.13 and 2.70 μm, respectively. The gas samples were prepared by mixing equal amounts of high-purity distilled H2O and 99% enriched D2O. The spectra were recorded at different temperatures (255-296 K) using a 20.38 cm long coolable cell [1] installed in the sample compartment of the Bruker IFS125HR Fourier transform spectrometer at the Jet Propulsion Laboratory in Pasadena, CA. The retrieved HDO spectroscopic parameters include line positions, intensities, self- and CO2-broadened half-width and pressure-induced shift coefficients and the temperature dependences for CO2 broadening. These spectroscopic parameters were obtained by simultaneous multispectrum fitting [2] of the same interval in all nine spectra. A non-Voigt line shape with speed dependence was applied. Line mixing was also observed for several transition pairs. Preliminary results compare well with the few other measurements reported in the literature.[1] K. Sung et al., J. Mol. Spectrosc. 162, 124-134 (2010).[2] D. C. Benner et al., J. Quant. Spectrosc. Radiat Transfer 53, 705-721 (1995).The research performed at the College of William and Mary was supported by NASA’s Mars Fundamental Research Program (Grant NNX13AG66G). The research at Jet Propulsion Laboratory, California Institute of Technology, Connecticut College, Langley Research Center, and Goddard Space Flight Center was conducted under contracts and cooperative agreements with the National Aeronautics and Space Administration. RRG is pleased to acknowledge support of this study by the National Science Foundation through Grant No. AGS-1156862.

MODTRAN2: Evolution and applications

DOE Office of Scientific and Technical Information (OSTI.GOV)

Anderson, G.P.; Chetwynd, J.H.; Kneizys, F.X.

1994-12-31

MODTRAN2 is the most recent version of the Moderate Resolution Atmospheric Radiance and Transmittance Model. It encompasses all the capabilities of LOWTRAN 7, the historic 20 cm{sup {minus}1} resolution (full width at half maximum, FWHM) radiance code, but incorporates a much more sensitive molecular band model with 2 cm{sup {minus}1} resolution. The band model is based directly upon the HITRAN spectral parameters, including both temperature and pressure (line shape) dependencies. Because the band model parameters and their applications to transmittance calculations have been independently developed using equivalent width binning procedures, validation against full Voigt line-by-line calculations is important. Extensive spectralmore » comparisons have shown excellent agreement. In addition, simple timing runs of MODTRAN vs. FASCOD3P show an improvement of more than a factor of 100 for a typical 500 cm{sup {minus}1} spectral interval and comparable vertical layering. It has been previously established that not only is MODTRAN an excellent band model for full path calculations, but it replicates layer-specific quantities to a very high degree of accuracy. Such layer quantities, derived from ratios and differences of longer path MODTRAN calculations from point A to adjacent layer boundaries, can be used to provide inversion algorithm weighting functions or similarly formulated quantities. One of the most exciting new applications is the rapid calculation of reliable IR cooling rates, including species, altitude, and spectral distinctions, as well as the standard integrated quantities. Comparisons with prior line-by-line cooling rate calculations are excellent, and the techniques can be extended to incorporate global climatologies. Enhancements expected to appear in MODTRAN3 relate directly to climate change studies. The addition of ultraviolet SO{sub 2} and NO{sub 2} in the UV, along with upgraded ozone Chappuis bands in the visible will also be part of MODTRAN3.« less

Transcriptome profiling of the floral buds and discovery of genes related to sex-differentiation in the dioecious cucurbit Coccinia grandis (L.) Voigt.

PubMed

Mohanty, Jatindra Nath; Nayak, Sanghamitra; Jha, Sumita; Joshi, Raj Kumar

2017-08-30

Dioecious species offer an inclusive structure to study the molecular basis of sexual dimorphism in angiosperms. Despite having a small genome and heteromorphic sex chromosomes, Coccinia grandis is a highly neglected dioecious species with little information available on its physical state, genetic orientation and key sex-defining elements. In the present study, we performed RNA-Seq and DGE analysis of male (MB) and female (FB) buds in C. grandis to gain insights into the molecular basis of sex determination in this plant. De novo assembly of 75 million clean reads resulted in 72,479 unigenes for male library and 63,308 unigenes for female library with a mean length of 736bp. 61,458 (85.57%) unigenes displayed significant similarity with protein sequences from publicly available databases. Comparative transcriptome analyses revealed 1410 unigenes as differentially expressed (DEGs) between MB and FB samples. A consistent correlation between the expression levels of DEGs was observed for the RNA-Seq pattern and qRT-PCR validation. Functional annotation showed high enrichment of DEGs involved in phytohormone biosynthesis, hormone signaling and transduction, transcriptional regulation and methyltransferase activity. High induction of hormone responsive genes such as ARF6, ACC synthase1, SNRK2 and BRI1-associated receptor kinase 1 (BAK1) suggest that multiple phytohormones and their signaling crosstalk play crucial role in sex determination in this species. Beside, the transcription factors such as zinc fingers, homeodomain leucine zippers and MYBs were identified as major determinants of male specific expression. Moreover, the detection of multiple DEGs as the miRNA target site implies that a small RNA mediated gene silencing cascade may also be regulating gender differentiation in C. grandis. Overall, the present transcriptome resources provide us a large number of DEGs involved in sex expression and could form the groundwork for unravelling the molecular mechanism of sex determination in C. grandis. Copyright © 2017 Elsevier B.V. All rights reserved.

Synthesis and re-investigation of the elastic properties of single-crystal magnesium silicate perovskite

NASA Astrophysics Data System (ADS)

Yeganeh-Haeri, Amir

1994-12-01

Single crystals of MgSiO3 in the perovskite structure have been grown at a peak pressure of 26 GPa and temperature of approximately 1600 K using a 2000 ton uniaxial split-sphere high-pressure apparatus (USSA-2000). The specimens were subsequently utilized to re-investigate the single-crystal elastic properties of this phase at ambient conditions using laser Brillouin spectroscopy. The nine adiabatic single-crystal elastic stiffness coefficients, in units of GPa, are: C11 = 482, C22 = 537, C33 = 485, C44 = 204, C55 = 186, C66 = 147, C12 = 144, C13 = 147, C23 = 146. The resulting estimated Voigt-Reuss-Hill (VRH) aggregate isotropic elastic moduli are: K=264.0 and mu = 177.3 GPa, respectively. The single-crystal elastic moduli of MgSiO3 perovskite display a pattern that is elastically somewhat anisotropic. The maximum shear and compressional velocities are 18% and 7% greater than the minimum. The (010) crystallographic direction contains both the fastest and the slowest shear wave velocities. If, under lower mantle conditions, magnesium silicate perovskite grains were to become preferentially oriented, a shear wave propagating in the Earth's lower mantle could become polarized with two distinct velocities. The observed density and seismic parameter of the lower mantle over the depth range of 1000-2700 km are compared with the calculated profiles for a model mantle consisting of pure perovskite (Mg(0.89)Fe(0.11))SiO3 and for a mixture composed of silicate perovskite and magnesiowuestite using our new elasticity results. At present, literature values of thermoelastic properties for silicate perovskite, in particular, the coefficient of thermal expansion and the temperature derivative of the isothermal bulk modulus, vary widely. Because of this disparity, we find that mantle models ranging from pure perovskite to 'pyrolitic'-type compositions provide acceptable fits to the seismically observed density and velocity profiles of the Earth's lower mantle.

Evaluation of copper, aluminum, and nickel interatomic potentials on predicting the elastic properties

DOE Office of Scientific and Technical Information (OSTI.GOV)

Rassoulinejad-Mousavi, Seyed Moein; Mao, Yijin; Zhang, Yuwen, E-mail: zhangyu@missouri.edu

Choice of appropriate force field is one of the main concerns of any atomistic simulation that needs to be seriously considered in order to yield reliable results. Since investigations on the mechanical behavior of materials at micro/nanoscale have been becoming much more widespread, it is necessary to determine an adequate potential which accurately models the interaction of the atoms for desired applications. In this framework, reliability of multiple embedded atom method based interatomic potentials for predicting the elastic properties was investigated. Assessments were carried out for different copper, aluminum, and nickel interatomic potentials at room temperature which is considered asmore » the most applicable case. Examined force fields for the three species were taken from online repositories of National Institute of Standards and Technology, as well as the Sandia National Laboratories, the LAMMPS database. Using molecular dynamic simulations, the three independent elastic constants, C{sub 11}, C{sub 12}, and C{sub 44}, were found for Cu, Al, and Ni cubic single crystals. Voigt-Reuss-Hill approximation was then implemented to convert elastic constants of the single crystals into isotropic polycrystalline elastic moduli including bulk modulus, shear modulus, and Young's modulus as well as Poisson's ratio. Simulation results from massive molecular dynamic were compared with available experimental data in the literature to justify the robustness of each potential for each species. Eventually, accurate interatomic potentials have been recommended for finding each of the elastic properties of the pure species. Exactitude of the elastic properties was found to be sensitive to the choice of the force fields. Those potentials that were fitted for a specific compound may not necessarily work accurately for all the existing pure species. Tabulated results in this paper might be used as a benchmark to increase assurance of using the interatomic potential that was designated for a problem.« less

Crystal structure, thermal expansivity, and elasticity of OH-chondrodite: Trends among dense hydrous magnesium silicates

DOE PAGES

Ye, Yu; Jacobsen, Steven D.; Mao, Zhu; ...

2015-04-01

Here, we report the structure and thermoelastic properties of OH-chondrodite. The sample was synthesized at 12 GPa and 1523 K, coexisting with hydroxyl-clinohumite and hydrous olivine. The Fe content Fe/(Fe+Mg) is 1.1 mol%, and the monoclinic unit-cell parameters are: a = 4.7459(2) Å, b = 10.3480(7) Å, c = 7.9002(6) Å, α = 108.702(7)°, and V = 367.50(4) Å3. At ambient conditions the crystal structure was refined in space group P 21/b from 1915 unique reflection intensities measured by single-crystal x-ray diffraction. The volume thermal expansion coefficient was measured between 150 and 800 K, resulting in α V = 2.8(5)×10more » -9(K -2) × T + 40.9(7) × 10 -6(K -1) – 0.81(3)(K)/T 2, with an average value of 38.0(9)×10 -6 K -1. Brillouin spectroscopy was used to measure a set of acoustic velocities from which all thirteen components (C ij) of the elastic tensor were determined. The Voigt-Reuss-Hill average of the moduli yield for the adiabatic bulk modulus, K S0 = 117.9(12) GPa, and for shear modulus, G 0 = 70.1(5) GPa. The Reuss bound on the isothermal bulk modulus (K T0) is 114.2(14) GPa. From the measured thermodynamic properties, the Grüneisen parameter (γ) is calculated to be 1.66(4). Fitting previous static compression data using our independently measured bulk modulus (isothermal Reuss bound) as a fixed parameter, we refined the first pressure derivative of the bulk modulus, K T’ = 5.5(1). Systematic trends between H 2O content and physical properties are evaluated among dense hydrous magnesium silicate (DHMS) phases along the forsterite-brucite join.« less

Nonlinear Viscoelastic Rheology and the Occurrence of Aftershocks

NASA Astrophysics Data System (ADS)

Shcherbakov, R.; Zhang, X.

2017-12-01

Aftershocks are ubiquitous in nature. They are the manifestation of relaxation phenomena observed in various physical systems. In one prominent example, they typically occur after large earthquakes. The observed aftershock sequences usually obey several well defined non-trivial empirical laws in magnitude, temporal, and spatial domains. In many cases their characteristics follow scale-invariant distributions. The occurrence of aftershocks displays a prominent temporal behavior due to time-dependent mechanisms of stress and/or energy transfer. There are compelling evidences that the lower continental crust and upper mantle are governed by various solid state creep mechanisms. Among those mechanisms a power-law viscous flow was suggested to explain the postseismic surface deformation after large earthquakes. In this work, we consider a slider-block model to mimic the behavior of a seismogenic fault. In the model, we introduce a nonlinear viscoelastic coupling mechanism to capture the essential characteristics of crustal rheology and stress interaction between the blocks and the medium. For this purpose we employ nonlinear Kelvin-Voigt elements consisting of an elastic spring and a dashpot assembled in parallel to introduce viscoelastic coupling between the blocks and the driving plate. By mapping the model into a cellular automaton we derive the functional form of the stress transfer mechanism in the model. We show that the nonlinear viscoelasticity plays a critical role in triggering of aftershocks. It explains the functional form of the Omori-Utsu law and gives physical interpretation of its parameters. The proposed model also suggests that the power-law rheology of the fault gauge and underlying lower crust and upper mantle controls the decay rate of aftershocks. To verify this, we analyze several prominent aftershock sequences to estimate their decay rates and correlate with the rheological properties of the underlying lower crust and mantle, which were estimated from the postseismic surface deformation. Our modelling suggests that the power-law rheology exponent n controls the decay rate of aftershocks and is related to the parameter p of the Omori-Utsu law.

Spectacle and SpecViz: New Spectral Analysis and Visualization Tools

NASA Astrophysics Data System (ADS)

Earl, Nicholas; Peeples, Molly; JDADF Developers

2018-01-01

A new era of spectroscopic exploration of our universe is being ushered in with advances in instrumentation and next-generation space telescopes. The advent of new spectroscopic instruments has highlighted a pressing need for tools scientists can use to analyze and explore these new data. We have developed Spectacle, a software package for analyzing both synthetic spectra from hydrodynamic simulations as well as real COS data with an aim of characterizing the behavior of the circumgalactic medium. It allows easy reduction of spectral data and analytic line generation capabilities. Currently, the package is focused on automatic determination of absorption regions and line identification with custom line list support, simultaneous line fitting using Voigt profiles via least-squares or MCMC methods, and multi-component modeling of blended features. Non-parametric measurements, such as equivalent widths, delta v90, and full-width half-max are available. Spectacle also provides the ability to compose compound models used to generate synthetic spectra allowing the user to define various LSF kernels, uncertainties, and to specify sampling.We also present updates to the visualization tool SpecViz, developed in conjunction with the JWST data analysis tools development team, to aid in the exploration of spectral data. SpecViz is an open source, Python-based spectral 1-D interactive visualization and analysis application built around high-performance interactive plotting. It supports handling general and instrument-specific data and includes advanced tool-sets for filtering and detrending one-dimensional data, along with the ability to isolate absorption regions using slicing and manipulate spectral features via spectral arithmetic. Multi-component modeling is also possible using a flexible model fitting tool-set that supports custom models to be used with various fitting routines. It also features robust user extensions such as custom data loaders and support for user-created plugins that add new functionality.This work was supported in part by HST AR #13919, HST GO #14268, and HST AR #14560.

Dynamic Rupture Modeling in Three Dimensions on Unstructured Meshes Using a Discontinuous Galerkin Method

NASA Astrophysics Data System (ADS)

Pelties, C.; Käser, M.

2010-12-01

We will present recent developments concerning the extensions of the ADER-DG method to solve three dimensional dynamic rupture problems on unstructured tetrahedral meshes. The simulation of earthquake rupture dynamics and seismic wave propagation using a discontinuous Galerkin (DG) method in 2D was recently presented by J. de la Puente et al. (2009). A considerable feature of this study regarding spontaneous rupture problems was the combination of the DG scheme and a time integration method using Arbitrarily high-order DERivatives (ADER) to provide high accuracy in space and time with the discretization on unstructured meshes. In the resulting discrete velocity-stress formulation of the elastic wave equations variables are naturally discontinuous at the interfaces between elements. The so-called Riemann problem can then be solved to obtain well defined values of the variables at the discontinuity itself. This is in particular valid for the fault at which a certain friction law has to be evaluated. Hence, the fault’s geometry is honored by the computational mesh. This way, complex fault planes can be modeled adequately with small elements while fast mesh coarsening is possible with increasing distance from the fault. Due to the strict locality of the scheme using only direct neighbor communication, excellent parallel behavior can be observed. A further advantage of the scheme is that it avoids spurious high-frequency contributions in the slip rate spectra and therefore does not require artificial Kelvin-Voigt damping or filtering of synthetic seismograms. In order to test the accuracy of the ADER-DG method the Southern California Earthquake Center (SCEC) benchmark for spontaneous rupture simulations was employed. Reference: J. de la Puente, J.-P. Ampuero, and M. Käser (2009), Dynamic rupture modeling on unstructured meshes using a discontinuous Galerkin method, JOURNAL OF GEOPHYSICAL RESEARCH, VOL. 114, B10302, doi:10.1029/2008JB006271

First-principles study on the structural, elastic and electronic properties of Ti4N3 and Ti6N5 under high pressure

NASA Astrophysics Data System (ADS)

Yang, Ruike; Chai, Bao; Zhu, Chuanshuai; Wei, Qun; Du, Zheng

2017-12-01

The structural, elastic and electronic properties of Ti4N3 and Ti6N5 have been systematically studied by first-principles calculations based on density functional theory (DFT) with generalized gradient approximation (GGA) and local density approximation (LDA). Basic physical properties for Ti4N3 and Ti6N5, such as the lattice constants, the bulk modulus, shear modulus, and elastic constants are calculated. The results show that Ti4N3 and Ti6N5 are mechanically stable under ambient pressure. The phonon dispersion spectra are researched throughout the Brillouin zone via the linear response approach as implemented in the CASTEP code, which indicate the optimized structures are stable dynamically. The Young’s modulus E and Poisson’s ratios ν are also determined within the framework of the Voigt-Reuss-Hill approximation. The analyses show that Ti4N3 is more ductile than Ti6N5 at the same pressure and ductility increases as the pressure increases. Moreover, the anisotropies of the Ti4N3 and Ti6N5 are discussed by the Young’s modulus at different directions, and the results indicate that the anisotropy of the two Ti-N compounds is obvious. The total density of states (TDOS) and partial density of states (PDOS) show that the TDOS of TiN, Ti4N3 and Ti6N5 originate mainly from Ti “d” and N “p” states. The results show that Ti4N3 and Ti6N5 present semimetal character. Pressure makes the level range of DOS significantly extended, for TiN, Ti4N3 and Ti6N5. The TDOS decreases with the pressure rise, at Fermi level.

New Elastic Moduli for Amphiboles and Feldspars: Impact on Interpretations of Seismic Velocities

NASA Astrophysics Data System (ADS)

Brown, J. M.; Angel, R. J.

2016-12-01

Seismic properties (both isotropic and anisotropic) of the crust and upper mantle require re-evaluation in light of improved single crystal properties for feldspars and amphiboles as a function of elemental partitioning. Together these minerals constitute more than half of the crust and are locally important in the lithospheric mantle. Their contribution in understanding seismic structures (both in the crust and mantle) has long been recognized. However, published single crystal elastic moduli, required in predictions of seismic velocities based on mineral properties, have remained inadequate for over 50 years. For example, the contribution of amphiboles to seismic velocities has often been approximated on the basis of the reported moduli for two hornblende crystals of unknown composition. New measurements now accurately characterize the plagioclase feldspars, the potassium feldspars, and the calcium and calcium-sodium amphiboles (including a range of compositions for common hornblende). The new moduli allow successful predictions of rock velocities with and without crystal preferred orientations. In contrast, the older moduli required inappropriate use of the Voigt upper aggregate bound in order to rationalize laboratory measurements. These minerals are also more anisotropic than suggested on the basis of the earlier work where cracks and open cleavage surfaces may have artificially depressed the apparent anisotropy. Both feldspars and amphiboles are nearly as anisotropic as sheet silicates with compressional velocity anisotropy of greater than 50%. The plagioclase feldspars show strong compositional trends with small discontinuities between minor structural transitions. In contrast, potassium substitution for sodium and differences in aluminum ordering have little impact on elastic moduli. In the amphiboles, elastic properties are strongly dependent on total aluminum and iron composition. The bulk modulus is most sensitive to aluminum and the shear modulus is more sensitive to iron. Variations in Poisson's ratio (which depends on the ratio of isotropic compressional and shear wave velocities) associated with compositions within the amphiboles and the feldspars are larger than previously predicted. The extent of modifications to seismic interpretations is evaluated.

Acoustic Radiation Force-Induced Creep-Recovery (ARFICR): A Noninvasive Method to Characterize Tissue Viscoelasticity.

PubMed

Amador Carrascal, Carolina; Chen, Shigao; Urban, Matthew W; Greenleaf, James F

2018-01-01

Ultrasound shear wave elastography is a promising noninvasive, low cost, and clinically viable tool for liver fibrosis staging. Current shear wave imaging technologies on clinical ultrasound scanners ignore shear wave dispersion and use a single group velocity measured over the shear wave bandwidth to estimate tissue elasticity. The center frequency and bandwidth of shear waves induced by acoustic radiation force depend on the ultrasound push beam (push duration, -number, etc.) and the viscoelasticity of the medium, and therefore are different across scanners from different vendors. As a result, scanners from different vendors may give different tissue elasticity measurements within the same patient. Various methods have been proposed to evaluate shear wave dispersion to better estimate tissue viscoelasticity. A rheological model such as the Kelvin-Voigt model is typically fitted to the shear wave dispersion to solve for the elasticity and viscosity of tissue. However, these rheological models impose strong assumptions about frequency dependence of elasticity and viscosity. Here, we propose a new method called Acoustic Radiation Force Induced Creep-Recovery (ARFICR) capable of quantifying rheological model-independent measurements of elasticity and viscosity for more robust tissue health assessment. In ARFICR, the creep-recovery time signal at the focus of the push beam is used to calculate the relative elasticity and viscosity (scaled by an unknown constant) over a wide frequency range. Shear waves generated during the ARFICR measurement are also detected and used to calculate the shear wave velocity at its center frequency, which is then used to calibrate the relative elasticity and viscosity to absolute elasticity and viscosity. In this paper, finite-element method simulations and experiments in tissue mimicking phantoms are used to validate and characterize the extent of viscoelastic quantification of ARFICR. The results suggest that ARFICR can measure tissue viscoelasticity reliably. Moreover, the results showed the strong frequency dependence of viscoelastic parameters in tissue mimicking phantoms and healthy liver.

Phylogenetic analyses reveal that Schellackia parasites (Apicomplexa) detected in American lizards are closely related to the genus Lankesterella: is the range of Schellackia restricted to the Old World?

PubMed

Megía-Palma, Rodrigo; Martínez, Javier; Paranjpe, Dhanashree; D'Amico, Verónica; Aguilar, Rocío; Palacios, María Gabriela; Cooper, Robert; Ferri-Yáñez, Francisco; Sinervo, Barry; Merino, Santiago

2017-10-10

Species of Schellackia Reichenow, 1919 have been described from the blood of reptiles distributed worldwide. Recently, Schellackia spp. detected in European and Asian lizards have been molecularly characterised. However, parasites detected in American lizard hosts remain uncharacterised. Thus, phylogenetic affinities between the Old and New World parasite species are unknown. In the present study, we characterised morphologically and molecularly the hemococcidian parasites (sporozoites) that infect three lizard hosts from North America and two from South America. In total, we generated 12 new 18S rRNA gene sequences of hemococcidian parasites infecting New World lizard hosts. By the microscopic examination of the smears we identified Schellackia golvani Rogier & Landau, 1975 (ex Anolis carolinensis Voigt) and Schellackia occidentalis Bonorris & Ball, 1955 (ex Uta stansburiana Baird & Girard and Sceloporus occidentalis Baird & Girard) in some samples, but the phylogenetic analysis indicated that all 18S rDNA sequences are distant from Schellackia species found in Old World lizards. In fact, the hemococcidian parasites detected in the New World lizards (including S. occidentalis and S. golvani) were closely related to the genus Lankesterella Labbé, 1899. Consequently, we suggest these two species to be included within the genus Lankesterella. Life history traits of hemococcidian parasites such as the type of host blood cells infected, host species or number of refractile bodies are not valid diagnostic characteristics to differentiate the parasites between the genera Schellackia and Lankesterella. Indeed, lankesterellid parasites with a different number of refractile bodies had a close phylogenetic origin. Based on the phylogenetic results we provide a systematic revision of the North American hemococcidians. Our recommendation is to include the species formerly described in the genus Schellackia that infect American lizards into Lankesterella (Lankesterellidae) as Lankesterella golvani (Rogier & Landau, 1975) n. comb and L. occidentalis (Bonorris & Ball, 1955) n. comb.

On mantle heterogeneity and anisotropy as mapped by inversion of global surface wave data

NASA Astrophysics Data System (ADS)

Khan, A.; Boschi, L.; Connolly, J.; Deschamps, F.

2008-12-01

We jointly invert Love and Rayleigh wave dispersion curves for the Earth's mantle composition, thermal state, P and S wave anisotropy at different locations on the Earth, based on self-consistent thermodynamic calculations. The method consists of four parts: 1. The composition of the Earth is modeled by the chemical system CaO-FeO-MgO- Al2O3-SiO2. Given these parameters and a geotherm (also an unknown), we calculate stable mineral modes, elastic properties, bulk density at the prevailing physical conditions using Gibbs free energy minimisation. Voigt-Reuss-Hill averaging is subsequently emplouyed to compute radial isotropic P and S wave velocity profiles in the elastic limit. 2. Anisotropic P and S wave velocities are determined from the isotropic ones by employing the relations ξ=(Vsh/Vsv)2, φ = (Vpv/Vph)2, η=F/(2A-L), Vs=(2Vsv2+Vsh2)/3 and Vp=(Vpv2+4Vph2)/5. The former three parameters are the standard anisotropy parameters, that we also invert for. 4. From these radial profiles, i.e. of Vsv, Vsh, Vph, Vpv and ρ, sunthetic Love and Rayleigh wave dispersion curves are calculated. The dispersion curves, which comprise fundamental and overtones up to 5th (Love) and 6th (Rayleigh) order have been extracted from global surface wave velocity maps. Given the above scheme, the data are at each location are jointly inverted using a Markov Chain Monte Carlo algorithm, from which a range of compositions, temperatures and radial profiles of anisotropy parameters, fitting data within uncertainties, are obtained. Our method has several advantages over standard approaches, in that no scaling relationships between Vs and Vp and ρ and Vs have to be introduced, implying that the full sensitivity of Rayleigh and Love waves to the parameters Vs, Vp and ρ is accounted for. In this particular study we investigate 5 locations distributed across the globe and reveal mantle chemical and thermal differences at these locations.

Putting the slab back: First steps of creating a synthetic seismic section of subducted lithosphere

NASA Astrophysics Data System (ADS)

Zertani, S.; John, T.; Tilmann, F. J.; Leiss, B.; Labrousse, L.; Andersen, T. B.

2016-12-01

Imaging subducted lithosphere is a difficult task which is usually tackled with geophysical methods. To date, the most promising method is receiver function imaging (RF), which concentrates on first order conversions from p- to s-waves at boundaries (e.g. lithological and structural) with contrasting seismic velocities. The resolution is high for the upper parts of the subducting material. However, in greater depths (40-80 km) the visualization of the subducted slab becomes increasingly blurry, until the slab cannot be distinguished from Earth's mantle anymore, rendering a visualization impossible. This blurry zone is thought to occur due to advancing eclogitization of the subducting slab. However, it is not well understood how micro- to macro-scale structures related to progressive eclogitization affect RF signals. The island of Holsnoy in the Bergen Arcs of western Norway represents a partially eclogitized formerly subducted block of lower crust and serves as an analogue to the aforementioned blurry zone in RF images. This eclogitization can be observed in static fluid induced eclogitization patches or fingers, but is mainly present in localized shear zones of variable sizes (mm to 100s of meters). We mapped the area to gain a better understanding of the geometries of such shear zones, which could possibly function as seismic reflectors. Further, we calculated seismic velocities from thermodynamic modelling on the basis of XRF whole rock analysis and compared these results to velocities calculated from a combination of thin section information, EMPA and physical mineral properties (Voigt-Reuss-Hill averaging). Both methods yield consistent results for p- and s-wave velocities of eclogites and granulites from Holsnoy. In combination with X-ray measurements to identify the microtextures of the characteristic samples to incorporate seismic anisotropy caused by e.g. foliation or lineation, these seismic velocities are used as an input for seismic models to reconstruct the progressive eclogitization of a subducting slab as seen in many RF-images (i.e. blurry zone).

Structural Characterization and Impedance Spectroscopy of Substituted, Fused-Ring Organic Semiconductors

NASA Astrophysics Data System (ADS)

Shaw, Charles Michael

Organic materials present a number of advantages over silicon that make them ideal candidates for modest performance devices like active matrix backplanes and RFID tags. The work detailed here describes both structural characterization of promising new materials, as well as the adaptation of impedance spectroscopy techniques to the study of organic transistors. Unit cells and solution casting behavior for dioctyl- and didodecyl-pentathienoacene are presented. Dioctyl pentathienoacene has an orthorhombic lattice with parameters a = 1.15 nm, b = 0.43 nm and c = 3.05 nm. Didodecyl pentathienoacene has an monoclinic lattice with parameters gamma = 92.2°, a = 1.10 urn, b = 0.42 nm and c = 3.89 nm. Additionally, thermotropic phase behavior is detailed. Both materials exhibit a "side chain melting" transition---characterized by a dramatic unit cell contraction of more than 20%---and smectic C liquid crystal phases. The side chain melting transition shows similarity to phase transitions elicited by exposing these materials to high energy electron flux. In both cases, disorder in the substitutions results in new phases for these materials. Dioctyl-pentathienoacene also exhibits a unique phase, which is intermediately ordered and shows a threefold increase in critical dose over the as-cast phase. Impedance spectroscopy of triisopropylsilyl pentacene transistors suggests these devices are well fit by a Voigt model equivalent circuit. The gate bias dependent resistor represents the channel conductance and the capacitor represents the drain-gate and source-gate capacitances. This in turn suggests that conduction occurs through delocalized states available in ordered regions, with disordered regions contributing localized, immobile states. Impedance spectroscopy of poly(2,5-bis(3-alkylthiophen-2-yl)thieno[3,2-b]thiophene) shows similar behavior. The use of variable temperature impedance spectroscopy is also demonstrated. This technique is used to measure the reduction in trap energy---from 200 meV to 140 meV---produced by annealing the material in its liquid crystal phase.

Development of a High-Resolution Laser Absorption Spectroscopy Method with Application to the Determination of Absolute Concentration of Gaseous Elemental Mercury in Air.

PubMed

Srivastava, Abneesh; Hodges, Joseph T

2018-06-05

Isotope dilution-cold-vapor-inductively coupled plasma mass spectrometry (ID-CV-ICPMS) has become the primary standard for measurement of gaseous elemental mercury (GEM) mass concentration. However, quantitative mass spectrometry is challenging for several reasons including (1) the need for isotopic spiking with a standard reference material, (2) the requirement for bias-free passive sampling protocols, (3) the need for stable mass spectrometry interface design, and (4) the time and cost involved for gas sampling, sample processing, and instrument calibration. Here, we introduce a high-resolution laser absorption spectroscopy method that eliminates the need for sample-specific calibration standards or detailed analysis of sample treatment losses. This technique involves a tunable, single-frequency laser absorption spectrometer that measures isotopically resolved spectra of elemental mercury (Hg) spectra of 6 1 S 0 ← 6 3 P 1 intercombination transition near λ = 253.7 nm. Measured spectra are accurately modeled from first-principles using the Beer-Lambert law and Voigt line profiles combined with literature values for line positions, line shape parameters, and the spontaneous emission Einstein coefficient to obtain GEM mass concentration values. We present application of this method for the measurement of the equilibrium concentration of mercury vapor near room temperature. Three closed systems are considered: two-phase mixtures of liquid Hg and its vapor and binary two-phase mixtures of Hg-air and Hg-N 2 near atmospheric pressure. Within the experimental relative standard uncertainty, 0.9-1.5% congruent values of the equilibrium Hg vapor concentration are obtained for the Hg-only, Hg-air, Hg-N 2 systems, in confirmation with thermodynamic predictions. We also discuss detection limits and the potential of the present technique to serve as an absolute primary standard for measurements of gas-phase mercury concentration and isotopic composition.

Tidally Heated Terrestrial Exoplanets

NASA Astrophysics Data System (ADS)

Henning, Wade Garrett

This work models the surface and internal temperatures for hypothetical terrestrial planets in situations involving extreme tidal heating. The feasibility of such planets is evaluated in terms of the orbital perturbations that may give rise to them, their required proximity to a hoststar, and the potential for the input tidal heating to cause significant partial melting of the mantle. Trapping terrestrial planets into 2:1 resonances with migrating Hot Jupiters is considered as a reasonable way for Earth-like worlds to both maintain high eccentricities and to move to short enough orbital periods (1-20 days) for extreme tidal heating to occur. Secular resonance and secular orbital perturbations may support moderate tidal heating at a low equilibrium eccentricity. At orbital periods below 10-30 days, with eccentricities from 0.01 to 0.1, tidal heat may greatly exceed radiogenic heat production. It is unlikely to exceed insolation, except when orbiting very low luminosity hosts, and thus will have limited surface temperature expression. Observations of such bodies many not be able to detect tidal surface enhancements given a few percent uncertainty in albedo, except on the nightside of spin synchronous airless objects. Otherwise detection may occur via spectral detection of hotspots or high volcanic gas concentrations including sulfur dioxide and hydrogen sulfide. The most extreme cases may be able to produce magma oceans, or magma slush mantles with up to 40-60% melt fractions. Tides may alter the habitable zones for smaller red dwarf stars, but are generally detrimental. Multiple viscoelastic models, including the Maxwell, Voigt-Kelvin, Standard Anelastic Solid, and Burgers rheologies are explored and applied to objects such as Io and the super-Earth planet GJ 876d. The complex valued Love number for the Burgers rheology is derived and found to be a useful improvement when modeling the low temperature behavior of tidal bodies, particularly during low eccentricity excursions. Viscoelastic solutions for GJ 876d are typical of extreme short period high eccentricity objects with tidal-convectiveequilibrium heat rates between ˜10,000 to 500,000 terawatts.

A QCM-D study of the concentration- and time-dependent interactions of human LL37 with model mammalian lipid bilayers.

PubMed

Lozeau, Lindsay D; Rolle, Marsha W; Camesano, Terri A

2018-07-01

The human antimicrobial peptide LL37 is promising as an alternative to antibiotics due to its biophysical interactions with charged bacterial lipids. However, its clinical potential is limited due to its interactions with zwitterionic mammalian lipids leading to cytotoxicity. Mechanistic insight into the LL37 interactions with mammalian lipids may enable rational design of less toxic LL37-based therapeutics. To this end, we studied concentration- and time-dependent interactions of LL37 with zwitterionic model phosphatidylcholine (PC) bilayers with quartz crystal microbalance with dissipation (QCM-D). LL37 mass adsorption and PC bilayer viscoelasticity changes were monitored by measuring changes in frequency (Δf) and dissipation (ΔD), respectively. The Voigt-Kelvin viscoelastic model was applied to Δf and ΔD to study changes in bilayer thickness and density with LL37 concentration. At low concentrations (0.10-1.00 μM), LL37 adsorbed onto bilayers in a concentration-dependent manner. Further analyses of Δf, ΔD and thickness revealed that peptide saturation on the bilayers was a threshold for interactions observed above 2.00 μM, interactions that were rapid, multi-step, and reached equilibrium in a concentration- and time-dependent manner. Based on these data, we proposed a model of stable transmembrane pore formation at 2.00-10.0 μM, or transition from a primarily lipid to a primarily protein film with a transmembrane pore formation intermediate state at concentrations of LL37 > 10 μM. The concentration-dependent interactions between LL37 and PC bilayers correlated with the observed concentration-dependent biological activities of LL37 (antimicrobial, immunomodulatory and non-cytotoxic at 0.1-1.0 μM, hemolytic and some cytotoxicity at 2.0-13 μM and cytotoxic at >13 μM). Copyright © 2018 Elsevier B.V. All rights reserved.

Controlling adsorption and passivation properties of bovine serum albumin on silica surfaces by ionic strength modulation and cross-linking.

PubMed

Park, Jae Hyeon; Sut, Tun Naw; Jackman, Joshua A; Ferhan, Abdul Rahim; Yoon, Bo Kyeong; Cho, Nam-Joon

2017-03-29

Understanding the physicochemical factors that influence protein adsorption onto solid supports holds wide relevance for fundamental insights into protein structure and function as well as for applications such as surface passivation. Ionic strength is a key parameter that influences protein adsorption, although how its modulation might be utilized to prepare well-coated protein adlayers remains to be explored. Herein, we investigated how ionic strength can be utilized to control the adsorption and passivation properties of bovine serum albumin (BSA) on silica surfaces. As protein stability in solution can influence adsorption kinetics, the size distribution and secondary structure of proteins in solution were first characterized by dynamic light scattering (DLS), nanoparticle tracking analysis (NTA), and circular dichroism (CD) spectroscopy. A non-monotonic correlation between ionic strength and protein aggregation was observed and attributed to colloidal agglomeration, while the primarily α-helical character of the protein in solution was maintained in all cases. Quartz crystal microbalance-dissipation (QCM-D) experiments were then conducted in order to track protein adsorption onto silica surfaces as a function of ionic strength, and the measurement responses indicated that total protein uptake at saturation coverage is lower with increasing ionic strength. In turn, the QCM-D data and the corresponding Voigt-Voinova model analysis support that the surface area per bound protein molecule is greater with increasing ionic strength. While higher protein uptake under lower ionic strengths by itself did not result in greater surface passivation under subsequent physiologically relevant conditions, the treatment of adsorbed protein layers with a gluteraldehyde cross-linking agent stabilized the bound protein in this case and significantly improved surface passivation. Collectively, our findings demonstrate that ionic strength modulation influences BSA adsorption uptake on account of protein spreading and can be utilized in conjunction with covalent cross-linking strategies to prepare well-coated protein adlayers for improved surface passivation.

Gas hydrate concentration estimated from P- and S-wave velocities

NASA Astrophysics Data System (ADS)

Carcione, J. M.; Gei, D.

2003-04-01

We estimate the concentration of gas hydrate at the Mallik 2L-38 research site, Mackenzie Delta, Canada, using P- and S-wave velocities obtained from well logging and vertical seismic profiles (VSP). The theoretical velocities are obtained from a poro-viscoelastic model based on a Biot-type approach. It considers the existence of two solids (grains and gas hydrate) and a fluid mixture and is based on the assumption that hydrate fills the pore space and shows interconnection. The moduli of the matrix formed by gas hydrate are obtained from the percolation model described by Leclaire et al., (1994). An empirical mixing law introduced by Brie et al., (1995) provides the effective bulk modulus of the fluid phase, giving Wood's modulus at low frequency and Voigt's modulus at high frequencies. The dry-rock moduli are estimated from the VSP profile where the rock is assumed to be fully saturated with water, and the quality factors are obtained from the velocity dispersion observed between the sonic and VSP velocities. Attenuation is described by using a constant-Q model for the dry rock moduli. The amount of dissipation is estimated from the difference between the seismic velocities and the sonic-log velocities. We estimate the amount of gas hydrate by fitting the sonic-log and seismic velocities to the theoretical velocities, using the concentration of gas hydrate as fitting parameter. We obtain hydrate concentrations up to 75 %, average values of 43 and 47 % from the VSP P- and S-wave velocities, respectively, and 47 and 42 % from the sonic-log P- and S-wave velocities, respectively. These averages are computed from 897 to 1110 m, excluding the zones where there is no gas hydrate. We found that modeling attenuation is important to obtain reliable results. largeReferences} begin{description} Brie, A., Pampuri, F., Marsala A.F., Meazza O., 1995, Shear Sonic Interpretation in Gas-Bearing Sands, SPE Annual Technical Conference and Exhibition, Dallas, 1995. Carcione, J.M. and Gei, D., Gas hydrate concentration estimated from P- and S-wave velocities at the Mallik 2L-38 research well, Mackenzie Delta, Canada, submitted to Geophysics. Gei, D. and Carcione, J.M., Acoustic properties of sediments saturated with gas hydrate, free gas and water, Geophysical Prospecting, in press. Leclarie, Ph., Cohen-Tenoudji, F., and Aguirre-Puente, J., 1994, Extension of Biot's theory of wave propagation to frozen porous media, J. Acoust. Soc. Am., 96, 6, 3753-3768.

First-principles investigation of thermodynamic, elastic and electronic properties of Al{sub 3}V and Al{sub 3}Nb intermetallics under pressures

DOE Office of Scientific and Technical Information (OSTI.GOV)

Chen, Zhe; Zhang, Peng; Chen, Dong

2015-02-28

The thermodynamic, elastic, and electronic properties of D0{sub 22}-type Al{sub 3}V and Al{sub 3}Nb intermetallics were studied using the first-principle method. The results showed the pressure has profound effects on the structural, mechanical and electronic properties in both Al{sub 3}V and Al{sub 3}Nb. Thermodynamically, the formation enthalpies for Al{sub 3}V and Al{sub 3}Nb were derived, which agreed well with available experimental and theoretical values. Comparably, Al{sub 3}Nb was a more stable phase with the more negative H{sub f} than Al{sub 3}V. Mechanically, the calculated elastic constants showed linearly increasing tendencies, and satisfied the Born's criteria from 0–20 GPa, indicating the mechanicallymore » stability of Al{sub 3}V and Al{sub 3}Nb under this pressure range. Further, the mechanical parameters (i.e., bulk modulus (B), shear modulus (G), and Young's modulus (E)) were derived using the Voigt-Reuss-Hill (VRH) method, and in good agreement with available experimental results at the ground state. All these parameters presented the linearly increasing dependences on the external pressure. The B/G ratios and Poisson's ratio indicated that the Al{sub 3}V and Al{sub 3}Nb crystals should exhibit brittle behavior at 0–20 GPa. Additionally, the bulk modulus can be obtained through fitting the Birch-Murnaghan equation (B{sub 0}), computing by VRH method (B{sub H}), and deriving from the elastic theory (B{sub relax}) in both intermetallics. The uniformity of these calculated bulk moduli in each compound exhibited the excellent reliability and self-consistency. In addition, Debye temperature was estimated from the average sound velocity. The Debye temperature showed an increasing dependence on the pressures. Finally, through density of states analysis, Al{sub 3}V and Al{sub 3}Nb were suggested to possess naturally metallic behavior. Under pressures, it was noted that the shapes of peaks and pseudogaps exhibited relative few changes, suggesting Al{sub 3}V and Al{sub 3}Nb has kept structurally stable up to 20 GPa. At zero pressure, Al{sub 3}Nb was considered as a more structurally stable phase with the more number of bonding electrons per atom than Al{sub 3}V. This conclusion was in consistent with the one drawn from the thermodynamic analysis.« less

Dynamic behavior of acoustic metamaterials and metaconfigured structures with local oscillators

NASA Astrophysics Data System (ADS)

Manimala, James Mathew

Dynamic behavior of acoustic metamaterials (AM) and metaconfigured structures (MCS) with various oscillator-type microstructures or local attachments was investigated. AM derive their unusual elastic wave manipulation capabilities not just from material constituents but more so from engineered microstructural configurations. Depending on the scale of implementation, these "microstructures" may be deployed as microscopic inclusions in metacomposites or even as complex endo-structures within load-bearing exo-structures in MCS. The frequency-dependent negative effective-mass exhibited by locally resonant microstructures when considered as a single degree of freedom system was experimentally verified using a structure with an internal mass-spring resonator. AM constructed by incorporating resonators in a host material display spatial attenuation of harmonic stress waves within a tunable bandgap frequency range. An apparent damping coefficient was derived to compare the degree of attenuation achieved in these wholly elastic AM to equivalent conventionally damped models illustrating their feasibility as stiff structures that simultaneously act as effective damping elements. Parametric studies were performed using simulations to design and construct MCS with attached resonators for dynamic load mitigation applications. 98% payload isolation at resonance (7 Hz) was experimentally attained using a low-frequency vibration isolator with tip-loaded cantilever beam resonators. Pendulum impact tests on a resonator stack substantiated a peak transmitted stress reduction of about 60% and filtering of the resonator frequencies in the transmitted spectrum. Drop-tower tests were done to gauge the shock mitigation performance of an AM-inspired infrastructural building-block with internal resonators. Proof-of-concept experiments using an array of multifunctional resonators demonstrate the possibility of integrating energy harvesting and transducer capabilities. Stress wave attenuation in locally dissipative AM with various damped oscillator microstructures was studied using mechanical lattice models. The presence of damping was represented by a complex effective-mass. Analytical transmissibilities and numerical verifications were obtained for Kelvin-Voigt-type, Maxwell-type and Zener-type oscillators. Although peak attenuation at resonance is diminished, broadband attenuation was found to be achievable without increasing mass ratio, obviating the bandgap width limitations of locally resonant AM. Static and frequency-dependent measures of optimal damping that maximize the attenuation characteristics were established. A transitional value for the excitation frequency was identified within the locally resonant bandgap, above which there always exists an optimal amount of damping that renders the attenuation for the dissipative AM greater than that for the locally resonant case. AM with nonlinear stiffnesses were also investigated. For a base-excited two degree of freedom system consisting of a master structure and a Duffing-type oscillator, approximate transmissibility was derived, verified using simulations and compared to its equivalent damped model. Analytical solutions for dispersion curve shifts in nonlinear chains with linear resonators and in linear chains with nonlinear oscillators were obtained using perturbation analysis and first order approximations for cubic hardening and softening cases. Amplitude-activated alterations in bandgap width and the possibility of phenomena such as branch curling and overtaking were observed. Device implications of nonlinear AM as amplitude-dependent filters and direction-biased waveguides were examined using simulations.

Atmospheric Sensitivity to Spectral Top-of-Atmosphere Solar Irradiance Perturbations, Using MODTRAN-5 Radiative Transfer Algorithm

NASA Astrophysics Data System (ADS)

Anderson, G.; Berk, A.; Harder, G.; Fontenla, J.; Shettle, E.; Pilewski, P.; Kindel, B.; Chetwynd, J.; Gardner, J.; Hoke, M.; Jordan, A.; Lockwood, R.; Felde, G.; Archarya, P.

2006-12-01

The opportunity to insert state-of-the-art solar irradiance measurements and calculations, with subtle perturbations, into a narrow spectral resolution radiative transfer model has recently been facilitated through release of MODTRAN-5 (MOD5). The new solar data are from: (1) SORCE satellite measurements of solar variability over solar rotation cycle, & (2) ultra-narrow calculation of a new solar source irradiance, extending over the full MOD5 spectral range, from 0.2 um to far-IR. MODTRAN-5, MODerate resolution radiance and TRANsmittance code, has been developed collaboratively by Air Force Research Laboratory and Spectral Sciences, Inc., with history dating back to LOWTRAN. It includes approximations for all local thermodynamic equilibrium terms associated with molecular, cloud, aerosol and surface components for emission, scattering, and reflectance, including multiple scattering, refraction and a statistical implementation of Correlated-k averaging. The band model is based on 0.1 cm-1 (also 1.0, 5.0 and 15.0 cm-1 statistical binning for line centers within the interval, captured through an exact formulation of the full Voigt line shape. Spectroscopic parameters are from HITRAN 2004 with user-defined options for additional gases. Recent validation studies show MOD5 replicates line-by-line brightness temperatures to within ~0.02ºK average and <1.0ºK RMS. MOD5 can then serve as a surrogate for a variety of perturbation studies, including the two modes for the solar source function, Io. (1) Data from the Solar Radiation and Climate Experiment (SORCE) satellite mission provide state-of-the-art measurements of UV, visible, near-IR, plus total solar radiation, on near real-time basis. These internally consistent estimates of Sun's output over solar rotation and longer time scales are valuable inputs for studying effects of Sun's radiation on Earth's atmosphere and climate. When solar rotation encounters bright plage and dark sunspots, relative variations are expected to be very small in visible wavelengths, although absolute power is substantial. SORCE's Spectral Irradiance Monitor measurements are readily included in comparative MOD5 calculations. (2) The embedded solar irradiance within MOD5 must be compatible with the chosen band model resolution binning. By matching resolutions some issues related to the correlated-k band model parameterizations can be tested. Two high resolution solar irradiances, the MOD5 default irradiance (Kurucz) and a new compilation associated with Solar Radiation Physical Modeling project (Fontenla), are compared to address the potential impact of discrepancies between any sets of irradiances. The magnitude of solar variability, as measured and calculated, can lead to subtle changes in heating/cooling rates throughout the atmosphere, as a function of altitude and wavelength. By holding chemical & dynamical responses constant, only controlled distributions of absorbing gases, aerosols and clouds will contribute to observed 1st order radiative effects.

Line shape parameters of PH3 transitions in the Pentad near 4-5 μm: Self-broadened widths, shifts, line mixing and speed dependence

NASA Astrophysics Data System (ADS)

Malathy Devi, V.; Benner, D. Chris; Kleiner, Isabelle; Sams, Robert L.; Fletcher, Leigh N.

2014-08-01

Accurate knowledge of spectroscopic line parameters of PH3 is important for remote sensing of the outer planets, especially Jupiter and Saturn. In a recent study, line positions and intensities for the Pentad bands of PH3 have been reported from analysis of high-resolution, high signal-to noise room-temperature spectra recorded with two Fourier transform spectrometers (2014) [1]. The results presented in this study were obtained during the analysis of positions and intensities, but here we focus on the measurements of spectral line shapes (e.g. widths, shifts, line mixing) for the 2ν4, ν2 + ν4, ν1 and ν3 bands. A multispectrum nonlinear least squares curve fitting technique employing a non-Voigt line shape to include line mixing and speed dependence of the Lorentz width was employed to fit the spectra simultaneously. The least squares fittings were performed on five room-temperature spectra recorded at various PH3 pressures (∼2-50 Torr) with the Bruker IFS-125HR Fourier transform spectrometer (FTS) located at the Pacific Northwest National Laboratory (PNNL), in Richland, Washington. Over 840 Lorentz self-broadened half-width coefficients, 620 self-shift coefficients and 185 speed dependence parameters were measured. Line mixing was detected for transitions in the 2ν4, ν1 and ν3 bands, and their values were quantified for 10 A+A- pairs of transitions via off-diagonal relaxation matrix element formalism. The dependences of the measured half-width coefficients on the J and K rotational quanta of the transitions are discussed. The self-width coefficients for the ν1 and ν3 bands from this study are compared to the self-width coefficients for transitions with the same rotational quanta (J, K) reported for the Dyad (ν2 and ν4) bands. The measurements from present study should be useful for the development of a reliable theoretical modeling of pressure-broadened widths, shifts and line mixing in symmetric top molecules with C3v symmetry in general, and of PH3 in particular.

ASYMMETRIC ABSORPTION PROFILES OF Ly{alpha} AND Ly{beta} IN DAMPED Ly{alpha} SYSTEMS

DOE Office of Scientific and Technical Information (OSTI.GOV)

Lee, Hee-Won, E-mail: hwlee@sejong.ac.kr

2013-08-01

Damped Ly{alpha} systems observed in the quasar spectra are characterized by a high neutral hydrogen column density, N{sub HI} > 2 x 10{sup 20} cm{sup -2}. The absorption wing profiles are often fitted using the Voigt function due to the fact that the scattering cross section near the resonant line center is approximately described by the Lorentzian function. Since a hydrogen atom has infinitely many p states that participate in the electric dipole interaction, the cross section starts to deviate from the Lorentzian in an asymmetric way in the line wing regions. We investigate this asymmetry in the absorption linemore » profiles around Ly{alpha} and Ly{beta} as a function of the neutral hydrogen column density N{sub HI}. In terms of {Delta}{lambda} {identical_to} {lambda} - {lambda}{sub {alpha}}, we expand the Kramers-Heisenberg formula around Ly{alpha} to find {sigma}({lambda}) {approx_equal} (0.5f{sub 12}){sup 2}{sigma}{sub T}({Delta}{lambda}/{lambda}{sub {alpha}}){sup -2}[1 + 3.792({Delta}{lambda}/{lambda}{sub {alpha}})], where f{sub 12} and {sigma}{sub T} are the oscillator strength of Ly{alpha} and the Thomson scattering cross section, respectively. In terms of {Delta}{lambda}{sub 2} {identical_to} {lambda} - {lambda}{sub {beta}} in the vicinity of Ly{beta}, the total scattering cross section, given as the sum of cross sections for Rayleigh and Raman scattering, is shown to be {sigma}({lambda}) {approx_equal} {sigma}{sub T}(0.5f{sub 13}){sup 2}(1 + R{sub 0})({Delta}{lambda}{sub 2}/{lambda}{sub {beta}}){sup -2}[1 - 24.68({Delta}{lambda}{sub 2}/{lambda}{sub {beta}})] with f{sub 13} and the factor R{sub 0} = 0.1342 being the oscillator strength for Ly{beta} and the ratio of the Raman cross section to Rayleigh cross section, respectively. A redward asymmetry develops around Ly{alpha}, whereas a blue asymmetry is obtained for Ly{beta}. The absorption center shifts are found to be almost proportional to the neutral hydrogen column density.« less

Line shape parameters of PH 3 transitions in the Pentad near 4–5 μm: Self-broadened widths, shifts, line mixing and speed dependence

DOE Office of Scientific and Technical Information (OSTI.GOV)

Malathy Devi, V.; Benner, D. C.; Kleiner, Isabelle

2014-08-01

Accurate knowledge of spectroscopic line parameters of PH 3 is important for remote sensing of the outer planets, especially Jupiter and Saturn. In a recent study, line positions and intensities for the Pentad bands of PH 3 have been reported from analysis of high-resolution, high signal-to noise room-temperature spectra recorded with two Fourier transform spectrometers (2014) [1]. The results presented in this study were obtained during the analysis of positions and intensities, but here we focus on the measurements of spectral line shapes (e.g. widths, shifts, line mixing) for the 2ν 4, ν 2 + ν 4, ν 1 andmore » ν 3 bands. A multispectrum nonlinear least squares curve fitting technique employing a non-Voigt line shape to include line mixing and speed dependence of the Lorentz width was employed to fit the spectra simultaneously. The least squares fittings were performed on five room-temperature spectra recorded at various PH 3 pressures (~2–50 Torr) with the Bruker IFS-125HR Fourier transform spectrometer (FTS) located at the Pacific Northwest National Laboratory (PNNL), in Richland, Washington. Over 840 Lorentz self-broadened half-width coefficients, 620 self-shift coefficients and 185 speed dependence parameters were measured. Line mixing was detected for transitions in the 2ν 4, ν 1 and ν 3 bands, and their values were quantified for 10 A+A- pairs of transitions via off-diagonal relaxation matrix element formalism. The dependences of the measured half-width coefficients on the J and K rotational quanta of the transitions are discussed. The self-width coefficients for the ν 1 and ν 3 bands from this study are compared to the self-width coefficients for transitions with the same rotational quanta (J, K) reported for the Dyad (ν 2 and ν 4) bands. The measurements from present study should be useful for the development of a reliable theoretical modeling of pressure-broadened widths, shifts and line mixing in symmetric top molecules with C 3v symmetry in general, and of PH 3 in particular.« less

CO2-, He- and H2-broadening coefficients of SO2 for ν1 band and ground state transitions for astrophysical applications

NASA Astrophysics Data System (ADS)

Ceselin, Giorgia; Tasinato, Nicola; Puzzarini, Cristina; Pietropolli Charmet, Andrea; Stoppa, Paolo; Giorgianni, Santi

2017-12-01

The discovery of the Universe and of the interstellar medium (ISM) is based on the knowledge of the molecules that are present in those places. Most of our understanding about the composition of the ISM and planetary atmospheres has been made possible almost entirely thanks to spectroscopic observations. Sulfur dioxide, SO2, is one of the about 200 molecules that have been detected in the ISM or circumstellar shells. In addition to its astrophysical relevance, SO2 has a proved role in the Earth's atmosphere. It origins from biomass burning and volcanic eruptions and directly enters in the sulfur cycle. In this work high-resolution tunable diode laser (TDL) infrared (IR) spectroscopy and mm-/sub-mm wave spectroscopy are exploited to retrieve the broadening parameters of sulfur dioxide perturbed by H2, He and CO2. IR measurements are carried out for ν1 band transitions around 9 μm by using He and CO2 as damping gases. As far as the vibrational ground state is concerned, about 20 rotational transitions are analyzed by means of the speed dependent Voigt profile to retrieve H2- and He-broadening coefficients. From the experimental results some conclusions about the quantum number dependence of the H2-, CO2- and He-collisional cross sections are drawn. Both IR and MW experiments highlight a very weak dependence of He broadening parameters on the Ka and J rotational quantum numbers. In a similar way, also SO2-H2 broadening coefficients show a negligible dependence on the rotational quantum numbers. Conversely, when CO2 is employed as perturbing species, the observed collisional cross sections tend to decrease with increasing Ka values and to increase against J, at least over the range of quantum numbers considered. The present results provide the first systematic determination of line-by-line SO2-CO2 broadening coefficients and they are of relevance to increase the potential use of spectroscopic databases for astronomical applications.

Properties of QSO Metal-line Absorption Systems at High Redshifts: Nature and Evolution of the Absorbers and New Evidence on Escape of Ionizing Radiation from Galaxies

NASA Astrophysics Data System (ADS)

Boksenberg, Alec; Sargent, Wallace L. W.

2015-05-01

Using Voigt-profile-fitting procedures on Keck High Resolution Spectrograph spectra of nine QSOs, we identify 1099 C IV absorber components clumped in 201 systems outside the Lyman forest over 1.6 <~ z <~ 4.4. With associated Si IV, C II, Si II and N V where available, we investigate the bulk statistical and ionization properties of the components and systems and find no significant change in redshift for C IV and Si IV while C II, Si II and N V change substantially. The C IV components exhibit strong clustering, but no clustering is detected for systems on scales from 150 km s-1 out to 50,000 km s-1. We conclude that the clustering is due entirely to the peculiar velocities of gas present in the circumgalactic media of galaxies. Using specific combinations of ionic ratios, we compare our observations with model ionization predictions for absorbers exposed to the metagalactic ionizing radiation background augmented by proximity radiation from their associated galaxies and find that the generally accepted means of radiative escape by transparent channels from the internal star-forming sites is spectrally not viable for our stronger absorbers. We develop an active scenario based on runaway stars with resulting changes in the efflux of radiation that naturally enable the needed spectral convergence, and in turn provide empirical indicators of morphological evolution in the associated galaxies. Together with a coexisting population of relatively compact galaxies indicated by the weaker absorbers in our sample, the collective escape of radiation is sufficient to maintain the intergalactic medium ionized over the full range 1.9 < z <~ 4.4. The data presented herein were obtained at the W. M. Keck Observatory, which is operated as a scientific partnership among the California Institute of Technology, the University of California, and the National Aeronautics and Space Administration. The Observatory was made possible by the generous financial support of the W. M. Keck Foundation.

THE COLUMN DENSITY DISTRIBUTION AND CONTINUUM OPACITY OF THE INTERGALACTIC AND CIRCUMGALACTIC MEDIUM AT REDSHIFT (z) = 2.4

DOE Office of Scientific and Technical Information (OSTI.GOV)

Rudie, Gwen C.; Steidel, Charles C.; Shapley, Alice E.

2013-06-01

We present new high-precision measurements of the opacity of the intergalactic and circumgalactic medium (IGM; CGM) at (z) = 2.4. Using Voigt profile fits to the full Ly{alpha} and Ly{beta} forests in 15 high-resolution high-S/N spectra of hyperluminous QSOs, we make the first statistically robust measurement of the frequency of absorbers with H I column densities 14{approx}< log (N{sub H{sub I}}/cm{sup -2}){approx}<17.2. We also present the first measurements of the frequency distribution of H I absorbers in the volume surrounding high-z galaxies (the CGM, 300 pkpc), finding that the incidence of absorbers in the CGM is much higher than inmore » the IGM. In agreement with Rudie et al., we find that there are fractionally more high-N{sub H{sub I}} absorbers than low-N{sub H{sub I}} absorbers in the CGM compared to the IGM, leading to a shallower power law fit to the CGM frequency distribution. We use these new measurements to calculate the total opacity of the IGM and CGM to hydrogen-ionizing photons, finding significantly higher opacity than most previous studies, especially from absorbers with log (N{sub H{sub I}}/cm{sup -2}) < 17.2. Reproducing the opacity measured in our data as well as the incidence of absorbers with log (N{sub H{sub I}}/cm{sup -2})>17.2 requires a broken power law parameterization of the frequency distribution with a break near N{sub H{sub I}} Almost-Equal-To 10{sup 15} cm{sup -2}. We compute new estimates of the mean free path ({lambda}{sub mfp}) to hydrogen-ionizing photons at z{sub em} = 2.4, finding {lambda}{sub mfp} = 147 {+-} 15 Mpc when considering only IGM opacity. If instead, we consider photons emanating from a high-z star-forming galaxy and account for the local excess opacity due to the surrounding CGM of the galaxy itself, the mean free path is reduced to {lambda}{sub mfp} = 121 {+-} 15 Mpc. These {lambda}{sub mfp} measurements are smaller than recent estimates and should inform future studies of the metagalactic UV background and of ionizing sources at z Almost-Equal-To 2-3.« less

Seismic anisotropy in the lower crust: The link between rock composition, microstructure, texture and seismic properties.

NASA Astrophysics Data System (ADS)

Czaplinska, Daria; Piazolo, Sandra; Almqvist, Bjarne

2015-04-01

Seismic anisotropy observed in Earth's interior is caused by the presence of aligned anisotropic minerals (crystallographic and shape preferred orientation; CPO and SPO respectively), and fluid and/or melt inclusions related to deformation. Therefore, the variations in seismic anisotropy carry valuable information about the structure of the mantle and crust. For example, anisotropy observed in the upper mantle is mainly attributed to the CPO of olivine, and provides strong evidence for the flow within the upper mantle. Seismic anisotropy in the crust is still poorly constrained, mostly due to the much larger heterogeneity of the crustal rocks in comparison with the more homogenous mantle. Anisotropy in the crust will be affected by the variations in rock composition, microstructure, texture (presence or lack of CPO), brittle structures (e.g. fracture systems) and chemical composition of the minerals. However, once the relationships between those variables and seismic properties of the crustal rocks are established, seismic anisotropy can be used to derive characteristics of rocks otherwise out of reach. Our study focuses on two sets of samples of middle to lower crustal rocks collected in Fiordland (New Zealand) and in Sweden. Samples from Fiordland represent a root of a thick (ca. 80 km) magmatic arc and comprise igneous rocks, which crystallized at high P and T conditions and were subsequently metamorphosed and deformed. Samples from Sweden are derived from a metasedimentary nappe in the Caledonian orogenic belt, which is mostly composed of gneisses, amphibolites and calc-silicates that have experienced different amounts of strain. We use large area EBSD mapping to measure the CPO of the constituent phases and record the geometric relationships of the rock microstructure. Data is then used to calculate the elastic properties of the rock from single-crystal stiffnesses. Here, we utilize the EBSD GUI software (Cook et al., 2013), which offers varied homogenization techniques, including Voigt, Reuss, Hill, geometric mean and self-consistent and Asymptotic Expansion Homogenization (AEH) methods. To test the advantages and disadvantages of the method, results are compared to measured geophysical properties of equivalent rocks. Such comparison, allows refinement of seismic data interpretation for mid to lower crustal rocks. References: Cook, A., Vel., S., Johnson, S.E., Gerbi, C., Song, W.J., 2013. Elastic and Seismic Properties (ESP) Toolbox (beta version); http://umaine.edu/mecheng/faculty-and-staff/senthil-vel/software/ESP_Toolbox/

HITRAN2016 Database Part II: Overview of the Spectroscopic Parameters of the Trace Gases

NASA Astrophysics Data System (ADS)

Tan, Yan; Gordon, Iouli E.; Rothman, Laurence S.; Kochanov, Roman V.; Hill, Christian

2017-06-01

The 2016 edition of HITRAN database is available now. This new edition of the database takes advantage of the new structure and can be accessed through HITRANonline (www.hitran.org). The line-by-line lists for almost all of the trace atmospheric species were updated in comparison with the previous edition HITRAN2012. These extended update covers not only updating few transitions of the certain molecules, but also complete replacements of the whole line lists, and as well as introduction of new spectroscopic parameters for non-Voigt line shape. The new line lists for NH_3, HNO_3, OCS, HCN, CH_3Cl, C_2H_2, C_2H_6, PH_3, C_2H_4, CH_3CN, CF_4, C_4H_2, and SO_3 feature substantial expansion of the spectral and dynamic ranges in addition of the improved accuracy of the parameters for already existing lines. A semi-empirical procedure was developed to update the air-broadening and self-broadening coefficients of N_2O, SO_2, NH_3, CH_3Cl, H_2S, and HO_2. We draw particular attention to flaws in the commonly used expression n_{air}=0.79n_{N_2}+0.21n_{O_2} to determine the air-broadening temperature dependence exponent in the power law from those for nitrogen and oxygen broadening. A more meaningful approach will be presented. The semi-empirical line width, pressure shifts and temperature-dependence exponents of CO, NH_3, HF, HCl, OCS, C_2H_2, SO_2 perturbed by H_2, He, and CO_2 have been added to the database based on the algorithm described in Wilzewski et al.. The new spectroscopic parameters for HT profile were implemented into the database for hydrogen molecule. The HITRAN database is supported by the NASA AURA program grant NNX14AI55G and NASA PDART grant NNX16AG51G. I. E. Gordon, L. S. Rothman, et al., J Quant Spectrosc Radiat Transf 2017; submitted. Hill C, et al., J Quant Spectrosc Radiat Transf 2013;130:51-61. Wilzewski JS,et al., J Quant Spectrosc Radiat Transf 2016;168:193-206. Wcislo P, et al., J Quant Spectrosc Radiat Transf 2016;177:75-91.

Modulation of Intraplate Deformation in Arizona due to Far-Reaching Postseismic Relaxation Following Plate Boundary Earthquakes

NASA Astrophysics Data System (ADS)

Kreemer, C.; Broermann, J.; Bennett, R. A.; Blewitt, G.

2016-12-01

The Basin and Range of southern Arizona is mostly devoid of active faults and seismicity, although M7+ earthquakes are known to have occurred in the Quaternary. Before the 2010 Mw=7.2 El-Mayor Cucapah (EMC) earthquake, we found from GPS data 2 mm/yr of extension across this region. After the EMC, we find that the extension across southern Arizona has been reduced to near-zero; this is part of a widespread change in the region's post-EMC deformation field that can be explained by viscoelastic relaxation of the lower crust and upper mantle. If the relaxation after the EMC is so wide-spread, similar affects must have occurred after other previous large earthquakes such that the deformation field is probably ever-changing, slowly. This transient deformation field obscures any long-term deformation and makes it difficult to assess the driving forces responsible for the deformation. To model the transient deformation we consider that the observed GPS-time-series record postseismic relaxation from the most recent large earthquakes: 1992 Landers, 1999 Hector Mine, 2009 Gulf of California, 2010 EMC, and 2012 Gulf of California. The postseismic model assumes an elastic upper crust to a depth of 15 km, a Maxwell visco-elastic lower crust at 15-30 km, a Burger's body rheology for the lithospheric mantle at 30-60 km, and an asthenosphere below 60 km. A best fitting viscosity was found by a random search over the parameter space of the three viscous layers and minimizing the misfit between the corrected time series and a least squares model that includes intercept, velocity, offsets at times of earthquakes and equipment offsets and annual and semi-annual terms. The overall best fitting viscosity for the lower crust 1019.9 Pa-s, lithospheric mantle 1019.6 Pa-s, and asthenospheric mantle 1018.8 Pa-s. Both the mantle viscosities are treated as Burger rheologies with a Kelvin Voigt element 1/10 of the Maxwell element. These viscosities predict very small present-day velocity gradients associated with relaxation from pre-1992 events. We will use the corrected GPS velocity field to explore the driving sources behind the velocity field; i.e., plate motion and spatial variation in gravitational potential energy.

Comparative planetary nitrogen atmospheres: Density and thermal structures of Pluto and Triton

NASA Astrophysics Data System (ADS)

Strobel, Darrell F.; Zhu, Xun

2017-07-01

Both atmospheres of Pluto and Neptune's largest satellite Triton have cold surfaces with surface gravitational accelerations and atmospheric surface pressures of comparable magnitude. To study their atmospheres we have updated Zhu et al. (2014) model for Pluto's atmosphere by adopting Voigt line profiles in the radiation module with the latest spectral database and extended the model to Triton's atmosphere by including additional parameterized heating due to the magnetospheric electron transport and energy deposition. The CH4 mixing ratio profiles play central roles in differentiating the atmospheres of Pluto and Triton. On Pluto the surface CH4 mole fraction is in the range of 0.3-0.8%, sufficiently high to ensure that it is well mixed in the lower atmosphere and not subject to photochemical destruction. Near the exobase CH4 attains comparable density to N2 due to gravitational diffusive separation and escapes at 500 times the N2 rate (= 1 × 1023 N2 s-1). In Triton's atmosphere, the surface CH4 mole fraction is on the order of 0.015%, sufficiently low to ensure that it is photochemically destroyed irreversibly in the lower atmosphere and that N2 remains the major species, even at the exobase. With solar EUV power only, Triton's upper thermosphere is too cold and magnetospheric heating, approximately comparable to the solar EUV power, is needed to bring the N2 tangential column number density in the 500-800 km range up to values derived from the Voyager 2 UVS observations (Broadfoot et al., 1989). Due to their cold exobase temperatures relative to the gravitational potential energy wells that N2 resides in, atmospheric escape from Triton and Pluto is not dominated by N2 Jeans escape but by CH4 from Pluto and H, C, N and H2 from Triton. The atmospheric thermal structure near the exobase is sensitive to the atmospheric escape rate only when it is significantly greater than 2 × 1027 amu s-1, above which enhanced Jeans escape and larger radial velocity adiabatically cools the atmosphere to a lower temperature. Finally we suggest that Pluto's thermosphere is a cold ∼ 70 K due to ablation of H2O molecules from the influx of dust grains detected by New Horizons Student Dust Counter.

Highlights of the HITRAN2016 database

NASA Astrophysics Data System (ADS)

Gordon, I.; Rothman, L. S.; Hill, C.; Kochanov, R. V.; Tan, Y.

2016-12-01

The HITRAN2016 database will be released just before the AGU meeting. It is a titanic effort of world-wide collaboration between experimentalists, theoreticians and atmospheric scientists, who measure, calculate and validate the HITRAN data. The line-by-line lists for almost all of the HITRAN molecules were updated in comparison with the previous compilation HITRAN2012 [1] that has been in use, along with some intermediate updates, since 2012. The extent of the updates ranges from updating a few lines of certain molecules to complete replacements of the lists and introduction of additional isotopologues. Many more vibrational bands were added to the database, extending the spectral coverage and completeness of the datasets. For several molecules, including H2O, CO2 and CH4, the extent of the updates is so complex that separate task groups were assembled to make strategic decisions about the choices of sources for various parameters in different spectral regions. The amount of parameters has also been significantly increased, now incorporating, for instance, non-Voigt line profiles [2]; broadening by gases other than air and "self" [3]; and other phenomena, including line mixing. In addition, the amount of cross-sectional sets in the database has increased dramatically and includes many recent experiments as well as adaptation of the existing databases that were not in HITRAN previously (for instance the PNNL database [4]). The HITRAN2016 edition takes full advantage of the new structure and interface available at www.hitran.org [5] and the HITRAN Application Programming Interface [6]. This poster will provide a summary of the updates, emphasizing details of some of the most important or dramatic improvements. The users of the database will have an opportunity to discuss the updates relevant to their research and request a demonstration on how to work with the database. This work is supported by the NASA PATM (NNX13AI59G), PDART (NNX16AG51G) and AURA (NNX14AI55G) programs. References[1] L.S. Rothman et al, JQSRT 130, 4 (2013). [2] P. Wcisło et al., JQSRT 177, 75 (2016). [3] J. S. Wilzewski et al., JQSRT 168, 193 (2016). [4] S.W. Sharpe et al, Appl Spectrosc 58, 1452 (2004). [5] C. Hill et al, JQSRT 177, 4 (2016). [6] R.V. Kochanov et al, JQSRT 177, 15 (2016).

3-D Anisotropic Ambient Noise Tomography of Piton De La Fournaise Volcano (La Réunion Island)

NASA Astrophysics Data System (ADS)

Mordret, A.; Rivet, D. N.; Landes, M.; Shapiro, N.

2014-12-01

We cross-correlate four years of seismic noise continuously recorded by the seismic monitoring network of the Piton de la Fournaise volcano (La Réunion Island). The network is composed of 40 stations 27 of which have 3-component sensors. We use Vertical-to-Vertical (ZZ) cross-correlation components from all stations and Radial-to-Radial (RR) and Transverse-to-Transverse (TT) cross-correlations computed from 3-component records. The group velocity dispersion curves for Rayleigh and Love waves are measured using a Frequency-Time Analysis. We average measurements from ZZ and RR components to finally obtain 577 Rayleigh-wave dispersion curves. 395 Love-wave dispersion curves are obtained from the TT cross-correlations. We then regionalize the group velocities measurements to construct 2D dispersion maps at a set of periods between 0.4 and 8 s. Finally, we construct a 3D shear-velocity model down to 3 km below the sea level by jointly inverting the Rayleigh and Love wave group velocity maps with a Neighborhood Algorithm and with taking into account the radial anisotropy. The distribution of 3-D Voigt averaged S-wave velocities shows three distinct high-velocity anomalies surrounded by a low-velocity ring. The most western high-velocity anomaly is located below the actual "Plaine des Sables" and could be attributed to an old intrusive body at the location of the former volcanic center before it migrated toward its present location. The second high-velocity body is located below the summit of the volcano and likely corresponds to the actual preferential dyke intrusion zone as highlighted by the seismicity. The third high-velocity anomaly is located below the "Grandes Pentes" and the "Grand Brûlé" areas and is thought to be an imprint of the solidified magma chamber of the ancient dismantled "Les Alizé" volcano. The distribution of the radial anisotropy shows two main anomalies: a positive anisotropy (Vsh>Vsv) above sea level highlighting the recent edifice of Piton de la Fournaise with an accumulation of mostly horizontal lava flows, and the second one below the sea level with a negative anisotropy (Vsv>Vsh) showing the ancient edifice of the Piton de la Fournaise dominated by intrusions of vertical dykes.

Stable isotopes suggest differences in diet between historic and reintroduced Przewalskís horses in the Gobi desert

NASA Astrophysics Data System (ADS)

Burnik Šturm, Martina; Spasskaya, Natalia N.; Sablin, Mikhail V.; Voigt, Christian C.; Kaczensky, Petra

2016-04-01

In historic times, two wild equid species, the Przewalski᾽s horse (PH; Equus ferus przewalskii) and the Asiatic wild ass (khulan, KH; Equus hemionus), roamed the Eurasian steppes. By the end of the 1960s, PHs had been driven to extinction in the wild and the range of KHs became severely restricted to the least productive habitats. However, PHs survived in captivity and reintroductions since the 1990s have brought the species back to parts of its native range in Mongolia and northern China where they again overlap with KHs. Ecological research on PHs and KHs has increased in recent years, but very little information is available on the ecology of the original PHs prior to extinction in the wild. We applied stable isotope analysis (13C, 15N, and 2H) of segmentally cut tail hair of PHs and KHs, collected during expeditions in NW China and SW Mongolia in 1889-1899, to draw inferences about the species feeding ecology. We compared tail hair isotope patterns of historic individuals to those of their extant counterparts from the Mongolian Gobi. A previous study of isotopic tail hair signatures of extant PHs (N=6) and KHs (N=6) suggested species specific differences in diet, with PHs being year-round grazers, but KHs switching between being grazers in summer and mixed feeders in winter (Burnik Šturm et al., in prep.). The comparison of isotope patterns of extant with historic samples confirms diet seasonality in historic KHs (N=3), but detects the same seasonality in five out of six PHs, suggesting that historic PHs had a different isotopic dietary niche than extant PHs. While we are still unable to fully understand the underlying reasons for this change in PHs, our results clearly suggest that the isotopic dietary niche of PHs was wider in the past, suggesting a higher diet flexibility, and overlapped with that of KHs, suggesting a high competition potential over Gobi pastures between the two equid species in historic times. Reference: Burnik Šturm, M., Ganbaatar, O., Voigt, C.C., Kaczensky, P. Stable isotopes reveal differences in the feeding ecology of three sympatric equid species in Dzungarian Gobi, Mongolia (in prep.)

Mechanical, Thermodynamic and Electronic Properties of Wurtzite and Zinc-Blende GaN Crystals.

PubMed

Qin, Hongbo; Luan, Xinghe; Feng, Chuang; Yang, Daoguo; Zhang, Guoqi

2017-12-12

For the limitation of experimental methods in crystal characterization, in this study, the mechanical, thermodynamic and electronic properties of wurtzite and zinc-blende GaN crystals were investigated by first-principles calculations based on density functional theory. Firstly, bulk moduli, shear moduli, elastic moduli and Poisson's ratios of the two GaN polycrystals were calculated using Voigt and Hill approximations, and the results show wurtzite GaN has larger shear and elastic moduli and exhibits more obvious brittleness. Moreover, both wurtzite and zinc-blende GaN monocrystals present obvious mechanical anisotropic behavior. For wurtzite GaN monocrystal, the maximum and minimum elastic moduli are located at orientations [001] and <111>, respectively, while they are in the orientations <111> and <100> for zinc-blende GaN monocrystal, respectively. Compared to the elastic modulus, the shear moduli of the two GaN monocrystals have completely opposite direction dependences. However, different from elastic and shear moduli, the bulk moduli of the two monocrystals are nearly isotropic, especially for the zinc-blende GaN. Besides, in the wurtzite GaN, Poisson's ratios at the planes containing [001] axis are anisotropic, and the maximum value is 0.31 which is located at the directions vertical to [001] axis. For zinc-blende GaN, Poisson's ratios at planes (100) and (111) are isotropic, while the Poisson's ratio at plane (110) exhibits dramatically anisotropic phenomenon. Additionally, the calculated Debye temperatures of wurtzite and zinc-blende GaN are 641.8 and 620.2 K, respectively. At 300 K, the calculated heat capacities of wurtzite and zinc-blende are 33.6 and 33.5 J mol -1 K -1 , respectively. Finally, the band gap is located at the G point for the two crystals, and the band gaps of wurtzite and zinc-blende GaN are 3.62 eV and 3.06 eV, respectively. At the G point, the lowest energy of conduction band in the wurtzite GaN is larger, resulting in a wider band gap. Densities of states in the orbital hybridization between Ga and N atoms of wurtzite GaN are much higher, indicating more electrons participate in forming Ga-N ionic bonds in the wurtzite GaN.

High covalence in CuSO4 and the radicalization of sulfate: an X-ray absorption and density functional study.

PubMed

Szilagyi, Robert K; Frank, Patrick; DeBeer George, Serena; Hedman, Britt; Hodgson, Keith O

2004-12-27

Sulfur K-edge X-ray absorption spectroscopy (XAS) of anhydrous CuSO(4) reveals a well-resolved preedge transition feature at 2478.8 eV that has no counterpart in the XAS spectra of anhydrous ZnSO(4) or copper sulfate pentahydrate. Similar but weaker preedge features occur in the sulfur K-edge XAS spectra of [Cu(itao)SO(4)] (2478.4 eV) and [Cu[(CH(3))(6)tren]SO(4)] (2477.7 eV). Preedge features in the XAS spectra of transition metal ligands are generally attributed to covalent delocalization of a metal d-orbital hole into a ligand-based orbital. Copper L-edge XAS of CuSO(4) revealed that 56% of the Cu(II) 3d hole is delocalized onto the sulfate ligand. Hybrid density functional calculations on the two most realistic models of the covalent delocalization pathways in CuSO(4) indicate about 50% electron delocalization onto the sulfate oxygen-based 2p orbitals; however, at most 14% of that can be found on sulfate sulfur. Both experimental and computational results indicated that the high covalence of anhydrous CuSO(4) has made sulfate more like the radical monoanion, inducing an extensive mixing and redistribution of sulfur 3p-based unoccupied orbitals to lower energy in comparison to sulfate in ZnSO(4). It is this redistribution, rather than a direct covalent interaction between Cu(II) and sulfur, that is the origin of the observed sulfur XAS preedge feature. From pseudo-Voigt fits to the CuSO(4) sulfur K-edge XAS spectrum, a ground-state 3p character of 6% was quantified for the orbital contributing to the preedge transition, in reasonable agreement with the DFT calculation. Similar XAS fits indicated 2% sulfur 3p character for the preedge transition orbitals in [Cu(itao)SO(4)] and [Cu[(CH(3))(6)tren]SO(4)]. The covalent radicalization of ligands similar to sulfate, with consequent energy redistribution of the virtual orbitals, represents a new mechanism for the induction of ligand preedge XAS features. The high covalence of the Cu sites in CuSO(4) was found to be similar to that of Cu sites in oxidized cupredoxins, including its anistropic nature, and can serve as the simplest inorganic examples of intramolecular electron-transfer processes.

New spectroscopy in the HITRAN2016 database and its impact on atmospheric retrievals

NASA Astrophysics Data System (ADS)

Gordon, I.; Rothman, L. S.; Kochanov, R. V.; Tan, Y.; Toon, G. C.

2017-12-01

The HITRAN spectroscopic database is a backbone of the interpretation of spectral atmospheric retrievals and is an important input to the radiative transfer codes. The database is serving the atmospheric community for nearly half-a-century with every new edition being released every four years. The most recent release of the database is HITRAN2016 [1]. It consists of line-by-line lists, experimental absorption cross-sections, collision-induced absorption data and aerosol indices of refraction. In this presentation it will be stressed the importance of using the most recent edition of the database in the radiative transfer codes. The line-by-line lists for most of the HITRAN molecules were updated (and two new molecules added) in comparison with the previous compilation HITRAN2012 [2] that has been in use, along with some intermediate updates, since 2012. The extent of the updates ranges from updating a few lines of certain molecules to complete replacements of the lists and introduction of additional isotopologues. In addition, the amount of molecules in cross-sectional part of the database has increased dramatically from nearly 50 to over 300. The molecules covered by the HITRAN database are important in planetary remote sensing, environment monitoring (in particular, biomass burning detection), climate applications, industrial pollution tracking, atrophysics, and more. Taking advantage of the new structure and interface available at www.hitran.org [3] and the HITRAN Application Programming Interface [4] the amount of parameters has also been significantly increased, now incorporating, for instance, non-Voigt line profiles [5]; broadening by gases other than air and "self" [6]; and other phenomena, including line mixing. This is a very important novelty that needs to be properly introduced in the radiative transfer codes in order to advance accurate interpretation of the remote sensing retrievals. This work is supported by the NASA PDART (NNX16AG51G) and AURA (NNX 17AI78G) programs. References[1] I.E. Gordon et al, JQSRT in press (2017) http://doi.org/10.1016/j.jqsrt.2017.06.038. [2] L.S. Rothman et al, JQSRT 130, 4 (2013). [3] C. Hill et al, JQSRT 177, 4 (2016). [4] R.V. Kochanov et al, JQSRT 177, 15 (2016). [5] P. Wcisło et al., JQSRT 177, 75 (2016). [6] J. S. Wilzewski et al., JQSRT 168, 193 (2016).

Radiative transfer modeling for analyses with Akatsuki/IR2 images

NASA Astrophysics Data System (ADS)

Sato, Takao M.; Satoh, Takehiko; Hashimoto, George L.; Lee, Yeon Joo; Sagawa, Hideo; Kasaba, Yasumasa

2017-10-01

The 2-micron camera (IR2) onboard Japanese Venus orbiter, Akatsuki had regularly observed Venus with four narrow-band filters (1.735, 2.02, 2.26, and 2.32 micron) from the late of March, 2016 until the electronic device was unable to control IR2 on December 9, 2016. For approximately nine months, we accumulated more than 3,000 dayside and nightside images of Venus. The main purposes of analyzing IR2 data are (i) to study the dynamics in the upper, middle, and lower atmosphere with the cloud-tracked winds, (ii) to derive the cloud top altitude with the 2.02 micron channel which is located in a CO2 absorption band, (iii) to deduce CO distribution, which is thought to be a good tracer of the atmospheric circulation below the massive clouds, by utilizing the 2.26 and 2.32 micron channels, and (iv) to investigate aerosol properties of the lower clouds with the 1.735 and 2.26 micron channels. For purposes (ii)-(iv), we have developed a line-by-line based radiative transfer model for generating synthetic radiance at the IR2 channels. For both solar and thermal radiation cases, adding doubling method (Hovenier et al., 2004; Liu and Weng, 2006) is selected for solving multiple scattering by clouds and molecules. We considered a total of eight molecules (H2O, CO2, CO, SO2, HF, HCl, OCS, and N2) and line parameters of the first three molecules are taken from HITEMP10 and those of the others are from HITRAN12. For all considered molecules, their line shapes are modelled as Voigt function with cutoff of 125 cm-1. For CO2, additional modification is done based on Tonkov et al. (1996). A cloud model consisting of four modal cloud particles with a mixture of 75% H2SO4 and 25% H2O is taken from Haus et al. (2013). This model was tested from near-infrared to mid-infrared ranges for the spectral analyses of Venus Express and Venera 15 data, which is useful for interpreting the very limited spectral information such as Akatsuki data. In this presentation, we will show the detail of the radiative transfer modeling for analyzing the IR2 data and, as its demonstration, the primitive results of spatiotemporal variations of CO abundance in the lower atmosphere.

Mechanical, Thermodynamic and Electronic Properties of Wurtzite and Zinc-Blende GaN Crystals

PubMed Central

Luan, Xinghe; Feng, Chuang; Yang, Daoguo; Zhang, Guoqi

2017-01-01

For the limitation of experimental methods in crystal characterization, in this study, the mechanical, thermodynamic and electronic properties of wurtzite and zinc-blende GaN crystals were investigated by first-principles calculations based on density functional theory. Firstly, bulk moduli, shear moduli, elastic moduli and Poisson’s ratios of the two GaN polycrystals were calculated using Voigt and Hill approximations, and the results show wurtzite GaN has larger shear and elastic moduli and exhibits more obvious brittleness. Moreover, both wurtzite and zinc-blende GaN monocrystals present obvious mechanical anisotropic behavior. For wurtzite GaN monocrystal, the maximum and minimum elastic moduli are located at orientations [001] and <111>, respectively, while they are in the orientations <111> and <100> for zinc-blende GaN monocrystal, respectively. Compared to the elastic modulus, the shear moduli of the two GaN monocrystals have completely opposite direction dependences. However, different from elastic and shear moduli, the bulk moduli of the two monocrystals are nearly isotropic, especially for the zinc-blende GaN. Besides, in the wurtzite GaN, Poisson’s ratios at the planes containing [001] axis are anisotropic, and the maximum value is 0.31 which is located at the directions vertical to [001] axis. For zinc-blende GaN, Poisson’s ratios at planes (100) and (111) are isotropic, while the Poisson’s ratio at plane (110) exhibits dramatically anisotropic phenomenon. Additionally, the calculated Debye temperatures of wurtzite and zinc-blende GaN are 641.8 and 620.2 K, respectively. At 300 K, the calculated heat capacities of wurtzite and zinc-blende are 33.6 and 33.5 J mol−1 K−1, respectively. Finally, the band gap is located at the G point for the two crystals, and the band gaps of wurtzite and zinc-blende GaN are 3.62 eV and 3.06 eV, respectively. At the G point, the lowest energy of conduction band in the wurtzite GaN is larger, resulting in a wider band gap. Densities of states in the orbital hybridization between Ga and N atoms of wurtzite GaN are much higher, indicating more electrons participate in forming Ga-N ionic bonds in the wurtzite GaN. PMID:29231902

Modeling and simulation of radiation from hypersonic flows with Monte Carlo methods

NASA Astrophysics Data System (ADS)

Sohn, Ilyoup

During extreme-Mach number reentry into Earth's atmosphere, spacecraft experience hypersonic non-equilibrium flow conditions that dissociate molecules and ionize atoms. Such situations occur behind a shock wave leading to high temperatures, which have an adverse effect on the thermal protection system and radar communications. Since the electronic energy levels of gaseous species are strongly excited for high Mach number conditions, the radiative contribution to the total heat load can be significant. In addition, radiative heat source within the shock layer may affect the internal energy distribution of dissociated and weakly ionized gas species and the number density of ablative species released from the surface of vehicles. Due to the radiation total heat load to the heat shield surface of the vehicle may be altered beyond mission tolerances. Therefore, in the design process of spacecrafts the effect of radiation must be considered and radiation analyses coupled with flow solvers have to be implemented to improve the reliability during the vehicle design stage. To perform the first stage for radiation analyses coupled with gas-dynamics, efficient databasing schemes for emission and absorption coefficients were developed to model radiation from hypersonic, non-equilibrium flows. For bound-bound transitions, spectral information including the line-center wavelength and assembled parameters for efficient calculations of emission and absorption coefficients are stored for typical air plasma species. Since the flow is non-equilibrium, a rate equation approach including both collisional and radiatively induced transitions was used to calculate the electronic state populations, assuming quasi-steady-state (QSS). The Voigt line shape function was assumed for modeling the line broadening effect. The accuracy and efficiency of the databasing scheme was examined by comparing results of the databasing scheme with those of NEQAIR for the Stardust flowfield. An accuracy of approximately 1 % was achieved with an efficiency about three times faster than the NEQAIR code. To perform accurate and efficient analyses of chemically reacting flowfield - radiation interactions, the direct simulation Monte Carlo (DSMC) and the photon Monte Carlo (PMC) radiative transport methods are used to simulate flowfield - radiation coupling from transitional to peak heating freestream conditions. The non-catalytic and fully catalytic surface conditions were modeled and good agreement of the stagnation-point convective heating between DSMC and continuum fluid dynamics (CFD) calculation under the assumption of fully catalytic surface was achieved. Stagnation-point radiative heating, however, was found to be very different. To simulate three-dimensional radiative transport, the finite-volume based PMC (FV-PMC) method was employed. DSMC - FV-PMC simulations with the goal of understanding the effect of radiation on the flow structure for different degrees of hypersonic non-equilibrium are presented. It is found that except for the highest altitudes, the coupling of radiation influences the flowfield, leading to a decrease in both heavy particle translational and internal temperatures and a decrease in the convective heat flux to the vehicle body. The DSMC - FV-PMC coupled simulations are compared with the previous coupled simulations and correlations obtained using continuum flow modeling and one-dimensional radiative transport. The modeling of radiative transport is further complicated by radiative transitions occurring during the excitation process of the same radiating gas species. This interaction affects the distribution of electronic state populations and, in turn, the radiative transport. The radiative transition rate in the excitation/de-excitation processes and the radiative transport equation (RTE) must be coupled simultaneously to account for non-local effects. The QSS model is presented to predict the electronic state populations of radiating gas species taking into account non-local radiation. The definition of the escape factor which is dependent on the incoming radiative intensity from over all directions is presented. The effect of the escape factor on the distribution of electronic state populations of the atomic N and O radiating species is examined in a highly non-equilibrium flow condition using DSMC and PMC methods and the corresponding change of the radiative heat flux due to the non-local radiation is also investigated.

Shear Elasticity and Shear Viscosity Imaging in Soft Tissue

NASA Astrophysics Data System (ADS)

Yang, Yiqun

In this thesis, a new approach is introduced that provides estimates of shear elasticity and shear viscosity using time-domain measurements of shear waves in viscoelastic media. Simulations of shear wave particle displacements induced by an acoustic radiation force are accelerated significantly by a GPU. The acoustic radiation force is first calculated using the fast near field method (FNM) and the angular spectrum approach (ASA). The shear waves induced by the acoustic radiation force are then simulated in elastic and viscoelastic media using Green's functions. A parallel algorithm is developed to perform these calculations on a GPU, where the shear wave particle displacements at different observation points are calculated in parallel. The resulting speed increase enables rapid evaluation of shear waves at discrete points, in 2D planes, and for push beams with different spatial samplings and for different values of the f-number (f/#). The results of these simulations show that push beams with smaller f/# require a higher spatial sampling rate. The significant amount of acceleration achieved by this approach suggests that shear wave simulations with the Green's function approach are ideally suited for high-performance GPUs. Shear wave elasticity imaging determines the mechanical parameters of soft tissue by analyzing measured shear waves induced by an acoustic radiation force. To estimate the shear elasticity value, the widely used time-of-flight method calculates the correlation between shear wave particle velocities at adjacent lateral observation points. Although this method provides accurate estimates of the shear elasticity in purely elastic media, our experience suggests that the time-of-flight (TOF) method consistently overestimates the shear elasticity values in viscoelastic media because the combined effects of diffraction, attenuation, and dispersion are not considered. To address this problem, we have developed an approach that directly accounts for all of these effects when estimating the shear elasticity. This new approach simulates shear wave particle velocities using a Green's function-based approach for the Voigt model, where the shear elasticity and viscosity values are estimated using an optimization-based approach that compares measured shear wave particle velocities with simulated shear wave particle velocities in the time-domain. The results are evaluated on a point-by-point basis to generate images. There is good agreement between the simulated and measured shear wave particle velocities, where the new approach yields much better images of the shear elasticity and shear viscosity than the TOF method. The new estimation approach is accelerated with an approximate viscoelastic Green's function model that is evaluated with shear wave data obtained from in vivo human livers. Instead of calculating shear waves with combinations of different shear elasticities and shear viscosities, shear waves are calculated with different shear elasticities on the GPU and then convolved with a viscous loss model, which accelerates the calculation dramatically. The shear elasticity and shear viscosity values are then estimated using an optimization-based approach by minimizing the difference between measured and simulated shear wave particle velocities. Shear elasticity and shear viscosity images are generated at every spatial point in a two-dimensional (2D) field-of-view (FOV). The new approach is applied to measured shear wave data obtained from in vivo human livers, and the results show that this new approach successfully generates shear elasticity and shear viscosity images from this data. The results also indicate that the shear elasticity values estimated with this approach are significantly smaller than the values estimated with the conventional TOF method and that the new approach demonstrates more consistent values for these estimates compared with the TOF method. This experience suggests that the new method is an effective approach for estimating the shear elasticity and the shear viscosity in liver and in other soft tissue.

40 years of mineral elasticity: a critical review and a new parameterisation of equations of state for mantle olivines and diamond inclusions

NASA Astrophysics Data System (ADS)

Angel, Ross J.; Alvaro, Matteo; Nestola, Fabrizio

2018-02-01

Elasticity is a key property of materials, not only for predicting volumes and densities of minerals at the pressures and temperatures in the interior of the Earth, but also because it is a major factor in the energetics of structural phase transitions, surface energies, and defects within minerals. Over the 40 years of publication of Physics and Chemistry of Minerals, great progress has been made in the accuracy and precision of the measurements of both volumes and elastic tensors of minerals and in the pressures and temperatures at which the measurements are made. As an illustration of the state of the art, all available single-crystal data that constrain the elastic properties and pressure-volume-temperature equation of state (EoS) of mantle-composition olivine are reviewed. Single-crystal elasticity measurements clearly distinguish the Reuss and Voigt bulk moduli of olivine at all conditions. The consistency of volume and bulk modulus data is tested by fitting them simultaneously. Data collected at ambient pressure and data collected at ambient temperature up to 15 GPa are consistent with a Mie-Grünesien-Debye thermal-pressure EoS in combination with a third-order Birch-Murnaghan (BM) compressional EoS, the parameter V 0 = 43.89 cm3 mol-1, isothermal Reuss bulk modulus K_{TR,0} = 126.3(2){ GPa}, K^'_{TR,0} = 4.54(6), a Debye temperature θD = 644(9){K}, and a Grüneisen parameter γ 0 = 1.044(4), whose volume dependence is described by q = 1.9(2). High-pressure softening of the bulk modulus at room temperature, relative to this EoS, can be fit with a fourth-order BM EoS. However, recent high- P, T Brillouin measurements are incompatible with these EoS and the intrinsic physics implied by it, especially that ( {partial K^'_{TR} }/partial T )P > 0. We introduce a new parameterisation for isothermal-type EoS that scales both the Reuss isothermal bulk modulus and its pressure derivative at temperature by the volume, K_{TR} (T,P = 0) = K_{TR,0} [ {{V0 }/V(T)} ]^{{δT }} and K^'_{TR} (T,P = 0) = K^'_{TR,0} [ {V(T)/{V_{0 }}} ]^{{δ^', to ensure thermodynamic correctness at low temperatures. This allows the elastic softening implied by the high- P, T Brillouin data for mantle olivine to be fit simultaneously and consistently with the same bulk moduli and pressure derivatives (at room temperature) as the MGD EoS, and with the additional parameters of α V0 = 2.666(9) × 10-5 K-1, θE = 484(6), δT = 5.77(8), and δ^' = -3.5(1.1). The effects of the differences between the two EoS on the calculated density, volume, and elastic properties of olivine at mantle conditions and on the calculation of entrapment conditions of olivine inclusions in diamonds are discussed, and approaches to resolve the current uncertainties are proposed.

First field-based observations of δ2H and δ18O values of precipitation and other water bodies in the Mongolian Gobi desert

NASA Astrophysics Data System (ADS)

Burnik Šturm, Martina; Ganbaatar, Oyunsaikhan; Voigt, Christian C.; Kaczensky, Petra

2017-04-01

Hydrogen (δ2H) and oxygen (δ18O) isotope values of water are widely used to track the global hydrological cycle and the global δ2H and δ18O patterns of precipitation are increasingly used in studies on animal migration, forensics, food authentication and traceability studies. However, δ2H and δ18O values of precipitation spanning one or more years are available for only a few 100 locations worldwide and for many remote areas such as Mongolia data are still scarce. We obtained the first field-based δ2H and δ18O isotope data of event-based precipitation, rivers and other water bodies in the extreme environment of the Dzungarian Gobi desert in SW Mongolia, covering a period of 16 months (1). Our study area is located over 450 km north-east from the nearest IAEA GNIP station (Fukang station, China) from which it is separated by a mountain range at the international border between China and Mongolia. Isotope values of the collected event-based precipitation showed and extreme range and a high seasonal variability with higher and more variable values in summer and lower in winter. The high variability could not be explained by different origin of air masses alone (i.e. NW polar winds over Russia or westerlies over Central Asia; analyzed using back-trajectory HYSPLIT model), but is likely a result of a combination of different processes affecting the isotope values of precipitation in this area. The calculated field-based local meteoric water line (LMWL, δ2H=(7.42±0.16)δ18O-(23.87±3.27)) showed isotopic characteristics of precipitation in an arid region. We observed a slight discrepancy between the filed based and modelled (Online Isotope in Precipitation Calculator, OIPC) LMWL which highlighted the difficulty of modelling the δ2H and δ18O values for areas with extreme climatic conditions and thus emphasized the importance of collecting long-term field-based data. The collected isotopic data of precipitation and other water bodies provide a basis for future studies in this largely understudied region. (1)Burnik Šturm M., Ganbaatar O., Voigt C.C., Kaczensky P. (2016) First field-based observations of δ2H and δ18O values of precipitation, rivers and other water bodies in the Dzungarian Gobi, SW Mongolia. Isotopes in Environmental and Health Studies, doi: 10.1080/10256016.2016.1231184

On the nature of absorption features toward nearby stars

NASA Astrophysics Data System (ADS)

Kohl, S.; Czesla, S.; Schmitt, J. H. M. M.

2016-06-01

Context. Diffuse interstellar absorption bands (DIBs) of largely unknown chemical origin are regularly observed primarily in distant early-type stars. More recently, detections in nearby late-type stars have also been claimed. These stars' spectra are dominated by stellar absorption lines. Specifically, strong interstellar atomic and DIB absorption has been reported in τ Boo. Aims: We test these claims by studying the strength of interstellar absorption in high-resolution TIGRE spectra of the nearby stars τ Boo, HD 33608, and α CrB. Methods: We focus our analysis on a strong DIB located at 5780.61 Å and on the absorption of interstellar Na. First, we carry out a differential analysis by comparing the spectra of the highly similar F-stars, τ Boo and HD 33608, whose light, however, samples different lines of sight. To obtain absolute values for the DIB absorption, we compare the observed spectra of τ Boo, HD 33608, and α CrB to PHOENIX models and carry out basic spectral modeling based on Voigt line profiles. Results: The intercomparison between τ Boo and HD 33608 reveals that the difference in the line depth is 6.85 ± 1.48 mÅ at the DIB location which is, however, unlikely to be caused by DIB absorption. The comparison between PHOENIX models and observed spectra yields an upper limit of 34.0 ± 0.3 mÅ for any additional interstellar absorption in τ Boo; similar results are obtained for HD 33608 and α CrB. For all objects we derive unrealistically large values for the radial velocity of any presumed interstellar clouds. In τ Boo we find Na D absorption with an equivalent width of 0.65 ± 0.07 mÅ and 2.3 ± 0.1 mÅ in the D2 and D1 lines. For the other Na, absorption of the same magnitude could only be detected in the D2 line. Our comparisons between model and data show that the interstellar absorption toward τ Boo is not abnormally high. Conclusions: We find no significant DIB absorption in any of our target stars. Any differences between modeled and observed spectra are instead attributable to inaccuracies in the stellar atmospheric modeling than to DIB absorption. The spectra are available at the CDS via anonymous ftp to http://cdsarc.u-strasbg.fr (http://130.79.128.5) or via http://cdsarc.u-strasbg.fr/viz-bin/qcat?J/A+A/591/A20

The Column Density Distribution and Continuum Opacity of the Intergalactic and Circumgalactic Medium at Redshift langzrang = 2.4

NASA Astrophysics Data System (ADS)

Rudie, Gwen C.; Steidel, Charles C.; Shapley, Alice E.; Pettini, Max

2013-06-01

We present new high-precision measurements of the opacity of the intergalactic and circumgalactic medium (IGM; CGM) at langzrang = 2.4. Using Voigt profile fits to the full Lyα and Lyβ forests in 15 high-resolution high-S/N spectra of hyperluminous QSOs, we make the first statistically robust measurement of the frequency of absorbers with H I column densities 14 \\lesssim log (N_H\\,\\scriptsize{ I}/ {cm}^{-2}) \\lesssim 17.2. We also present the first measurements of the frequency distribution of H I absorbers in the volume surrounding high-z galaxies (the CGM, 300 pkpc), finding that the incidence of absorbers in the CGM is much higher than in the IGM. In agreement with Rudie et al., we find that there are fractionally more high-N H I absorbers than low-N H I absorbers in the CGM compared to the IGM, leading to a shallower power law fit to the CGM frequency distribution. We use these new measurements to calculate the total opacity of the IGM and CGM to hydrogen-ionizing photons, finding significantly higher opacity than most previous studies, especially from absorbers with log (N_H\\,\\scriptsize{ I}/ {cm}^{-2}) < 17.2. Reproducing the opacity measured in our data as well as the incidence of absorbers with log (N_H\\,\\scriptsize{ I}/ {cm}^{-2}) \\gt 17.2 requires a broken power law parameterization of the frequency distribution with a break near N H I ≈1015 cm-2. We compute new estimates of the mean free path (λmfp) to hydrogen-ionizing photons at z em = 2.4, finding λmfp = 147 ± 15 Mpc when considering only IGM opacity. If instead, we consider photons emanating from a high-z star-forming galaxy and account for the local excess opacity due to the surrounding CGM of the galaxy itself, the mean free path is reduced to λmfp = 121 ± 15 Mpc. These λmfp measurements are smaller than recent estimates and should inform future studies of the metagalactic UV background and of ionizing sources at z ≈ 2-3. Based on data obtained at the W. M. Keck Observatory, which is operated as a scientific partnership among the California Institute of Technology, the University of California, and the National Aeronautics and Space Administration, and was made possible by the generous financial support of the W. M. Keck Foundation.

Modelling the Contrasting Viscoelastic Behaviours of Melt--Free and Melt--Bearing Olivine

NASA Astrophysics Data System (ADS)

Morris, S.; Jackson, I.

2005-12-01

Torsional oscillation experiments on polycrystalline olivine show that the viscoelastic behaviour is strongly affected by the presence of melt. For melt--free samples, the dissipation Q-1 per cycle decreases monotonically with increasing oscillation frequency ω, but melt--bearing samples exhibit a dissipation peak. To explain that difference, we analyse a simplified continuum model. In it, the sample occupies the gap -d> and >> H= η' d/bη, so that H is the ratio of the sliding timescale η' d/μ b to the Maxwell timescale η/μ of the grain. The behaviour predicted by (1) proves to be identical to that of a Burgers solid. By solving (1) for periodic forcing, we find there are two cases: (a) if H<1/4, there is a dissipation peak for all values of M; (b) if H>1/4, there is a peak only if M> 2(4H-1)/(H+2). In case (a) the timescales are sufficiently separated that a peak always exists, but in case (b), the timescales are so close together that a peak only exists if sliding is facilitated by making the boundary rigidity μ' sufficiently small compared with the grain rigidity. These conclusions are consistent with those of Faul, Fitz Gerald & Jackson ( JGR, 109, B06202; 58, 60, 2004). Since their microcreep tests demonstrated a continuous evolution from elastic through anelastic to viscous behaviour, they inferred that in their experiments the Maxwell and sliding timescales could not be widely separated. They also argued physically that rounding of grain corners promotes the formation of a dissipation peak by enhancing grain boundary sliding. Their conclusions are consistent with case (b) above, since the work of Raj & Ashby implies that M is increased by decreasing the ratio of grain diameter to grain corner radius. Our model thus consolidates the physical reasoning previously used to interpret the olivine experiments, and also summarizes the processes we need to include in more detailed micromechanical modelling.

Emissions from Coal Fires and Their Impact on the Environment

USGS Publications Warehouse

Kolker, Allan; Engle, Mark; Stracher, Glenn; Hower, James; Prakash, Anupma; Radke, Lawrence; ter Schure, Arnout; Heffern, Ed

2009-01-01

Self-ignited, naturally occurring coal fires and fires resulting from human activities persist for decades in underground coal mines, coal waste piles, and unmined coal beds. These uncontrolled coal fires occur in all coal-bearing parts of the world (Stracher, 2007) and pose multiple threats to the global environment because they emit greenhouse gases - carbon dioxide (CO2), and methane (CH4) - as well as mercury (Hg), carbon monoxide (CO), and other toxic substances (fig. 1). The contribution of coal fires to the global pool of atmospheric CO2 is little known but potentially significant. For China, the world's largest coal producer, it is estimated that anywhere between 10 million and 200 million metric tons (Mt) of coal reserves (about 0.5 to 10 percent of production) is consumed annually by coal fires or made inaccessible owing to fires that hinder mining operations (Rosema and others, 1999; Voigt and others, 2004). At this proportion of production, coal amounts lost to coal fires worldwide would be two to three times that for China. Assuming this coal has mercury concentrations similar to those in U.S. coals, a preliminary estimate of annual Hg emissions from coal fires worldwide is comparable in magnitude to the 48 tons of annual Hg emissions from all U.S. coal-fired power-generating stations combined (U.S. Environmental Protection Agency, 2002). In the United States, the combined cost of coal-fire remediation projects, completed, budgeted, or projected by the U.S. Department of the Interior's Office of Surface Mining Reclamation and Enforcement (OSM), exceeds $1 billion, with about 90% of that in two States - Pennsylvania and West Virginia (Office of Surface Mining Enforcement and Reclamation, 2008; fig. 2). Altogether, 15 States have combined cumulative OSM coal-fire project costs exceeding $1 million, with the greatest overall expense occurring in States where underground coal fires are predominant over surface fires, reflecting the greater cost of extinguishing underground fires (fig. 2) (see 'Controlling Coal Fires'). In this fact sheet we review how coal fires occur, how they can be detected by airborne and remote surveys, and, most importantly, the impact coal-fire emissions may have on the environment and human health. In addition, we describe recent efforts by the U.S. Geological Survey (USGS) and collaborators to measure fluxes of CO2, CO, CH4, and Hg, using groundbased portable detectors, and combining these approaches with airborne thermal imaging and CO2 measurements. The goal of this research is to develop approaches that can be extrapolated to large fires and to extrapolate results for individual fires in order to estimate the contribution of coal fires as a category of global emissions.

Controls and implications of anisotropy across a strain gradient within granodiorite, Serifos, Western Cyclades

NASA Astrophysics Data System (ADS)

Gaudreau, Élyse; Lagroix, France; Cossette, Élise; Schneider, David; Grasemann, Bernhard

2016-04-01

In order to evaluate the assumption that the crust behaves as an isotropic material in complex structural settings, we integrate crystallographic preferred orientation (CPO) and anisotropy of magnetic susceptibility (AMS) data across a strain gradient within a Miocene granodioritic intrusion on Serifos island, Western Cyclades. One of the consequences of anisotropic crust is the variation in seismic wave velocity with the direction of propagation, which is largely controlled by the CPO of anisotropic minerals such as micas. The magnetic fabric of variably deformed granodiorite is used to characterize weakly defined tectonic fabric and thus complements the CPO data. Granodiorite samples exhibit very low strain to mylonitic fabric across the crustal-scale shear zone, recording progressive deformation through the ductile to brittle transition. CPO data was collected using electron backscatter diffraction and seismic properties were calculated using Voigt-Reuss-Hill averaging of the single minerals' elastic stiffness tensor. Quartz CPO is very strong in the weakly deformed samples recording basal and prism {0001} slip. Furthermore, bulging recrystallization and undulose extinction in quartz as well as feldspar grains that exhibit brittle deformation structures are indicative of 300-400 °C temperatures. The mylonite has a very weak CPO for the quartz phase and exhibits prism {0001} slip. The higher strain samples also reveal dynamic recrystallization and grain size reduction of quartz, plagioclase, potassium feldspar and biotite, which are characteristic of 400-500 °C temperatures. Orthoclase and anorthite possess a weak CPO in all samples. The S-wave anisotropy calculated from the CPO data of the weakly deformed granodiorite is the highest of all samples (max: 8%), and the anisotropy of the mylonite is the weakest of all samples (max: <3%). AMS data yields mainly oblate fabrics and the magnetic foliations and lineations correlate with microscopic and macroscopic structural observations. Most samples exhibit a bulk magnetic susceptibility between 30 and 5000 μSI, suggesting that the magnetic signature is due to both paramagnetic and ferrimagnetic minerals. Hysteresis loops and thermomagnetic curves specify pseudo-single domain magnetite as the main ferrimagnetic mineral. Paramagnetic and ferrimagnetic minerals can exhibit distinct subfabrics, and differentiating between the two using the anisotropy of remanence is essential for semi-quantifying local deformation. The magnetic fabric, coupled with the tectonic fabric inferred from CPO data, gives unique insight into the character of anisotropic minerals in a complex structural setting. For instance, the AMS foliations for samples with ill-defined syntectonic emplacement fabric have a similar orientation to that of fast P-wave propagation, a trait consistent with samples that have a macroscopic foliation. The analysis of anisotropic minerals is therefore fundamental for incorporating seismic anisotropy into large-scale geophysical models.

Crustal seismic anisotropy and structure from textural and seismic investigations in the Cycladic region, Greece

NASA Astrophysics Data System (ADS)

Cossette, Élise; Schneider, David; Audet, Pascal; Grasemann, Bernhard

2016-04-01

Seismic anisotropy data are often used to resolve rock structures and deformation styles in the crust based on compilations of rock properties that may not be representative of the exposed geology. We use teleseismic receiver functions jointly with in situ rock property data to constrain the seismic structure and anisotropy of the crust in the Cyclades, Greece, located in the back arc region of the Hellenic subduction zone. Crystallographic preferred orientations (CPOs) via electron backscatter diffraction (EBSD) analyses were measured on a suite of samples representative of different structural depths along the West Cycladic Detachment System; average seismic properties of the rocks were calculated with the Voigt-Reuss-Hill average of the single minerals' elastic stiffness tensor. The calcitic and quartzitic rocks have P- and S-wave velocity anisotropies (AVp, AVs) averaging 8.1% and 7.1%, respectively. The anisotropy increases with depth represented by blueschist assemblages, with AVp averaging 20.3% and AVs averaging 14.5% due to the content of aligned glaucophane and mica, which strongly control the seismic properties of the rocks. Localized anisotropies of very high magnitude are caused by the presence of mica schists as they possess the strongest anisotropies, with values of ~25% for AVp and AVs. The direction of the fast and slow P-wave velocities occur parallel and perpendicular to the foliation, respectively, for most samples. The fast propagation has the same NE-SW orientation as the lithospheric stretching direction present in the Cyclades since the Late Oligocene. The maximum shear wave anisotropy is subhorizontal, similarly concordant with mineral alignment that developed during back-arc extension. Our results strongly favor radial anisotropy in the Aegean mid-crust over azimuthal anisotropy. The receiver function data indicate that the Moho is relatively flat at 25 km depth in the south and deepens to 33 km in the north, consistent with previous studies, and reveal an intra-crustal discontinuity at depth varying from 3 to 11 km, mostly observed in the south-central Aegean. Harmonic decomposition of the receiver functions further indicates layering of both shallow and deep crustal anisotropy related to crustal structures. We model synthetic receiver functions based on constraints from the in situ rock properties that we measured using the EBSD technique. Our results indicate that the shallow upper crustal layer is characterized by metapelites with ~5% anisotropy, underlain by a 20 km thick and anisotropic layer of possible high-pressure rocks comprising blueschist and eclogite and/or restitic crust as a consequence of Miocene magmatism. Seismic anisotropy models require a sub-vertical axis of hexagonal symmetry in the upper crust (i.e. radial anisotropy), consistent with in situ rock data. Finally, a thinned crust is likely caused by back-arc extension associated with elevated sub-crustal temperatures, in agreement with thermal isostasy models of back arcs. This study demonstrates the importance of integrating rock textural data with seismic velocity profiles in the interpretation of crustal architecture.

Line Narrowing Parameter Measurement by Modulation Spectroscopy

NASA Technical Reports Server (NTRS)

Dharamsi, Amin N.

1998-01-01

Accurate Characterization of Oxygen A-Band Line Parameters by Wavelength Modulation Spectroscopy with tunable diode lasers is an ongoing research at Old Dominion University, under sponsorship from NASA Langley research Center. The work proposed here will be undertaken under the guidance of Dr. William Chu and Dr. Lamont Poole of the Aerosol Research Branch at NASA Langley-Research Center in Hampton, Virginia. The research was started about two years ago and utilizes wavelength modulation absorption spectroscopy with higher harmonic detection, a technique that we developed at Old Dominion University, to obtain the absorption line characteristics of the Oxygen A-band rovibronic lines. Accurate characterization of this absorption band is needed for processing of data that will be obtained in experiments such as the NASA Stratospheric Aerosol and Gas Experiment III (SAGE III) as part of the US Mission to Planet Earth. The research work for Summer Fellowship undertook a measurement of the Dicke line-narrowing parameters of the Oxygen A-Band lines by using wavelength modulation spectroscopy. Our previous theoretical results had indicated that such a measurement could be done sensitively and in a convenient fashion by using this type of spectroscopy. In particular, theoretical results had indicated that the signal magnitude would depend on pressure in a manner that was very sensitive to the narrowing parameter. One of the major tasks undertaken during the summer of 1998 was to establish experimentally that these theoretical predictions were correct. This was done successfully and the results of the work are being prepared for publication. Experimental Results were obtained in which the magnitude of the signal was measured as a function of pressure, for various harmonic detection orders (N = 1, 2, 3, 4, 5). A comparison with theoretical results was made, and it was shown that the agreement between theory and experiment was very good. More importantly, however, it was shown that the measurement was yielded a very sensitive technique for obtaining the narrowing parameter that describes the deviation of Oxygen A-band lines from the Voigt profile. In particular, it was seen that the best fits were obtained consistently when the narrowing parameter value used was 0.022 1/cm, 1/Atm, Previous work, upon which the current work was based has resulted in several accurate measurements of properties of particular lines of the Oxygen A band. For example, this work has resulted in the measurement of the collision cross sections of several lines including the RQ(13,14) and the RR(15,15) lines. A major achievement of achievement of the work was also the demonstration that the technique we have developed can accurately probe the structure of the absorption lineshape function. In particular, the method we have developed is very well suited for experimentally probing the characteristics of lines in their wings. This work was accepted for publication in the Journal of Applied Physics, and is scheduled to appear in the December 15, 1998 issue.

Seawater Os heterogeneity during the OAE 2 and across the Cenomanian-Turonian Boundary: Implications for global ocean paleocirculation

NASA Astrophysics Data System (ADS)

Du Vivier, A.

2009-12-01

Alice D.C. Du Vivier1, David Selby1, Darren R. Gröcke1, Bradley B. Sageman2, Silke Voigt3 1Department of Earth Sciences, Durham University, Durham, DH1 3LE, UK 2Department of Geological Sciences, Northwestern University, Evanston, Illinois 60208, USA 3Leibniz Institute of Marine Sciences (IFM-Geomar), Wischhofstrasse 1-3, 24184 Kiel, Germany Organic-rich sediments (ORS) from two OAE 2 sites (ODP Site 1260B and Furlo) show significant enrichment in Os (>1 ppb) and possess mantle-like initial 187Os/188Os (IOs, ~0.13) prior to the onset and during the lower part of the OAE 2 [1]. However, these sites show significantly different IOs profiles for the upper part of the OAE 2, suggesting Os heterogeneity within the global ocean. We use new IOs data from correlative sections based on chemostratigraphy and biostratigraphy (Rock Canyon, Pueblo USA and Wunstorf, Germany) to evaluate the evolution of global seawater IOs during OAE 2. Wunstorf and Rock Canyon OAE 2 sections are the European type and CTB GSSP sections, respectively. These sections have average Os abundances that are an order of magnitude lower than that from Furlo and Site 1260B (410 and 245 pg/g vs. 3630 and 2575 pg/g, respectively). Redox is important for Os capture in ORS, but not a controlling factor for Os uptake. The significant enrichment in Os in ORS from Furlo and Site 1260B may relate to the slow sedimentation rate of the ORS (~ 0.2 cm/kyrs vs ~ 1.8 cm/kyrs and ~ 0.5cm/kyrs at Wunstorf and Pueblo), thus permitting a greater contact time for Os uptake. Spikes in the ORS Os abundance coincide with unradiogenic IOs (0.13 to 0.30). Our high-resolution IOs coupled with that of site 1260B and Furlo [1] show distinct variations in IOs throughout the OAE 2. This suggests that the 187Os/188Os ratio in the global ocean was not homogeneous. During the peak of OAE 2 the IOs at Furlo and Site 1260B are more unradiogenic (0.13 and 0.15) than that recorded at Wunstorf, 0.18 and Pueblo, ~ 0.2. The IOs profile from Wunstorf and Pueblo show a similar gradual return to radiogenic IOs towards the CTB, ~300 kyrs after the onset of OAE 2, which is very similar to that from Furlo. However, Site 1260B remains unradiogenic (IOs = 0.13 to 0.30) and rapidly returns to more radiogenic values (~0.5) at the end of OAE 2. The unradiogenic IOs coincide with the onset of the Caribbean LIP. However, the extended duration of unradiogenic IOs at Site 1260B in comparison to Pueblo, Wunstorf and Furlo, may relate to its proximity to the LIP. Additionally, the variation in IOs between the sites at the onset of OAE 2 questions the homogenous mixing of the global ocean with respect to Os. We suggest that the heterogeneity of global seawater Os is the result of variations in global ocean circulation, as a result of latitudinal climate belts and paleogeography. Furthermore, if the LIP contemporaneously affected the global seawater Os isotope composition, which is suggested by the IOs, then the onset of magmatism was ~94.4 Ma, almost identical to the 40Ar/39Ar dating, which has a 1-2 myr uncertainty, of the Caribbean LIP. Moreover, the IOs data suggests that the effect of the Caribbean LIP on the global ocean was on the order of only 300 to 800 kyrs. [1] Turgeon & Creaser, 2009, Nature, 454, 323-326

Radiative transfer analyses of Titan's tropical atmosphere

NASA Astrophysics Data System (ADS)

Griffith, Caitlin A.; Doose, Lyn; Tomasko, Martin G.; Penteado, Paulo F.; See, Charles

2012-04-01

Titan's optical and near-IR spectra result primarily from the scattering of sunlight by haze and its absorption by methane. With a column abundance of 92 km amagat (11 times that of Earth), Titan's atmosphere is optically thick and only ˜10% of the incident solar radiation reaches the surface, compared to 57% on Earth. Such a formidable atmosphere obstructs investigations of the moon's lower troposphere and surface, which are highly sensitive to the radiative transfer treatment of methane absorption and haze scattering. The absorption and scattering characteristics of Titan's atmosphere have been constrained by the Huygens Probe Descent Imager/Spectral Radiometer (DISR) experiment for conditions at the probe landing site (Tomasko, M.G., Bézard, B., Doose, L., Engel, S., Karkoschka, E. [2008a]. Planet. Space Sci. 56, 624-247; Tomasko, M.G. et al. [2008b]. Planet. Space Sci. 56, 669-707). Cassini's Visual and Infrared Mapping Spectrometer (VIMS) data indicate that the rest of the atmosphere (except for the polar regions) can be understood with small perturbations in the high haze structure determined at the landing site (Penteado, P.F., Griffith, C.A., Tomasko, M.G., Engel, S., See, C., Doose, L., Baines, K.H., Brown, R.H., Buratti, B.J., Clark, R., Nicholson, P., Sotin, C. [2010]. Icarus 206, 352-365). However the in situ measurements were analyzed with a doubling and adding radiative transfer calculation that differs considerably from the discrete ordinates codes used to interpret remote data from Cassini and ground-based measurements. In addition, the calibration of the VIMS data with respect to the DISR data has not yet been tested. Here, VIMS data of the probe landing site are analyzed with the DISR radiative transfer method and the faster discrete ordinates radiative transfer calculation; both models are consistent (to within 0.3%) and reproduce the scattering and absorption characteristics derived from in situ measurements. Constraints on the atmospheric opacity at wavelengths outside those measured by DISR, that is from 1.6 to 5.0 μm, are derived using clouds as diffuse reflectors in order to derive Titan's surface albedo to within a few percent error and cloud altitudes to within 5 km error. VIMS spectra of Titan at 2.6-3.2 μm indicate not only spectral features due to CH4 and CH3D (Rannou, P., Cours, T., Le Mouélic, S., Rodriguez, S., Sotin, C., Drossart, P., Brown, R. [2010]. Icarus 208, 850-867), but also a fairly uniform absorption of unknown source, equivalent to the effects of a darkening of the haze to a single scattering albedo of 0.63 ± 0.05. Titan's 4.8 μm spectrum point to a haze optical depth of 0.2 at that wavelength. Cloud spectra at 2 μm indicate that the far wings of the Voigt profile extend 460 cm-1 from methane line centers. This paper releases the doubling and adding radiative transfer code developed by the DISR team, so that future studies of Titan's atmosphere and surface are consistent with the findings by the Huygens Probe. We derive the surface albedo at eight spectral regions of the 8 × 12 km2 area surrounding the Huygens landing site. Within the 0.4-1.6 μm spectral region our surface albedos match DISR measurements, indicating that DISR and VIMS measurements are consistently calibrated. These values together with albedos at longer 1.9-5.0 μm wavelengths, not sampled by DISR, resemble a dark version of the spectrum of Ganymede's icy leading hemisphere. The eight surface albedos of the landing site are consistent with, but not deterministic of, exposed water ice with dark impurities.

Contrail Cirrus Forecasts for the ML-CIRRUS Experiment and Some Comparison Results

NASA Astrophysics Data System (ADS)

Schumann, Ulrich; Graf, Kaspar; Bugliaro, Luca; Dörnbrack, Andreas; Giez, Andreas; Jurkat, Tina; Kaufmann, Stefan; Krämer, Martina; Minikin, Andreas; Schäfler, Andreas; Voigt, Christiane; Wirth, Martin; Zahn, Andreas; Ziereis, Helmut

2015-04-01

Model simulations with the contrail cirrus prediction model CoCiP driven by numerical weather prediction (NWP) data provided from the European Centre for Medium Range Forecasts (ECMWF) and global aircraft waypoint data show a mean computed cover (for optical depth larger than 0.1) of 0.23% globally, and 5.4% over mid Europe (Schumann and Graf, JGR, 2013). The computed mean longwave radiative forcing (RF) reaches 3 W m-2 over mid Europe (10°W-20°E and 40°N-55°N), and 0.13 W m-2 globally. The global net RF is about 40-60% smaller because of compensating shortwave cooling induced by contrails during daytime. The results depend on several model details such as the number of ice particles forming from aircraft soot emissions, the contrail plume dispersion, ice particle sedimentation etc., all influencing contrail life time and their optical properties. The quantitative results depend also strongly on ambient relative humidity, vertical motion and on ice water content of other cirrus predicted by the NWP model. In order to test and possibly improve this and other contrail models, high-quality observations are needed to which multi-parameter model output can be compared. The Mid-Latitude Cirrus Experiment ML-CIRRUS was performed (see C. Voigt et al., this conference) with a suite of in-situ and Lidar instruments for airborne measurements on the research aircraft HALO. Before and during the mission, CoCiP was run daily to provide 3-days forecasts of contrail cover using operational ECMWF forecasts and historical traffic data. CoCiP forecast output was made available in an internet tool twice a day for experiment planning. The one-day and two-day contrail forecasts often showed only small differences. Still, most recent forecasts and detailed satellite observations results were transmitted via satellite link to the crew for onboard campaign optimization. After the campaign, a data base of realistic air traffic data has been setup from various sources, and CoCiP was rerun with improved ECMWF-NWP data (at one-hour time resolution). The model results are included in the HALO mission data bank, and the results are available for comparison to in-situ data. The data are useful for identifying aircraft and other sources for measured air properties. The joint analysis of observations and model result has basically just started. Preliminary results from comparisons with lidar-measured extinction profiles, in-situ measured humidity, nitrogen oxides, and aerosol and ice particle concentrations, and with meteorological observations (wind, temperature etc.) illustrate the expected gain in insight. The contrail forecasts have been checked by comparison to available data including satellite data and HALO observations. During the campaign, it became obvious that predicted contrail cirrus cover compared qualitatively mostly well with what was found when HALO reached predicted cirrus regions. From the analysis of the measured data, some examples of significant correlation between model results and observations have been found. However, the quantitative agreement is not uniform. As expected, nature is far more variable than a model can predict. The observed optical properties of cirrus and contrails vary far more in time and space than predicted. Local values were often far higher or lower than mean values. A one-to-one correlation between local observations and model results is not to be expected. This inhomogeneity may have consequences for the climate impact of aviation induced cloud changes.

Long-term series of tropospheric water vapour amounts and HDO/H2O ratio profiles above Jungfraujoch.

NASA Astrophysics Data System (ADS)

Lejeune, B.; Mahieu, E.; Schneider, M.; Hase, F.; Servais, C.; Demoulin, P.

2012-04-01

Water vapour is a crucial climate variable involved in many processes which widely determine the energy budget of our planet. In particular, water vapour is the dominant greenhouse gas in the Earth's atmosphere and its radiative forcing is maximum in the middle and upper troposphere. Because of the extremely high variability of water vapour concentration in time and space, it is challenging for the available relevant measurement techniques to provide a consistent data set useful for trend analyses and climate studies. Schneider et al. (2006a) showed that ground-based Fourier Transform Infrared (FTIR) spectroscopy, performed from mountain observatories, allows for the detection of H2O variabilities up to the tropopause. Furthermore, the FTIR measurements allow the retrieval of HDO amounts and therefore the monitoring of HDO/H2O ratio profiles whose variations act as markers for the source and history of the atmospheric water vapour. In the framework of the MUSICA European project (Multi-platform remote Sensing of Isotopologues for investigating the Cycle of Atmospheric water, http://www.imk-asf.kit.edu/english/musica.php), a new approach has been developed and optimized by M. Schneider and F. Hase, using the PROFFIT algorithm, to consistently retrieve tropospheric water vapour profiles from high-resolution ground-based infrared solar spectra and so taking benefit from available long-term data sets of ground-based observations. The retrieval of the water isotopologues is performed on a logarithmic scale from 14 micro-windows located in the 2600-3100 cm-1 region. Other important features of this new retrieval strategy are: a speed dependant Voigt line shape model, a joint temperature profile retrieval and an interspecies constraint for the HDO/H2O profiles. In this contribution, we will combine the quality of the MUSICA strategy and of our observations, which are recorded on a regular basis with FTIR spectrometers, under clear-sky conditions, at the NDACC site (Network for the Detection of Atmospheric Composition Change, http://www.ndacc.org) of the Jungfraujoch International Scientific Station (Swiss Alps, 46.5° N, 8.0° E, 3580m asl). Information content analysis of the retrieved H2O products allows us to produce a long-term trend from 1996 to 2011 for different tropospheric levels. We will compare the annual cycle of tropospheric HDO/H2O ratio profiles with those already produced at other sites (Schneider et al., 2010). We will also focus on the diurnal variability of water vapour to determine a time limit in the inter-comparison of different water vapour measurement techniques. Acknowledgments The University of Liège involvement has primarily been supported by the PRODEX program funded by the Belgian Federal Science Policy Office, Brussels and by the Swiss GAW-CH program. The FRS-FNRS and the Fédération Wallonie-Bruxelles are further acknowledged for observational activities support. We thank the International Foundation High Altitude Research Stations Jungfraujoch and Gornergrat (HFSJG, Bern) for supporting the facilities needed to perform the observations. MUSICA is funded by the European Research Council under the European Community's Seventh Framework Programme (FP7/2007-2013) / ERC Grant agreement n° 256961.

Separation and sampling of ice nucleation chamber generated ice particles by means of the counterflow virtual impactor technique for the characterization of ambient ice nuclei.

NASA Astrophysics Data System (ADS)

Schenk, Ludwig; Mertes, Stephan; Kästner, Udo; Schmidt, Susan; Schneider, Johannes; Frank, Fabian; Nillius, Björn; Worringen, Annette; Kandler, Konrad; Ebert, Martin; Stratmann, Frank

2014-05-01

In 2011, the German research foundation (DFG) research group called Ice Nuclei Research Unit (INUIT (FOR 1525, project STR 453/7-1) was established with the objective to achieve a better understanding concerning heterogeneous ice formation. The presented work is part of INUIT and aims for a better microphysical and chemical characterization of atmospheric aerosol particles that have the potential to act as ice nuclei (IN). For this purpose a counterflow virtual impactor (Kulkarni et al., 2011) system (IN-PCVI) was developed and characterized in order to separate and collect ice particles generated in the Fast Ice Nucleus Chamber (FINCH; Bundke et al., 2008) and to release their IN for further analysis. Here the IN-PCVI was used for the inertial separation of the IN counter produced ice particles from smaller drops and interstitial particles. This is realized by a counterflow that matches the FINCH output flow inside the IN-PCVI. The choice of these flows determines the aerodynamic cut-off diameter. The collected ice particles are transferred into the IN-PCVI sample flow where they are completely evaporated in a particle-free and dry carrier air. In this way, the aerosol particles detected as IN by the IN counter can be extracted and distributed to several particle sensors. This coupled setup FINCH, IN-PCVI and aerosol instrumentation was deployed during the INUIT-JFJ joint measurement field campaign at the research station Jungfraujoch (3580m asl). Downstream of the IN-PCVI, the Aircraft-based Laser Ablation Aerosol Mass Spectrometer (ALABAMA; Brands et al., 2011) was attached for the chemical analysis of the atmospheric IN. Also, number concentration and size distribution of IN were measured online (TROPOS) and IN impactor samples for electron microscopy (TU Darmstadt) were taken. Therefore the IN-PCVI was operated with different flow settings than known from literature (Kulkarni et al., 2011), which required a further characterisation of its cut-off-behaviour. Depending on the operation and thus freezing conditions inside FINCH (temperature/supersaturation), IN number concentrations between 1 and 200 per litre were detected by FINCH and a CPC mounted downstream of the IN-PCVI. The ALABAMA spectra of IN showed organic material from biomass burning and mineral dust particles mixed with organic material. The offline electron microscopy revealed that in average 80% of the IN consist of dust and metal oxides. 20 % are carbonaceous material, of which less than 5 % are soot. Bundke, U., Nillius, B., Jaenicke, R., Wetter, T., Klein, H., and Bingemer, H. (2008). The fast ice nucleus chamber finch. Atmospheric Research, 90:180-186. Brands, M., Kamphus, M., Böttger, T., Schneider, J., Drewnick, F., Roth, A., Curtius, J., Voigt, C., Borbon, A., Beekmann, M., Bourdon, A., Perrin, T. and Borrmann, S. (2011). Characterization of a newly developed aircraft-based laser ablation aerosol mass spectrometer (ALABAMA) and first field deployment in urban pollution plumes over Paris during MEGAPOLI 2009. Aerosol Sci. Technol., 45, 46-64. Kulkarni, G., Pekour, M., Afchine, A., Murphy, D. M., and Cziczo, D. J. (2011). Comparison of experimental and numerical studies of the performance characteristics of a pumped counterflow virtual impactor. Aerosol Science and Technology, 45(3):382-392.

Coating Characterization with the Quartz Crystal Microbalance

NASA Astrophysics Data System (ADS)

Sturdy, Lauren F.

The quartz crystal microbalance is a sensitive tool that can be used to measure the mass, modulus and phase angle of films of appropriate thicknesses. It is can be applied to systems with very varied properties, from liquid to solid, and under many different conditions. In this thesis its capabilities have been used to study the properties of several different systems of relevance to the coatings, art conservation, and rubber communities, in the process of which new techniques and tools were developed to analyze data and improve QCM data collection and experimental design. Alkyd resins, which have been used in artists' paints since the twentieth century, are the subject of the first studies. Alkyds are oil-modified polyesters. These resins are of interest because of their relatively recent use in art and how little is known of the mechanical properties in the early stages of cure. The QCM was shown to be sensitive to the curing process, changes in temperature, and mass change due to exposure to water. Kinetic studies during the first days of curing showed that the curing process can be divided into three regions. The first is dominated by solvent evaporation. In the second, oxygen absorption dominates and the mechanical properties change rapidly. The final stage extends from when the film is touch dry after about a day to years and is characterized by mass loss and continued increases in the modulus. Studying the curing at different temperatures revealed that the reactions do proceed much more rapidly at higher temperatures and an overall energy of activation was calculated for the curing process. The mechanical properties of alkyd resins containing zinc oxide, a white pigment, were studied with the QCM, nanoindentation and dynamic mechanical analysis. These measurements showed increases in the modulus with the inclusion of zinc oxide, and the QCM data showed that the second region started at earlier times as the pigment concentration was increased. Linseed oil is one of the starting materials for many alkyd resins and should cure similarly since the primary curing mechanisms are the same. It takes longer to cure than alkyds because it begins with no initial polymerization. Linseed oil was harder to study, as obtaining even films was difficult, multiple peaks at a single harmonic were observed, and the material properties during the early stages of curing led to a region where viscoelastic properties could not be calculated. To facilitate studying linseed oil, a multiple peak fitting method was developed to extract data from unusual peak shapes. With this ability, measurements at short times could be obtained despite poor film quality. Although linseed oil begins as a softer material than alkyds, its curing follows the same patterns as alkyd resins, exhibiting mass gain followed by mass loss, and sharp increases in modulus and decreases in phase angle during the early stages of curing. Having demonstrated the ability of the QCM to monitor curing, the QCM was also applied to uncrosslinked rubber systems. Rubbers, like the drying oils, contain double bonds which can react with oxygen, so first the oxidation of these materials was studied. In further studies oxidation was undesirable, so protocols were developed to limit oxidation. Measurements were made of homopolymers at different temperatures and the QCM measurements appear to be consistent with time-temperature superposition results obtained at lower frequencies. Blends of the various rubbers were studied and compared with models. The mechanical properties measured by the QCM were between the Voigt and Reuss predictions for most blends studied. Modeling the expected QCM response of layered rubbers matched the predictions of the Reuss model but not the measured values of the rubber blends, suggesting that the QCM is sensitive to different morphologies. Measurements with the QCM expanded our understanding of a variety of systems and proved to be a useful tool to measure mechanical changes during processes which are difficult to study by other methods.

Molecular hydrogen in the zabs = 2.66 damped Lyman-α absorber towards Q J 0643-5041. Physical conditions and limits on the cosmological variation of the proton-to-electron mass ratio

NASA Astrophysics Data System (ADS)

Albornoz Vásquez, D.; Rahmani, H.; Noterdaeme, P.; Petitjean, P.; Srianand, R.; Ledoux, C.

2014-02-01

Context. Molecular hydrogen in the interstellar medium (ISM) of high-redshift galaxies can be detected directly from its UV absorption imprinted in the spectrum of background quasars. Associated absorption from H i and metals allow for the study of the chemical enrichment of the gas, while the analysis of excited species and molecules make it possible to infer the physical state of the ISM gas. In addition, given the numerous H2 lines usually detected, these absorption systems are unique tools to constrain the cosmological variation of the proton-to-electron mass ratio, μ. Aims: We intend to study the chemical and physical state of the gas in the H2-bearing cloud at zabs = 2.658601 towards the quasar Q J 0643-5041 (zem = 3.09) and to derive a useful constraint on the variation of μ. Methods: We use high signal-to-noise ratio, high-resolution VLT-UVES data of Q J 0643-5041 amounting to a total of more than 23 h exposure time and fit the H i, metals, and H2 absorption features with multiple-component Voigt profiles. We study the relative populations of H2 rotational levels and the fine-structure excitation of neutral carbon to determine the physical conditions in the H2-bearing cloud. Results: We find some evidence for part of the quasar broad-line emission region not being fully covered by the H2-bearing cloud. We measure a total neutral hydrogen column density of log N(H i)(cm-2) = 21.03 ± 0.08. Molecular hydrogen is detected in several rotational levels, possibly up to J = 7, in a single component. The corresponding molecular fraction is log f = -2.19+0.07-0.08, where f = 2N(H2)/(2N(H2)+ N(H i)). The H2 Doppler parameter is of the order of 1.5 km s-1 for J = 0, 1, and 2 and larger for J> 2. The molecular component has a kinetic temperature of Tkin ≃ 80 K, which yields a mean thermal velocity of ~1 km s-1, consistent with the Doppler broadening of the lines. The UV ambient flux is of the order of the mean ISM Galactic flux. We discuss the possible detection of HD and derive an upper limit of log N(HD) ≲ 13.65 ± 0.07 leading to log HD/(2 × H2) ≲ - 5.19 ± 0.07, which is consistently lower than the primordial D/H ratio. Metals span ~210 km s-1 with [Zn/H] = -0.91 ± 0.09 relative to solar, with iron depleted relative to zinc [Zn/Fe] = 0.45 ± 0.06, and with the rare detection of copper. We follow the procedures used in our previous works to derive a constraint on the cosmological variation of μ, Δμ/μ = (7.4 ± 4.3stat ± 5.1syst) × 10-6. Based on data obtained with the Ultraviolet and Visual Echelle Spectrograph (UVES) at the European Southern Observatory Very Large Telescope (ESO-VLT), under program ID 080.A-0288(A) and archival data.Appendices are available in electronic form at http://www.aanda.orgReduced spectra (FITS files) are only available at the CDS via anonymous ftp to http://cdsarc.u-strasbg.fr (ftp://130.79.128.5) or via http://cdsarc.u-strasbg.fr/viz-bin/qcat?J/A+A/562/A88

In-situ single particle composition analysis of free tropospheric ice nuclei and ice residues in mixed-phase clouds during INUIT-JFJ 2013

NASA Astrophysics Data System (ADS)

Schmidt, Susan; Schneider, Johannes; Thomas, Klimach; Stephan, Mertes; Ludwig, Schenk; Udo, Kästner; Frank, Stratmann; Joachim, Curtius; Piotr, Kupiszewski; Ernest, Weingartner; Emanuel, Hammer; Paul, Vochezer; Martin, Schnaiter; Stephan, Borrmann

2014-05-01

In the framework of the DFG (deutsche Forschungsgemeinschaft)-funded research unit INUIT (Ice Nuclei research UnIT) a field campaign at the High Alpine Research Station Jungfraujoch (JFJ, Swiss Alps, Sphinx Laboratory, 3580 m asl; 7°59'2''E, 46°32'53''N) took place in January/February 2013 (INUIT-JFJ 2013). The goal of the measurements was to investigate the chemical composition of ice particle residues (IPR) in ambient air as well as the background aerosol particles. Previous investigations conducted at the JFJ showed that particles consisting of mineral components dominate the ice particle residue number (Kamphus et al., 2008) but also particles consisting of black carbon were found to be enriched in IPR (Mertes et al., 2007; Cozic et al., 2008). Cziczo et al. find out that lead as well is a good ice nucleus and was measured in IPR at previous measurements at the JFJ. During INUIT-JFJ 2013, the IPR were sampled out of mixed-phase clouds by an Ice-CVI (Ice Counterflow Virtual Impactor, Mertes et al., 2007) and an ISI (Ice Selective Inlet, Kupiszewski et al., 2013) and analyzed by the single particle mass spectrometer ALABAMA (Aircraft-based Laser Ablation Aerosol Mass Spectrometer; Brands et al., 2011). Additionally, the ALABAMA was connected to a total aerosol-inlet to investigate the chemical composition of background aerosol particles. During 217 hours of background aerosol measurements we analyzed more than 27000 aerosol particles, which consisted mainly of pure organic components or organics mixed with ammonium, metals or mineral components. During six cloud events with approximately 63 h measurement time we detected 162 IPR sampled by the Ice-CVI. The main part of these IPR were also composed of organic material mixed with other chemical compounds. Additionally, we found particles which consisted of mineral components (approximately 23 %). Sampling mixed-phase cloud through the ISI we measured during four cloud events 34 ice residues in approximately 30 h measurement time. The main part of the chemical compounds of these IPR were also organic material mixed with metals or with mineral compounds. We also found a smaller part of particles which consisted of pure mineral components (about 48 %). Lead was also found in the IPR measured behind Ice-CVI (~14 %) as well as in the background aerosol (~0.04 %). Black carbon particles were only found in the background aerosol. Because of the topography of the JFJ, air masses can reach the station only from the northwestern or southeastern direction (Hammer et al., 2013). Back trajectory calculations show that during our measurements the air masses were dominated mainly by long-distance transport from North America over Great Britain and France. This may explain the lower abundance of mineral dust in the ice residues compared to the previous studies. Brands, M., Kamphus, M., Böttger, T., Schneider, J., Drewnick, F., Roth, A., Curtius, J., Voigt, C., Borbon, A., Beekmann, M., Bourdon, A., Perrin, T. and Borrmann, S. (2011) Aerosol Sci. Technol., 45, 46-64. Cozic, J., Mertes, S., Verheggen, B., Cziczo, D. J., Gallavardin, S. J., Walter, S., Baltensperger, U. and Weingartner, E. (2008) J. Geophys. Res.-Atmos., 113, D15209. Cziczo, D. J., Stetzer. O., Worringen, A., Ebert, M., Weinbruch, S., Kamphus, M., Gallavardin, S. J., Curtius, J., Borrmann, S., Froyd, K. D., Mertes, S., Möhler, O., Lohmann, U. (2009) Nature Geoscience, 2, 333-336 Hammer, E., Bukowiecki, N., Gysel, M., Jurányi, Z., Hoyle, C. R., Vogt, R., Baltensperger, U. and Weingartner, E. (2013) Atmos. Chem. Phys. Discuss., 13, 20419-20462 Kamphus, M., Ettner-Mahl, M., Klimach, T., Drewnick, F, Keller, L., Cziczo, D. J., Mertes, S., Borrmann, S. and Curtius1, J. (2010) Atmos. Chem. Phys., 10, 8077-8095. Kupiszewski, P., Weingartner, E., Färber, R., Gysel, M., Hammer, E., Fuchs, C., Baltensperger, U., Vochezer, P., Schnaiter, M., Linke, C., Toprak, E., Mertes, S., Schneider, J., Schmidt, S. (2013) European Aerosol Conference, Prague. Mertes, S., Verheggen, B., Walter,S., Connolly,P., Ebert, M., Schneider, J., Bower, K. N., Cozic, J., Weinbruch, S., Baltensperger, U. and Weingartner, E. (2007) Aerosol Sci. Technol., 41, 848-864.

VLT/X-Shooter spectroscopy of the afterglow of the Swift GRB 130606A. Chemical abundances and reionisation at z ~ 6

NASA Astrophysics Data System (ADS)

Hartoog, O. E.; Malesani, D.; Fynbo, J. P. U.; Goto, T.; Krühler, T.; Vreeswijk, P. M.; De Cia, A.; Xu, D.; Møller, P.; Covino, S.; D'Elia, V.; Flores, H.; Goldoni, P.; Hjorth, J.; Jakobsson, P.; Krogager, J.-K.; Kaper, L.; Ledoux, C.; Levan, A. J.; Milvang-Jensen, B.; Sollerman, J.; Sparre, M.; Tagliaferri, G.; Tanvir, N. R.; de Ugarte Postigo, A.; Vergani, S. D.; Wiersema, K.; Datson, J.; Salinas, R.; Mikkelsen, K.; Aghanim, N.

2015-08-01

Context. The reionisation of the Universe is a process that is thought to have ended around z ~ 6, as inferred from spectroscopy of distant bright background sources, such as quasars (QSO) and gamma-ray burst (GRB) afterglows. Furthermore, spectroscopy of a GRB afterglow provides insight in its host galaxy, which is often too dim and distant to study otherwise. Aims: For the Swift GRB 130606A at z = 5.913 we have obtained a high S/N spectrum covering the full optical and near-IR wavelength region at intermediate spectral resolution with VLT/X-Shooter. We aim to measure the degree of ionisation of the intergalactic medium (IGM) between z = 5.02-5.84 and to study the chemical abundance pattern and dust content of its host galaxy. Methods: We estimated the UV continuum of the GRB afterglow using a power-law extrapolation, then measured the flux decrement due to absorption at Lyα,β, and γ wavelength regions. Furthermore, we fitted the shape of the red damping wing of Lyα. The hydrogen and metal absorption lines formed in the host galaxy were fitted with Voigt profiles to obtain column densities. We investigated whether ionisation corrections needed to be applied. Results: Our measurements of the Lyα-forest optical depth are consistent with previous measurements of QSOs, but have a much smaller uncertainty. The analysis of the red damping wing yields a neutral fraction xH i< 0.05 (3σ). We obtain column density measurements of H, Al, Si, and Fe; for C, O, S and Ni we obtain limits. The ionisation due to the GRB is estimated to be negligible (corrections <0.03 dex), but larger corrections may apply due to the pre-existing radiation field (up to 0.4 dex based on sub-DLA studies). Assuming that [ Si/Fe ] = +0.79 ± 0.13 is due to dust depletion, the dust-to-metal ratio is similar to the Galactic value. Conclusions: Our measurements confirm that the Universe is already predominantly ionised over the redshift range probed in this work, but was slightly more neutral at z> 5.6. GRBs are useful probes of the ionisation state of the IGM in the early Universe, but because of internal scatter we need a larger statistical sample to draw robust conclusions. The high [Si/Fe] in the host can be due to dust depletion, α-element enhancement, or a combination of both. The very high value of [ Al/Fe ] = 2.40 ± 0.78 might be due to a proton capture process and is probably connected to the stellar population history. We estimate the host metallicity to be -1.7 < [ M/H ] < -0.9 (2%-13% of solar). Based on observations carried out under prog. ID 091.C-0934(C) with the X-Shooter spectrograph installed at the Cassegrain focus of the Very Large Telescope (VLT), Unit 2 - Kueyen, operated by the European Southern Observatory (ESO) on Cerro Paranal, Chile. Partly based on observations made with the Nordic Optical Telescope, operated on the island of La Palma jointly by Denmark, Finland, Iceland, Norway, and Sweden, in the Spanish Observatorio del Roque de los Muchachos of the Instituto de Astrofísica de Canarias. Partly based on observations made with the Italian Telescopio Nazionale Galileo (TNG) operated on the island of La Palma by the Fundación Galileo Galilei of the INAF (Istituto Nazionale di Astrofisica) at the Spanish Observatorio del Roque de los Muchachos of the Instituto de Astrofísica de Canarias, under programme A26TAC_63.Appendix A is available in electronic form at http://www.aanda.orgThe reduced spectrum (FITS file) is only available at the CDS via anonymous ftp to http://cdsarc.u-strasbg.fr (ftp://130.79.128.5) or via http://cdsarc.u-strasbg.fr/viz-bin/qcat?J/A+A/580/A139

High Arctic paleoenvironmental and Paleoclimatic changes in the Mid-Cretaceous

NASA Astrophysics Data System (ADS)

Herrle, Jens; Schröder-Adams, Claudia; Selby, David; Du Vivier, Alice; Flögel, Sascha; McAnena, Alison; Davis, William; Pugh, Adam; Galloway, Jennifer; Hofmann, Peter; Wagner, Thomas

2014-05-01

Although major progress in Cretaceous (145-66 Ma) paleoclimate and paleoceanography has been made during the last decades (e.g., Hay, 2008, 2011; Föllmi, 2012 and references therein), our knowledge of high latitudinal environmental change remains largely unknown compared to low- and mid-latitude marine and terrestrial environments. Drilling the Arctic Ocean remains challenging and expensive, whereas the Sverdrup Basin provides excellent exposures on land. To fully understand the climate and paleoceanographic dynamics of the warm, equable greenhouse world of the Cretaceous Period it is important to determine polar paleotemperatures and to study paleoceanographic changes in a well-established and continuous bio- and chemostratigraphic context. Exceptional exposures of Cretaceous sediments on the central to southern part of Axel Heiberg Island at a Cretaceous paleolatitude of about 71°N (Tarduno et al., 1998) provide a unique window on the Cretaceous Arctic paleoenvironment and climate history (Schröder-Adams et al., 2014). Here we present high-resolution records combining sedimentological studies, U-Pb zircon geochronology, marine organic carbon isotopes and initial 187Os/188Os data, TEX86-derived sea-surface temperatures (SST) and climate modelling, that constrain the timing and magnitude of major Oceanic Anoxic Events (OAEs) and climate events constructed from a ~1.8 km sedimentary succession exposed on Axel Heiberg and Ellef Ringnens islands in the Canadian Arctic Archipelago. The first high latitude application of initial 187Os/188Os data are agreeable with global profiles (Du Vivier et al., 2014) indicating the widespread magmatic pulse of the Caribbean Large Igneous Province (LIP) at the onset of OAE2 but also record the emplacement of local High Arctic LIP prior to the OAE2 in the Sverdrup Basin. Initial SST data suggest a slightly lower meridional temperature gradient during the Middle/Late Albian compared to present and a similar to the present one during the OAE2 period which shades a new light on temperature gradients during different climate states of the Cretaceous. In contrast, to the Late Cenomanian to Early Turonian the distinct occurrence of several widespread glendonite beds in the Late Aptian to Early Albian support cool bottom waters of about 0°C in the Arctic Sverdrup Basin, consistent with much lower TEX86-SST ~28°C, McAnena et al., 2013) and bottom water temperatures (6°C, Huber et al., 2011) in the low latitude North Atlantic. This supports the global character of the proposed Late Aptian cold snap (Kemper, 1987; Herrle & Mutterlose, 2003; Mutterlose et al. 2009; McAnena et al. 2013) and perhaps a northern hemisphere high-latitude intermediate bottom water source. References Du Vivier, A.C.D., Selby, D., Sageman, B.B., Jarvis, I., Gröcke, D.R., Voigt, S., 2014. Marine 187Os/188Os isotope stratigraphy reveals the interaction of volcanism and ocean circulation during Oceanic Anoxic Event 2. EPSL 389, 23-33. Föllmi, K.B., 2012. Early Cretaceous life, climate and anoxia. Cretaceous Research 35, 230-257. Hay, W.W., 2008. Evolving ideas about the Cretaceous climate and ocean circulation. Cretaceous Research 29, 725-753. Hay, W.W., 2011. Can humans force a return to a "Cretaceous" climate? Sedimentary Geology 235, 5-26. Herrle, J.O. , Mutterlose, J., 2003. Calcareous nannofossils from the Aptian - early Albian of SE France: Paleoecological and biostratigraphic implications. Cretaceous Research 24, 1-22. Huber, B.T., MacLeod, K.G., Gröcke, D.R., Kucera, M., 2011. Paleotemperature and paleosalinity inferences and chemostratigraphy across the Aptian/Albian boundary in the subtropical North Atlantic. Paleoceanography 26, PA4221 doi:10.1029/2011PA002178. McAnena, A., Flögel, S., Hofmann, P., Herrle, J.O., Griesand, A., Pross, J., Talbot, H.M., Rethemeyer, J., Wallmann, K., Wagner, T., 2013. Atlantic cooling associated with a marine biotic crisis during the mid-Cretaceous period. Nature Geoscience 6, 558-561. Schröder-Adams, C.J., Herrle, J.O., Embry, A., Haggart, J.W., Galloway, J.M., Pugh, A.T., Harwood, D.M., 2014. Aptian to Santonian foraminiferal biostratigraphy and paleoenvironmental change in the Sverdrup Basin as revealed at Glacier Fiord, Axel Heiberg Island, Canadian Arctic Archipelago. Palaeogeography, Palaeoclimatology, Palaeoecology. (in press). Tarduno, J.A., Brinkman, D. B., Renne, P. R., Cottrell, R. D., Scher, H., Castillo, P., 1998. Evidence for Extreme Climatic Warmth from Late Cretaceous Arctic Vertebrates. Science 282, 2241-2244.

Synchrotron X-ray Applications Toward an Understanding of Elastic Anisotropy

NASA Astrophysics Data System (ADS)

Kanitpanyacharoen, Waruntorn

The contribution of this dissertation is to expand the current knowledge of factors and mechanisms that influence the development of preferred orientation of minerlas and pores in different materials, ranging from rocks in Earth's crust to minerals in the deep Earth. Preferred orientation--a main contributing component to elastic anisotropy--is however very challenging to quantify. The overall focus of this thesis thus aims to (1) apply the capabilities of synchrotron X-ray techniques to determine preferred orientations of hexagonal metals and shales under different conditions and (2) enhance our understanding of their relationships to the elastic properties. Lattice preferred orientation (LPO) or 'texture' of hexagonal close-packed iron (hcp- Fe) crystals during deformation has been suggested as the cause of the elastic anisotropy observed in Earth's inner core. However, relatively little is known about LPO of other hcp metals. An investigation of a wide range of hcp metals (Cd, Zn, Os, and Hf) as analogs to hcp-Fe was thus undertaken to better understand deformation mechanisms at high pressure and temperature in Chapter 2. Results show that all hcp metals preferentially align their c-axes near the compression axis during deformation but with considerable differences. The gradual texture evolution in Cd and Zn is mainly controlled by basal slip systems while a rapid texture development in Os and Hf at ambient temperature is due to a dominant role of tensile twinning, with some degree of basal slip. At elevated temperature, tensile twinning is suppressed and texturing is governed by combined basal and prismatic slip. Under all conditions, basal slip appears to be the main deformation mechanism in hcp metals at high pressure and temperature. These findings are similar to those of hcp-Fe and useful to better understand the deformation mechanisms of hcp metals and their implications for elastic anisotropy. In Chapter 3, a high-energy synchrotron X-ray diffraction technique was applied to characterize LPO and phase proportions of Posidonia Shale collected in the Hils Syncline from Germany, in order to examine the influence of clay content, burial depth, and thermal history. The samples used in this study had experienced different local temperatures during burial and uplifting, as established by the maturity of kerogen (0.68-1.45% vitrinite reflectance, Ro), but their constituent clay minerals, including kaolinite, illite-mica, and illite-smectite, show similar degrees of LPO in all samples, ranging between 3.7 and 6.3 multiple of random distribution (m.r.d.). These observations imply that the difference in local thermal history, which significantly affects the maturity of kerogen, at most marginally influences LPO of clays, as the alignment of clays was established early in the history. In Chapter 4, the SPO of constituents phases in Kimmeridge Shale (North Sea, UK) and Barnett Shale (Gulf of Mexico, USA) was quantified to a resolution of ˜1 mum by using synchrotron X-ray microtomography (SXMT) technique. Measurements were done at different facilities (ALS, APS, and SLS) to characterize 3D microstructures, explore resolution limitations, and develop satisfactory procedures for data quantification. Segmentation images show that the SPO of low density features, including pores, fractures, and kerogen, is mostly anisotropic and oriented parallel to the bedding plane. Small pores are generally dispersed, whereas some large fractures and kerogen have irregular shapes and remain aligned horizontally. In contrast, pyrite exhibits no SPO. The volume fractions and aspect ratios of low density features extracted from three synchrotron sources show excellent agreement with 6.3(6)% for Kimmeridge Shale and 4.5(4)% for Barnett Shale. A small variation is mainly due to differences of optical instruments and technical setups. The SXMT is proven to be a crucial technique to investigate 3D internal structures of fine-grained materials at high-resolution. A relationship between LPO, SPO, and elastic anisotropy of the Qusaiba Shale from the Rub'al-Khali basin in Saudi Arabia is established in Chapter 5. The Qusaiba samples exhibit strong LPO of clay minerals (2.4-6.8 m.r.d.) due to their high total clay content and high degree of compaction. The SPO of pores, fractures, and kerogen here are also anisotropic and organized mainly parallel to bedding, with little connectivity of the flat pores normal to the bedding. The microscopic information (LPO) extracted from different synchrotron X-ray techniques is then applied in different averaging approaches (Voigt, Reuss, Hill, and Geometric mean) to calculate macroscopic properties of shales. (Abstract shortened by UMI.)

BOOK REVIEW: Introduction to Computational Plasticity

NASA Astrophysics Data System (ADS)

Hartley, P.

2006-04-01

The use of computational modelling in all areas of science and engineering has in recent years escalated to the point where it underpins much of current research. However, the distinction must be made between computer systems in which no knowledge of the underlying computer technology or computational theory is required and those areas of research where the mastery of computational techniques is of great value, almost essential, for final year undergraduates or masters students planning to pursue a career in research. Such a field of research in the latter category is continuum mechanics, and in particular non-linear material behaviour, which is the core topic of this book. The focus of the book on computational plasticity embodies techniques of relevance not only to academic researchers, but also of interest to industrialists engaged in the production of components using bulk or sheet forming processes. Of particular interest is the guidance on how to create modules for use with the commercial system Abaqus for specific types of material behaviour. The book is in two parts, the first of which contains six chapters, starting with microplasticity, but predominantly on continuum plasticity. The first chapter on microplasticty gives a brief description of the grain structure of metals and the existence of slip systems within the grains. This provides an introduction to the concept of incompressibility during plastic deformation, the nature of plastic yield and the importance of the critically resolved shear stress on the slip planes (Schmid's law). Some knowledge of the notation commonly used to describe slip systems is assumed, which will be familiar to students of metallurgy, but anyone with a more general engineering background may need to undertake additional reading to understand the various descriptions. Any lack of knowledge in this area however, is of no disadvantage as it serves only as an introduction and the book moves on quickly to continuum plasticity. Chapter two introduces one of several yield criteria, that normally attributed to von Mises (though historians of mechanics might argue over who was first to develop the theory of yielding associated with strain energy density), and its two or three-dimensional representation as a yield surface. The expansion of the yield surface during plastic deformation, its translation due to kinematic hardening and the Bauschinger effect in reversed loading are described with a direct link to the material stress-strain curve. The assumption, that the increment of strain is normal to the yield surface, the normality principle, is introduced. Uniaxial loading of an elastic-plastic material is used as an example in which to develop expressions to describe increments in stress and strain. The full presentation of numerous expressions, tensors and matrices with a clear explanation of their development, is a recurring, and commendable, feature of the book, which provides an invaluable introduction for those new to the subject. The chapter moves on from time-independent behaviour to introduce viscoplasticity and creep. Chapter three takes the theories of deformation another stage further to consider the problems associated with large deformation in which an important concept is the separation of the phenomenon into material stretch and rotation. The latter is crucial to allow correct measures of strain and stress to be developed in which the effects of rigid body rotation do not contribute to these variables. Hence, the introduction of 'objective' measures for stress and strain. These are described with reference to deformation gradients, which are clearly explained; however, the introduction of displacement gradients passes with little comment, although velocity gradients appear later in the chapter. The interpretation of different strain measures, e.g. Green--Lagrange and Almansi, is covered briefly, followed by a description of the spin tensor and its use in developing the objective Jaumann rate of stress. It is tempting here to suggest that a more complete description should be given together with other measures of strain and stress, of which there are several, but there would be a danger of changing the book from an `introduction' to a more comprehensive text, and examples of such exist already. Chapter four begins the process of developing the plasticity theories into a form suitable for inclusion in the finite-element method. The starting point is Hamilton's principle for equilibrium of a dynamic system. A very brief introduction to the finite-element method is then given, followed by the finite-element equilibrium equations and a description of how they are incorporated into Hamilton's principle. A useful clarification is provided by comparing tensor notation and the form normally used in finite-element expressions, i.e. Voigt notation. The chapter concludes with a brief overview of implicit integration methods, i.e. tangent stiffness, initial tangent stiffness and Newton Raphson. Chapter five deals with the more specialized topic of implicit and explicit integration of von Mises plasticity. One of the techniques described is the radial-return method which ensures that the stresses at the end of an increment of deformation always lie on the expanded yield surface. Although this method guarantees a solution it may not always be the most accurate for large deformation, this is one area where reference to alternative methods would have been a helpful addition. Chapter six continues with further detail of how the plasticity models may be incorporated into finite-element codes, with particular reference to the Abaqus package and the use of user-defined subroutines, introduced via a `UMAT' subroutine. This completes part I of the book. Part II focuses on plasticity models, each chapter dealing with a particular process or material model. For example, chapter seven deals with superplasticity, chapter eight with porous plasticity, chapter nine with creep and chapter ten with cyclic plasticity, creep and TMF. Examples of deep drawing, forming of titanium metal-matrix composites and creep damage are provided, together with further guidelines on the use of Abaqus to model these processes. Overall, the book is organised in a very logical and readable form. The use of simple one-dimensional examples, with full descriptions of tensors and vectors throughout the book, is particularly useful. It provides a good introduction to the topic, covering much of the theory and with applications to give a good grounding that can be taken further with more comprehensive advanced texts. An excellent starting point for anyone involved in research in computational plasticity.

A complex Lyman limit system at z=1.9 towards HS 1103+6416

NASA Astrophysics Data System (ADS)

Köhler, S.; Reimers, D.; Tytler, D.; Hagen, H.-J.; Barlow, T.; Burles, S.

1999-02-01

We analyse absorption lines in optical and ultraviolet spectra of the bright (V=15.8, z=2.19) QSO HS 1103+6416. High-resolution (FWHM =8 km s(-1) ) optical spectra have been obtained with the Keck 10 m telescope in the range from 3180 to 5780 Angstroms. Ultraviolet observations in the range from 1150 to 3280 Angstroms were performed with the FOS and the GHRS onboard the Hubble Space Telescope (HST). In this paper we concentrate our discussion on a complex Lyman limit system (LLS) at z=1.89. Absorption lines by carbon, silicon and aluminum in the optical spectra reveal a complex velocity structure with at least 11 components spanning a velocity range of 200 km s(-1) . From the Lyman limit in the ultraviolet spectra we derive a total neutral hydrogen column density of log N(H i) =17.46 cm(-2) . Column densities of heavy elements in the individual components were derived by Voigt profile fitting. The eleven components can be subdivided roughly into three groups: Components 2, 3 and 6 with radial velocities v = -129... -95 km s(-1) with low ionization (L), components 4, 5, 7, 8 (v = -75... +2) with intermediate ionization (I), and components 1, 9, 10, 11 (v = -129, +34... +57) with high ionization (H). In order to study the ionization and abundances in these systems we compare the observed column densities with photoionization models. The observed absorption in the optical data can be explained by individual clouds with slightly varying metal abundances photoionized by slightly different radiation fields. Highly ionized components favour the extragalactic radiation field as calculated by Haardt & Madau (\\cite{Haardt96}) while the components of low and intermediate ionization are better reproduced with a harder ionizing radiation field. Obviously local sources like stars can therefore be excluded as the main ionizing sources. Observational parameters for HST spectra of HS 1103+6416. <~bel{obs} Detector/Grating Exposure time Resolution Observed range Date Offset S/N_{subs{max}} [s] FWHM [Angstroms] [Angstroms] [Angstroms] AMBER/G270H 5336 2 2223-3277 Oct 31 1995 0.5 46 AMBER/G190H 8628 1.44 1572-2311 Oct 31 1995 1.24 21 DET1/G140L 17408 0.77 1415-1700 Jul 9 1996 0.66 8 DET1/G140L 22739 0.77 1150-1436 Jul 9 1996 0.66 12 Abundances in components L and I appear to be slightly different from those in the high ionization component H. In L and I we find roughly [C/H] = -0.9 while H has [C/H] = -1.2, consistent with the expectation that in a galaxy or groups of galaxies the abundances in the higher ionized `Halo' component are lower. The relative element abundances are also different. While in components L and I [Si/C] ~ 0.2, barely significant, and [S/C] and [O/C] ~ 0 within the uncertainties, component H shows [Si/C] = 0.5 and in addition [O/C] and [S/C] = 0.4 (both from HST spectra). [Al/C] measurable only in L and I is always ~ 0. The tendency of enhanced alpha element (O, Si, S) abundances at low C abundance is consistent with what is known from nucleosynthesis theory (SNII dominant at the beginning of galactic evolution), from metal deficient stars in our galaxy and from QSO absorption line systems. If all components were ionized by the same radiation field the relative overabundances of O and S in the highly ionized components would be even larger. We show that HS 1103+6416 will offer in the future for the first time the possibility to measure the cosmic He abundance at high redshift. Detailed calculations of He i absorption using the multicomponent model which explains the metal lines shows consistency with the observed first seven series members of the He i 584, 537, 522 Angstroms ... series for a helium abundance Y=0.24, the expected cosmic He abundance from Big Bang nucleosynthesis modified by stellar nucleosynthesis at ~ 1/10 solar metallicity. The presence of O i and possibly O vi absorption cannot be explained by our photoionization models and might hint at the existence of additional mainly neutral components with relatively low H i column density and further ionization mechanisms like, e.g., collisional ionization. Based on observations with the NASA/ESA Hubble Space Telescope, obtained at the Space Telescope Science Institute, which is operated by Aura, Inc., under NASA contract NAS 5--26\\,555. Optical data presented herein were obtained at the W.M.\\ Keck Observatory, which is operated as a scientific partnership among the California Institute of Technology, the University of California and the National Aeronautics and Space Administration. The Observatory was made possible by the generous financial support of the W.M.\\ Keck Foundation.

PREFACE: Rheology and Elasticity Studies at Ultra-High Pressures and Temperatures

NASA Astrophysics Data System (ADS)

Liu, Haozhe; Wenk, Hans-Rudolf; Duffy, Thomas S.

2006-06-01

One of the major goals of geophysical research is to understand deformation in the deep Earth. The COMPRES (Consortium for Materials Properties Research in Earth Sciences) workshop on `Rheology and Elasticity Studies at Ultra-High Pressures and Temperatures' was held on 21-23 October 2005 at the Advanced Photon Source, Argonne National Laboratory, organized by Haozhe Liu, Hans-Rudolf Wenk and Thomas S Duffy, and provided an opportunity to assemble more than 50 scientists from six countries. Experts in diamond anvil cell (DAC) design, large-volume high-pressure apparatus and data analysis defined the current state of ultra-high pressure deformation studies and explored initiatives to push the technological frontier. The DAC, when used in radial diffraction geometry, emerges as a powerful tool for investigation of plasticity and elasticity of materials at high pressures. More information regarding this workshop can be found at the website: http://www.hpcat.aps.anl.gov/Hliu/Workshop/Index1.htm. In this special issue of Journal of Physics: Condensed Matter, 17 manuscripts review the state-of-the-art and we hope they will stimulate researchers to participate in this field and take it forward to a new level. A major incentive for high-pressure research has been the need of geophysicists to understand composition, physical properties and deformation in the deep Earth in order to interpret the macroscopically observed seismic anisotropy. In the mantle and core, materials deform largely in a ductile manner at low stresses and strain rates. From observational inferences and experiments at lower pressures, it is considered plausible that deformation occurs in the field of dislocation creep or diffusion creep and deformation mechanisms depend in a complex way on stress, strain rate, pressure, temperature, grain size and hydration state. With novel apparatus such as the rotational Drickamer press or deformation DIA (D-DIA) multianvil apparatus, large volumes (approximately 10 mm3) of materials can be deformed at pressure and temperature. Unfortunately these experiments do not currently extend to pressures of the lower mantle, which comprises most of the volume of the Earth. Thus deformation mechanisms of minerals such as perovskite (in the lower mantle), post-perovskite (in the anisotropic D" zone) and epsilon-iron (in the inner core) remain enigmatic. Here developments in the DAC offer new opportunities. At present, this is a novel, and in many ways still very primitive, method to deform minerals at high pressure, confined to room temperature and moderate strains. No doubt this will change in the near future as new technologies become implemented, for example laser heating, remote pressure control, especially fine control of strain rate during compression, decompression and cycling procedures for DAC radial diffraction studies. The first paper, by Bassett, gives a perspective on the significance of stress in DAC experiments. An issue once considered by many a nuisance has become a gold mine when it comes to unravelling material properties at very high pressures. At high pressures many silicates and oxides become ductile, even at room temperature, and ductile deformation results in development of preferred orientation that can be used to infer deformation mechanisms as illustrated in the reviews by Wenk et al and Merkel. Mao et al investigate the strength of solidified argon and find it increases greatly and exceeds 2.7~GPa with applied pressure at 55 GPa. Singh et al investigate the dependence of strength on grain size by studying nanocrystalline gold, while Yoneda and Kubo use axial diffraction geometry to determine both mean pressure and deviatoric stress of gold. Miyagi et al illustrate the Rietveld method for quantitative texture analysis of CaSiO3 perovskite. Speziale et al map strain gradients in the DAC by investigating texture variations in copper to 25 GPa. Naturally, efficient and accurate image processing is a requirement for reduction and analysis of diffraction data (Hinrichsen et al). A complementary study by Conil and Kavner explores DAC heterogeneities with numerical methods. Using the D-DIA multianvil apparatus, the differential lattice strains in polycrystalline Fe2SiO4 and MgO are measured to investigate the evolution of the weighting factor for Reuss and Voigt bounds during plastic flow by Chen et al, while Weidner and Li study MgO and mixtures of MgO and spinel (MgAl2O4) for fabric and residual stresses development during a plastic deformation cycle. Mao and Mao describe an ingenious device for remote pressure control and demonstrate it with a sample of platinum to 230 GPa. Large strains can be obtained with a rotational DAC and this influences the pressure at which the α-epsilon transition occurs in iron (Ma et al). Chesnut et al introduce a new DAC adapted for radial diffraction geometry. While much of the current DAC work in radial geometry is done with monochromatic x-rays and angle dispersive 2D detectors, the radial x-ray diffraction program at X17C of NSLS at energy dispersive XRD geometry is reviewed by Hu et al. Meng et al introduce the double-sided laser heating technique at ID-B of HPCAT, and propose a rotational design for applying the laser heating technique to radial x-ray diffraction studies at simultaneous high pressure-temperature (PT) conditions. These contributions provide a sound introduction and overview of the current science for anyone interested in elasticity and plasticity of materials at ultrahigh pressure. We are grateful to Dr Richard Palmer and Professor Marshall Stoneham for the opportunity to publish these carefully selected and reviewed proceedings in Journal of Physics: Condensed Matter where they reach a large audience. We acknowledge the authors for contributing exciting papers to this issue, to participants at the workshop for stimulating presentations and discussions, and to many reviewers whose suggestions improved the manuscripts. We are most grateful to COMPRES and its Director Dr Robert Liebermann for generous financial support of this workshop, and the support from local organizing committee Veronica O'Connor, Dave Mao, Guoyin Shen and other HPCAT staff. The goal of the project was not to provide final conclusions in a dynamic field but to stimulate progress.

Composition of uppermost mantle beneath the Northern Fennoscandia - numerical modeling and petrological interpretation

NASA Astrophysics Data System (ADS)

Virshylo, Ivan; Kozlovskaya, Elena; Prodaivoda, George; Silvennoinen, Hanna

2013-04-01

Studying of the uppermost mantle beneath the northern Fennoscandia is based on the data of the POLENET/LAPNET passive seismic array. Firstly, arrivals of P-waves of teleseismic events were inverted into P-wave velocity model using non-linear tomography (Silvennoinen et al., in preparation). The second stage was numerical petrological interpretation of referred above velocity model. This study presents estimation of mineralogical composition of the uppermost mantle as a result of numerical modeling. There are many studies concerning calculation of seismic velocities for polymineral media under high pressure and temperature conditions (Afonso, Fernàndez, Ranalli, Griffin, & Connolly, 2008; Fullea et al., 2009; Hacker, 2004; Xu, Lithgow-Bertelloni, Stixrude, & Ritsema, 2008). The elastic properties under high pressure and temperature (PT) conditions were modelled using the expanded Hook's law - Duhamel-Neumann equation, which allows computation of thermoelastic strains. Furthermore, we used a matrix model with multi-component inclusions that has no any restrictions on shape, orientation or concentration of inclusions. Stochastic method of conditional moment with computation scheme of Mori-Tanaka (Prodaivoda, Khoroshun, Nazarenko, & Vyzhva, 2000) is applied instead of traditional Voigt-Reuss-Hill and Hashin-Shtrikman equations. We developed software for both forward and inverse problem calculation. Inverse algorithm uses methods of global non-linear optimization. We prefer a "model-based" approach for ill-posed problem, which means that the problem is solved using geological and geophysical constraints for each parameter of a priori and final models. Additionally, we are checking at least several different hypothesis explaining how it is possible to get the solution with good fit to the observed data. If the a priori model is close to the real medium, the nearest solution would be found by the inversion. Otherwise, the global optimization is searching inside the restricted volume in the multi-dimensional parameter space. In order to constrain concentration of minerals we used equilibrium of mineral associations for selected P-T condition obtained by free Gibbs energy minimization (c.f. Stixrude & Lithgow-Bertelloni, 2005). We also considered the mineralogical composition of upper mantle xenoliths, although the representativeness of xenoliths in Precambrian rocks could be treated with care, if one tries to describe the modern mantle. As a first step, we estimated 1D model of mineralogical composition in the depth range of 35-350 km using the IASP91 reference model (Kennett & Engdahl, 1991). Both the P- and S- wave velocities were used for inversion, in order to improve the reliability of the model. More comprehensive result could be obtained if density distribution is involved. In our study we used the 1D PEMC density model (Dziewonski, Hales & Lapwood, 1975) as it is the most adequate for the continental lithosphere. The 1D modeling showed that the garnet lherzolite model (forsterite, fayalite, enstatite, ferrosilite, diopside, jadeite, pyrope) can be considered as a basic one. The end-members of olivine and orthopyroxene solutions were included with the aim of Fe/Mg ratio estimation. Testing with modified models including hedenbergite, harzburgite spinel, etc. showed that these minerals have no significant influence on bulk elastic properties. Selected set of minerals allows modelling the most species of peridote-pyroxenite associations known from xenoliths investigations (Kukkonen, Kuusisto, Lehtonen, & Peltonen, 2008; Lehtonen, O'Brien, Peltonen, Johanson, & Pakkanen, 2004). However, there exist also a number of evidences for mantle eclogite xenoliths from the region under study and its surrounding (Lehtonen et al., 2004; Peltonen, Kinnunen, & Huhma, 2002). That is why we also made modelling for garnet-clinopyroxene model of eclogite. The volumetric mineral compositions obtained were transformed into weight concentration of rock-forming oxides using stoichiometric formulas. The results indicate significant variation of Fe and Mg oxides concentration in the uppermost mantle. The Mg/Fe ratio could be different from the results of previous studies (Griffin et al., 2003; Svetov & Smolkin, 2003), but it is in agreement with the geophysical models considered in our study. At the same time the SiO2 concentration is close to the chemical composition of xenoliths from the Fennoscandia, including Kola Peninsula and Central Finland (Beard, Downes, Mason, & Vetrin, 2007; Kukkonen et al., 2008; Lehtonen et al., 2004). Brief conclusions from our study could be formulated as follows: 1) Modelling confirms potential significant lateral inhomogeneity of mineral composition of the uppermost mantle of northern Fennoscandian Shield. 2) Lherzolitic composition of the mantle lithosphere generally explains seismic velocities obtained by teleseismic tomography in northern Fennoscandian Shield. It could be used as a primary a priori model for interpretation. But potential presence of eclogites cannot be rejected, at least for some parts of studied area. 3) The future study needs to include more precise evaluation of temperature and density in the upper mantle using gravity and heat flow data. Afonso, J. C., Fernàndez, M., Ranalli, G., Griffin, W. L., & Connolly, J. a. D. (2008). Integrated geophysical-petrological modeling of the lithosphere and sublithospheric upper mantle: Methodology and applications. Geochemistry Geophysics Geosystems, 9(5). doi:10.1029/2007GC001834 Beard, a. D., Downes, H., Mason, P. R. D., & Vetrin, V. R. (2007). Depletion and enrichment processes in the lithospheric mantle beneath the Kola Peninsula (Russia): Evidence from spinel lherzolite and wehrlite xenoliths. Lithos, 94(1-4), 1-24. doi:10.1016/j.lithos.2006.02.002 Dziewonski, A.M., A.L. Hales, & E.R. Lapwood. (1975) Parametrically simple earth models consistent with geophysical data Phys. Earth Plan. Int. 10:12. Fullea, J., Afonso, J. C., Connolly, J. A. D., Fernàndez, M., García-Castellanos, D., & Zeyen, H. (2009). LitMod3D: An interactive 3-D software to model the thermal, compositional, density, seismological, and rheological structure of the lithosphere and sublithospheric upper mantle. Geochemistry Geophysics Geosystems, 10(8), 1-21. doi:10.1029/2009GC002391 Griffin, W. ., O'Reilly, S. ., Abe, N., Aulbach, S., Davies, R. ., Pearson, N. ., Doyle, B. ., et al. (2003). The origin and evolution of Archean lithospheric mantle. Precambrian Research, 127(1-3), 19-41. doi:10.1016/S0301-9268(03)00180-3 Hacker, B. R. (2004). Subduction Factory 3: An Excel worksheet and macro for calculating the densities, seismic wave speeds, and H 2 O contents of minerals and rocks at pressure and temperature. Geochemistry Geophysics Geosystems, 5(1), 1-7. doi:10.1029/2003GC000614 Kennett B.L.N. & Engdahl E.R. (1991) Travel times for global earthquake location and phase association. Geophysical Journal International, 105:429-465. Kukkonen, I., Kuusisto, M., Lehtonen, M., & Peltonen, P. (2008). Delamination of eclogitized lower crust: Control on the crust-mantle boundary in the central Fennoscandian shield. Tectonophysics, 457(3-4), 111-127. doi:10.1016/j.tecto.2008.04.029 Lehtonen, M. L., O'Brien, H. E., Peltonen, P., Johanson, B. S., & Pakkanen, L. K. (2004). Layered mantle at the Karelian Craton margin: P - T of mantle xenocrysts and xenoliths from the Kaavi - Kuopio kimberlites , Finland. Lithos, 77, 593-608. doi:10.1016/j.lithos.2004.04.026 Peltonen, P., Kinnunen, K. A., & Huhma, H. (2002). Petrology of two diamondiferous eclogite xenoliths from the Lahtojoki kimberlite pipe , eastern Finland. Lithos, 63, 151-164. Prodaivoda, G. T., Khoroshun, L. P., Nazarenko, L. V, & Vyzhva, S. A. (2000). Mathematical modeling of the azimuthal anisotropy in thermoelasic properties of the oceanic upper mantle. IzvestiyaPhysics of the Solid Earth, 36(5), 394-405. Stixrude, L., & Lithgow-Bertelloni, C. (2005). Thermodynamics of mantle minerals - I. Physical properties. Geophysical Journal International, 162(2), 610-632. Retrieved from http://discovery.ucl.ac.uk/8891/ Svetov, S. A., & Smolkin, V. F. (2003). Model P - T Conditions of High-Magnesia Magma Generation in the Precambrian of the Fennoscandian Shield. Geochemistry International, 41(8), 799-811. Xu, W., Lithgow-Bertelloni, C., Stixrude, L., & Ritsema, J. (2008). The effect of bulk composition and temperature on mantle seismic structure. Earth and Planetary Science Letters, 275(1-2), 70-79. doi:10.1016/j.epsl.2008.08.012

Space Environment Effects on Materials : An Overview

NASA Technical Reports Server (NTRS)

Garrett, Henry B.

2006-01-01

A general overview on the space environment and its effects on materials is presented. The topics include: 1) Impact of Space Effects on Spacecraft Costs; 2) Space Environment Effects on Spacecraft by Source; 3) Primary Source of Space Effects: The Sun; 4) The Earth's Environment; 5) Trapped Radiation Belts; 6) Aurora Are Everywhere; 7) Spacecraft Interactions; 8) Atmospheric Effects; 9) Contaminant Effects on Materials; 10) Meteoroid/Debris Effects on Materials; 11) Spacecraft Surface Charging; 12) Surface Discharge Effects; 13) Internal Electrostatic Discharge--Satellite Killer; 14) Plasma Interactions DS-1 Ion Engines; 15) Radiation Effects on Spacecraft Systems and Materials; 16) Total Ionizing Dose Effects Total Ionizing Dose Effects; 17) Man-Made Sources of Space Effects Man-Made Sources of Space Effects; and 18) Space Environments Versus Interactions.

15 CFR 930.151 - Interstate coastal effect.

Code of Federal Regulations, 2010 CFR

2010-01-01

... management program. Effects are not just environmental effects, but include effects on coastal uses. Effects include both direct effects which result from the activity and occur at the same time and place as the... time or farther removed in distance, but are still reasonably foreseeable. Indirect effects are effects...

1987 Annual Conference on Nuclear and Space Radiation Effects, Snowmass Village, CO, July 28-31, 1987, Proceedings

NASA Technical Reports Server (NTRS)

1987-01-01

Various papers on nuclear and space radiation effects are presented. The general topics addressed include: basic mechanisms of radiation effects, single-event phenomena, temperature and field effects, modeling and characterization of radiation effects, IC radiation effects and hardening, and EMP/SGEMP/IEMP phenomena. Also considered are: dosimetry/energy-dependent effects, sensors in and for radiation environments, spacecraft charging and space radiation effects, radiation effects and devices, radiation effects on isolation technologies, and hardness assurance and testing techniques.

Proton Damage Effects on Carbon Nanotube Field-Effect Transistors

DTIC Science & Technology

2014-06-19

PROTON DAMAGE EFFECTS ON CARBON NANOTUBE FIELD-EFFECT TRANSISTORS THESIS Evan R. Kemp, Ctr...United States. AFIT-ENP-T-14-J-39 PROTON DAMAGE EFFECTS ON CARBON NANOTUBE FIELD-EFFECT TRANSISTORS THESIS Presented to...PROTON DAMAGE EFFECTS ON CARBON NANOTUBE FIELD-EFFECT TRANSISTORS Evan R. Kemp, BS Ctr, USAF Approved: // Signed

What matters when judging intentionality-moral content or normative status? Testing the rational scientist model of the side-effect.

PubMed

Papadopoulos, C; Hayes, B K

2018-06-01

Previous work has demonstrated a "side-effect effect," such that intentionality is more likely to be attributed to agents who bring about negatively valenced as opposed to positively valenced side effects. The rational-scientist model explains this by suggesting that norm-violating side effects are more informative for inferring intentionality than norm-conforming side effects. In the present study we reexamined this account, addressing limitations of previous empirical tests (e.g., Uttich & Lombrozo, Cognition 116: 87-100, 2010). Side-effect valence and norm status were manipulated factorially, enabling an examination of the impact of norm status on intentionality judgments in both positively and negatively valenced side effects. Additionally, the impact of side-effect norm status on the perceived valences of side effects and agents was examined. Effects of norm status were found for both positive and negative side effects. Violation of an ostensibly neutral norm led to negative perceptions of the side effect. However, a norm status effect on intentionality judgments persisted when these effects were controlled. These results support the view that the side-effect effect is the result of the rational use of social-cognitive evidence.

No blank slates: Pre-existing schemas about pharmaceuticals predict memory for side effects.

PubMed

Heller, Monika K; Chapman, Sarah C E; Horne, Rob

2017-04-01

Attribution of symptoms as medication side effects is informed by pre-existing beliefs about medicines and perceptions of personal sensitivity to their effects (pharmaceutical schemas). We tested whether (1) pharmaceutical schemas were associated with memory (recall/recognition) for side effect information (2) memory explained the attribution of a common unrelated symptom as a side effect. In this analogue study participants saw the patient leaflet of a fictitious asthma drug listing eight side effects. We measured recall and recognition memory for side effects and used a vignette to test whether participants attributed an unlisted common symptom (headache) as a side effect. Participants who perceived pharmaceuticals as more harmful in general recalled fewer side effects correctly (r Correct Recall  = -.273), were less able to differentiate between listed and unlisted side effects (r Recognition Sensitivity  = -.256) and were more likely to attribute the unlisted headache symptom as a side effect (r side effect attribution  = .381, ps < .01). The effect of harm beliefs on side effect attribution was partially mediated by correct recall of side effects. Pharmaceutical schemas are associated with memory for side effect information. Memory may explain part of the association between pharmaceutical schemas and the attribution of unrelated symptoms as side effects.

Influence of verbal instructions on effect-based action control.

PubMed

Eder, Andreas B; Dignath, David

2017-03-01

According to ideomotor theory, people use bidirectional associations between movements and their effects for action selection and initiation. Our experiments examined how verbal instructions of action effects influence response selection without prior experience of action effects in a separate acquisition phase. Instructions for different groups of participants specified whether they should ignore, attend, learn, or intentionally produce acoustic effects produced by button presses. Results showed that explicit instructions of action-effect relations trigger effect-congruent action tendencies in the first trials following the instruction; in contrast, no evidence for effect-based action control was observed in these trials when instructions were to ignore or to attend to the action effects. These findings show that action-effect knowledge acquired through verbal instruction and direct experience is similarly effective for effect-based action control as long as the relation between the movement and the effect is clearly spelled out in the instruction.

Does the use of efficacy or effectiveness evidence in cost-effectiveness analysis matter?

PubMed

Dilokthornsakul, Piyameth; Chaiyakunapruk, Nathorn; Campbell, Jonathan D

2017-01-02

To test the association of clinical evidence type, efficacy-based or effectiveness-based ("E"), versus whether or not asthma interventions' cost-effectiveness findings are favorable. We conducted a systematic review of PubMed, EMBASE, Tufts CEA registry, Cochrane CENTRAL, and the UK National Health Services Economic Evaluation Database from 2009 to 2014. All cost-effectiveness studies evaluating asthma medication(s) were included. Clinical evidence type, "E," was classified as efficacy-based if the evidence was from an explanatory randomized controlled trial(s) or meta-analysis, while evidence from pragmatic trial(s) or observational study(s) was classified as effectiveness-based. We defined three times the World Health Organization cost-effectiveness willingness-to-pay (WTP) threshold or less as a favorable cost-effectiveness finding. Logistic regression tested the likelihood of favorable versus unfavorable cost-effectiveness findings against the type of "E." 25 cost-effectiveness studies were included. Ten (40.0%) studies were effectiveness-based, yet 15 (60.0%) studies were efficacy-based. Of 17 studies using endpoints that could be compared to WTP threshold, 7 out of 8 (87.5%) effectiveness-based studies yielded favorable cost-effectiveness results, whereas 4 out of 9 (44.4%) efficacy-based studies yielded favorable cost-effectiveness results. The adjusted odds ratio was 15.12 (95% confidence interval; 0.59 to 388.75) for effectiveness-based versus efficacy-based achieving favorable cost-effectiveness findings. More asthma cost-effectiveness studies used efficacy-based evidence. Studies using effectiveness-based evidence trended toward being more likely to disseminate favorable cost-effective findings than those using efficacy. Health policy decision makers should pay attention to the type of clinical evidence used in cost-effectiveness studies for accurate interpretation and application.

The Expertise Reversal Effect Is a Variant of the More General Element Interactivity Effect

ERIC Educational Resources Information Center

Chen, Ouhao; Kalyuga, Slava; Sweller, John

2017-01-01

Within the framework of cognitive load theory, the element interactivity and the expertise reversal effects usually are not treated as closely related effects. We argue that the two effects may be intertwined with the expertise reversal effect constituting a particular example of the element interactivity effect. Specifically, the element…

Effect of Communication Style on Perceptions of Medication Side Effect Risk among Pharmacy Students.

PubMed

Sawant, Ruta V; Beatty, Collin R; Sansgiry, Sujit S

2016-10-25

Objective. To assess the effect of communication style, and frequency and severity of medication side-effects, on pharmacy students' perception of risk of experiencing side effects. Methods. One hundred responses from pharmacy students were obtained using an online survey. Participants were presented with a drug information box containing drug name, drug usage, and one side-effect associated with the drug. Information on side-effect for each drug was presented in one of eight experimental conditions, in a 2 (side-effect frequency: low, high), X2 (side-effect severity: mild, severe) X2 (communication style: verbal, verbal + natural frequency) factorial design. Risk perception of experiencing side effects was measured. Results. Communication style was found to have a significant impact on risk perception depending on the context of frequency and severity associated with the side effect. Conclusion. Communication style plays a significant role in formulating risk perceptions of medication side effects. Training in pharmaceutical counseling should include special emphasis on effective language use.

Longitudinal multilevel models of the big-fish-little-pond effect on academic self-concept: counterbalancing contrast and reflected-glory effects in Hong Kong schools.

PubMed

Marsh, H W; Kong, C K; Hau, K T

2000-02-01

Longitudinal multilevel path models (7,997 students, 44 high schools, 4 years) evaluated effects of school-average achievement and perceived school status on academic self-concept in Hong Kong, which has a collectivist culture with a highly achievement-segregated high school system. Consistent with a priori predictions based on the big-fish-little-pond effect (BFLPE), higher school-average achievements led to lower academic self-concepts (contrast effect), whereas higher perceived school status had a counterbalancing positive effect on self-concept (reflected-glory, assimilation effect). The negative BFLPE is the net effect of counterbalancing influences, stronger negative contrast effects, and weaker positive assimilation effects so that controlling perceived school status led to purer--and even more negative--contrast effects. Attending a school where school-average achievement is high simultaneously resulted in a more demanding basis of comparison for one's own accomplishments (the stronger negative contrast effect) and a source of pride (the weaker positive assimilation effect).

Biological Effects of Atomic Radiations; ACCIONES BIOLOGICAS DE LAS RADIACIONES ATOMICAS

DOE Office of Scientific and Technical Information (OSTI.GOV)

Patetta-Queirolo, M.A.

1959-02-01

A resume is presented of each class in a course on the biological effects of nuclear radiations. The topics discussed include the physical and chemical bases of radiation effects, primary and secondary processes, accumulated effects, biochemical and cellular effects, radiation effects on living organisms and tissues, radioecology, genetic effects, cytogenetic effects, genetics of radiation in mammals, response of mammals to irradiation, dosimetry, and protection against radiations. (J.S.R.)

The neglected nonlocal effects of deforestation

NASA Astrophysics Data System (ADS)

Winckler, Johannes; Reick, Christian; Pongratz, Julia

2017-04-01

Deforestation changes surface temperature locally via biogeophysical effects by changing the water, energy and momentum balance. Adding to these locally induced changes (local effects), deforestation at a given location can cause changes in temperature elsewhere (nonlocal effects). Most previous studies have not considered local and nonlocal effects separately, but investigated the total (local plus nonlocal) effects, for which global deforestation was found to cause a global mean cooling. Recent modeling and observational studies focused on the isolated local effects: The local effects are relevant for local living conditions, and they can be obtained from in-situ and satellite observations. Observational studies suggest that the local effects of potential deforestation cause a warming when averaged globally. This contrast between local warming and total cooling indicates that the nonlocal effects of deforestation are causing a cooling and thus counteract the local effects. It is still unclear how the nonlocal effects depend on the spatial scale of deforestation, and whether they still compensate the local warming in a more realistic spatial distribution of deforestation. To investigate this, we use a fully coupled climate model and separate local and nonlocal effects of deforestation in three steps: Starting from a forest world, we simulate deforestation in one out of four grid boxes using a regular spatial pattern and increase the number of deforestation grid boxes step-wise up to three out of four boxes in subsequent simulations. To compare these idealized spatial distributions of deforestation to a more realistic case, we separate local and nonlocal effects in a simulation where deforestation is applied in regions where it occurred historically. We find that the nonlocal effects scale nearly linearly with the number of deforested grid boxes, and the spatial distribution of the nonlocal effects is similar for the regular spatial distribution of deforestation and the more realistic pattern. Globally averaged, the deforestation-induced warming of the local effects is counteracted by the nonlocal effects, which are about three times as strong as the local effects (up to 0.1K local warming versus -0.3K nonlocal cooling). Thus, the nonlocal effects are more cooling than the local effects are warming, and this is valid not only for idealized simulations of large-scale deforestation, but also for a more realistic deforestation scenario. We conclude that the local effects of deforestation only yield an incomplete picture of the total climate effects by biogeophysical pathways. While the local effects capture the direct climatic response at the site of deforestation, the nonlocal effects have to be included if the biogeophysical effects of deforestation are considered for an implementation in climate policies.

A Multi-Scale Perspective of the Effects of Forest Fragmentation on Birds in Eastern Forests

Treesearch

Frank R. Thompson; Therese M. Donovan; Richard M. DeGraff; John Faaborg; Scott K. Robinson

2002-01-01

We propose a model that considers forest fragmentation within a spatial hierarchy that includes regional or biogeographic effects, landscape-level fragmentation effects, and local habitat effects. We hypothesize that effects operate "top down" in that larger scale effects provide constraints or context for smaller scale effects. Bird species' abundance...

Relationships between direct predation and risk effects.

PubMed

Creel, Scott; Christianson, David

2008-04-01

Risk effects arise when prey alter their behavior in response to predators, and these responses carry costs. Empirical studies have found that risk effects can be large. Nonetheless, studies of predation in vertebrate conservation and management usually consider only direct predation. Given the ubiquity and strength of behavioral responses to predators by vertebrate prey, it is not safe to assume that risk effects on dynamics can be ignored. Risk effects can be larger than direct effects. Risk effects can exist even when the direct rate of predation is zero. Risk effects and direct effects do not necessarily change in parallel. When risk effects reduce reproduction rather than survival, they are easily mistaken for limitation by food supply.

Dissociating action-effect activation and effect-based response selection.

PubMed

Schwarz, Katharina A; Pfister, Roland; Wirth, Robert; Kunde, Wilfried

2018-05-25

Anticipated action effects have been shown to govern action selection and initiation, as described in ideomotor theory, and they have also been demonstrated to determine crosstalk between different tasks in multitasking studies. Such effect-based crosstalk was observed not only in a forward manner (with a first task influencing performance in a following second task) but also in a backward manner (the second task influencing the preceding first task), suggesting that action effect codes can become activated prior to a capacity-limited processing stage often denoted as response selection. The process of effect-based response production, by contrast, has been proposed to be capacity-limited. These observations jointly suggest that effect code activation can occur independently of effect-based response production, though this theoretical implication has not been tested directly at present. We tested this hypothesis by employing a dual-task set-up in which we manipulated the ease of effect-based response production (via response-effect compatibility) in an experimental design that allows for observing forward and backward crosstalk. We observed robust crosstalk effects and response-effect compatibility effects alike, but no interaction between both effects. These results indicate that effect activation can occur in parallel for several tasks, independently of effect-based response production, which is confined to one task at a time. Copyright © 2018 Elsevier B.V. All rights reserved.

40 CFR 721.72 - Hazard communication program.

Code of Federal Regulations, 2011 CFR

2011-07-01

... irritation. (ii) Respiratory complications. (iii) Central nervous system effects. (iv) Internal organ effects... irritation (B) Respiratory complications (C) Central nervous system effects (D) Internal organ effects (E... irritation (B) Respiratory complications (C) Central nervous system effects (D) Internal organ effects (E...

40 CFR 721.72 - Hazard communication program.

Code of Federal Regulations, 2010 CFR

2010-07-01

... irritation. (ii) Respiratory complications. (iii) Central nervous system effects. (iv) Internal organ effects... irritation (B) Respiratory complications (C) Central nervous system effects (D) Internal organ effects (E... irritation (B) Respiratory complications (C) Central nervous system effects (D) Internal organ effects (E...

40 CFR 721.72 - Hazard communication program.

Code of Federal Regulations, 2012 CFR

2012-07-01

... irritation. (ii) Respiratory complications. (iii) Central nervous system effects. (iv) Internal organ effects... irritation (B) Respiratory complications (C) Central nervous system effects (D) Internal organ effects (E... irritation (B) Respiratory complications (C) Central nervous system effects (D) Internal organ effects (E...

40 CFR 721.72 - Hazard communication program.

Code of Federal Regulations, 2014 CFR

2014-07-01

... irritation. (ii) Respiratory complications. (iii) Central nervous system effects. (iv) Internal organ effects... irritation (B) Respiratory complications (C) Central nervous system effects (D) Internal organ effects (E... irritation (B) Respiratory complications (C) Central nervous system effects (D) Internal organ effects (E...

40 CFR 721.72 - Hazard communication program.

Code of Federal Regulations, 2013 CFR

2013-07-01

... irritation. (ii) Respiratory complications. (iii) Central nervous system effects. (iv) Internal organ effects... irritation (B) Respiratory complications (C) Central nervous system effects (D) Internal organ effects (E... irritation (B) Respiratory complications (C) Central nervous system effects (D) Internal organ effects (E...

Long-term and short-term action-effect links and their impact on effect monitoring.

PubMed

Wirth, Robert; Steinhauser, Robert; Janczyk, Markus; Steinhauser, Marco; Kunde, Wilfried

2018-04-23

People aim to produce effects in the environment, and according to ideomotor theory, actions are selected and executed via anticipations of their effects. Further, to ensure that an action has been successful and an effect has been realized, we must be able to monitor the consequences of our actions. However, action-effect links might vary between situations, some might apply for a majority of situations, while others might only apply to special occasions. With a combination of behavioral and electrophysiological markers, we show that monitoring of self-produced action effects interferes with other tasks, and that the length of effect monitoring is determined by both, long-term action-effect links that hold for most situations, and short-term action-effect links that emerge from a current setting. Effect monitoring is fast and frugal when these action-effect links allow for valid anticipation of action effects, but otherwise effect monitoring takes longer and delays a subsequent task. Specific influences of long-term and short-term links on the P1/N1 and P3a further allow to dissect the temporal dynamics of when these links interact for the purpose of effect monitoring. (PsycINFO Database Record (c) 2018 APA, all rights reserved).

EXPERIMENTAL STUDIES ON THE PROTECTIVE EFFECT OF SEVERAL PHARMACOLOGICAL AGENTS AGAINST X-IRRADIATION (in Japanese)

DOE Office of Scientific and Technical Information (OSTI.GOV)

Shakudo, Y.

The protective effects of several pharmacological agents against lethal radiation effects were tested in mice. Noradrenaline, phenylephrine, naphazoline, tetrahydrozoline, and methoxamine markedly reduced radiation mortality when injected 5 min before exposure. Adrenaline and phenylethylamine had little protective effect, while ephedrine had no effect. Cocain was moderately effective, while caffein had little effect. (C.H.)

Effect of Visual Experience on Face Processing: A Developmental Study of Inversion and Non-Native Effects

ERIC Educational Resources Information Center

Sangrigoli, Sandy; de Schonen, Scania

2004-01-01

In adults, three phenomena are taken to demonstrate an experience effect on face recognition: an inversion effect, a non-native face effect (so-called "other-race" effect) and their interaction. It is crucial for our understanding of the developmental perception mechanisms of object processing to discover when these effects are present in…

A Cost-Effectiveness Analysis Model for Evaluating and Planning Secondary Vocational Programs

ERIC Educational Resources Information Center

Kim, Jin Eun

1977-01-01

This paper conceptualizes a cost-effectiveness analysis and describes a cost-effectiveness analysis model for secondary vocational programs. It generates three kinds of cost-effectiveness measures: program effectiveness, cost efficiency, and cost-effectiveness and/or performance ratio. (Author)

Good cope, bad cope: adaptive and maladaptive coping strategies following a critical negative work event.

PubMed

Brown, Steven P; Westbrook, Robert A; Challagalla, Goutam

2005-07-01

The authors examined the moderating effects of coping tactics on the relationship between negative emotion and work performance. Findings indicate an adverse effect of emotion on performance; however, this effect is moderated by coping tactics. Venting (expressing one's negative feelings to others) amplified the adverse effects of negative emotion. Self-control had mixed effects: On one hand, it buffered the adverse effects of negative emotion, yet on the other hand, it had a negative direct effect on outcomes. Task focus had a positive direct effect on performance but no buffering (moderating) effect. Implications of these findings for understanding the effects of negative emotion and coping in the workplace are discussed. Copyright 2005 APA, all rights reserved.

Statistical properties of four effect-size measures for mediation models.

PubMed

Miočević, Milica; O'Rourke, Holly P; MacKinnon, David P; Brown, Hendricks C

2018-02-01

This project examined the performance of classical and Bayesian estimators of four effect size measures for the indirect effect in a single-mediator model and a two-mediator model. Compared to the proportion and ratio mediation effect sizes, standardized mediation effect-size measures were relatively unbiased and efficient in the single-mediator model and the two-mediator model. Percentile and bias-corrected bootstrap interval estimates of ab/s Y , and ab(s X )/s Y in the single-mediator model outperformed interval estimates of the proportion and ratio effect sizes in terms of power, Type I error rate, coverage, imbalance, and interval width. For the two-mediator model, standardized effect-size measures were superior to the proportion and ratio effect-size measures. Furthermore, it was found that Bayesian point and interval summaries of posterior distributions of standardized effect-size measures reduced excessive relative bias for certain parameter combinations. The standardized effect-size measures are the best effect-size measures for quantifying mediated effects.

Employment effects of active labor market programs for sick-listed workers.

PubMed

Holm, Anders; Høgelund, Jan; Gørtz, Mette; Rasmussen, Kristin Storck; Houlberg, Helle Sofie Bøje

2017-03-01

We use register data of 88,948 sick-listed workers in Denmark over the period 2008-2011 to investigate the effect of active labor market programs on the duration until returning to non-subsidized employment and the duration of this employment. To identify causal treatment effects, we exploit over-time variation in the use of active labor market programs in 98 job centers and time-to- event. We find that ordinary education and subsidized job training have significant positive employment effects. Subsidized job training has a large, positive effect on the transition into employment but no effect on the subsequent employment duration. In contrast, ordinary education has a positive effect on employment duration but no effect on the transition into employment. The latter effect is the result of two opposing effects, a large positive effect of having completed education and a large negative lock-in effect, with low re-employment chances during program participation. Copyright © 2017. Published by Elsevier B.V.

Effect of Crataegus Usage in Cardiovascular Disease Prevention: An Evidence-Based Approach

PubMed Central

Wang, Jie; Xiong, Xingjiang; Feng, Bo

2013-01-01

Hawthorn (Crataegus oxyacantha) is a widely used Chinese herb for treatment of gastrointestinal ailments and heart problems and consumed as food. In North America, the role of treatment for heart problems dates back to 1800. Currently, evidence is accumulating from various in vivo and in vitro studies that hawthorn extracts exert a wide range of cardiovascular pharmacological properties, including antioxidant activity, positive inotropic effect, anti-inflammatory effect, anticardiac remodeling effect, antiplatelet aggregation effect, vasodilating effect, endothelial protective effect, reduction of smooth muscle cell migration and proliferation, protective effect against ischemia/reperfusion injury, antiarrhythmic effect, lipid-lowering effect and decrease of arterial blood pressure effect. On the other hand, reviews of placebo-controlled trials have reported both subjective and objective improvement in patients with mild forms of heart failure (NYHA I–III), hypertension, and hyperlipidemia. This paper discussed the underlying pharmacology mechanisms in potential cardioprotective effects and elucidated the clinical applications of Crataegus and its various extracts. PMID:24459528

A Meta Analytical Approach Regarding School Effectiveness: The True Size of School Effects and the Effect Size of Educational Leadership.

ERIC Educational Resources Information Center

Bosker, Roel J.; Witziers, Bob

School-effectiveness research has not yet been able to identify the factors of effective and noneffective schools, the real contribution of the significant factors, the true sizes of school effects, and the generalizability of school-effectiveness results. This paper presents findings of a meta analysis, the Dutch PSO programme, that was used to…

LED and Semiconductor Photo-effects on Living Things

NASA Astrophysics Data System (ADS)

Fujiyasu, Hiroshi; Ishigaki, Takemitsu; Fujiyasu, Kentarou; Ujihara, Shirou; Watanabe, Naoharu; Sunayama, Shunji; Ikoma, Shuuji

We have studied LED irradiation effects on plants and animals in the visible to UV region of light from GaN LEDs. The results are as follows. Blue light considers to be effective for pearl cultivation or for attraction of small fishes living in near the surface of sea such as Pompano or Sardine, white light radiation is effective for cultivation of botanical plankton for shells. Other experiments of UV light irradiation attracting effect on baby sea turtle and the germination UV effect of mushroom, green light weight enhance effect on baby pigs, light vernalization effect of vegitable and Ge far infrared therapic effect on human body are also given.

Small- and Large-Effect Quantitative Trait Locus Interactions Underlie Variation in Yeast Sporulation Efficiency

PubMed Central

Lorenz, Kim; Cohen, Barak A.

2012-01-01

Quantitative trait loci (QTL) with small effects on phenotypic variation can be difficult to detect and analyze. Because of this a large fraction of the genetic architecture of many complex traits is not well understood. Here we use sporulation efficiency in Saccharomyces cerevisiae as a model complex trait to identify and study small-effect QTL. In crosses where the large-effect quantitative trait nucleotides (QTN) have been genetically fixed we identify small-effect QTL that explain approximately half of the remaining variation not explained by the major effects. We find that small-effect QTL are often physically linked to large-effect QTL and that there are extensive genetic interactions between small- and large-effect QTL. A more complete understanding of quantitative traits will require a better understanding of the numbers, effect sizes, and genetic interactions of small-effect QTL. PMID:22942125

Importance of placebo effect in cough clinical trials.

PubMed

Eccles, Ron

2010-01-01

Cough is a unique symptom because, unlike sneeze and other symptoms, it can be under voluntary control and this complicates clinical trials on cough medicines. All over-the-counter cough medicines (OTC) are very effective treatments because of their placebo effect. The placebo effect is enhanced by expectancy related to advertising, brand, packaging, and formulation. This placebo effect creates a problem for the conduct of clinical trials on OTC cough medicines that attempt to demonstrate the efficacy of a pharmacological agent above that of any placebo effect. Up to 85% of the efficacy of some cough medicines can be attributed to a placebo effect. The placebo effect apparent in clinical trials consists of several components: natural recovery, regression of cough response toward mean, demulcent effect, effect of sweetness, voluntary control, and effects related to expectancy and meaning of the treatment. The placebo effect has been studied most in the pain model, and placebo analgesia is reported to depend on the activation of endogenous opioid systems in the brain; this model may be applicable to cough. A balanced placebo design may help to control for the placebo effect, but this trial design may not be acceptable due to deception of patients. The placebo effect in clinical trials may be controlled by use of a crossover design, where feasible, and the changes in the magnitude of the placebo effect in this study design are discussed.

All Effects of Psychophysical Variables on Color Attributes: A Classification System

PubMed Central

Pridmore, Ralph W.; Melgosa, Manuel

2015-01-01

This paper reports the research and structuring of a classification system for the effects of psychophysical variables on the color attributes. A basic role of color science is to psychophysically specify color appearance. An early stage is to specify the effects of the psychophysical variables (as singles, pairs, etc) on the color attributes (as singles, pairs, etc), for example to model color appearance. Current data on effects are often scarce or conflicting. Few effects are well understood, and the practice of naming effects after their discoverer(s) is inadequate and can be confusing. The number and types of possible effects have never been systematically analyzed and categorized. We propose a simple and rigorous system of classification including nomenclature. The total range of effects is computed from the possible combinations of three psychophysical variables (luminance, dominant wavelength, purity) and six color attributes (lightness, brightness, hue, chroma, colorfulness, saturation) in all modes of appearance. Omitting those effects that are normally impossible to perceive at any one time (such as four- or five-dimensional colors), the total number perceivable is 161 types of effects for all modes of appearance. The type of effect is named after the psychophysical stimulus (or stimuli) and the relevant color attribute(s), e.g., Luminance-on-hue effect (traditionally known as Bezold-Brucke effect). Each type of effect may include slightly different effects with infinite variations depending on experimental parameters. PMID:25859845