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Sample records for 2d numerical study

  1. Numerical Study of Microwave Reflectometry in Plasmas with 2D Turbulent Fluctuations

    SciTech Connect

    E. Mazzucato

    1998-02-01

    This paper describes a numerical study of the role played by 2D turbulent fluctuations in microwave reflectometry -- a radar technique for density measurements using the reflection of electromagnetic waves from a plasma cutoff. The results indicate that, if the amplitude of fluctuations is below a threshold which is set by the spectrum of poloidal wavenumbers, the measured backward field appears to originate from a virtual location behind the reflecting layer, and to arise from the phase modulation of the probing wave, with an amplitude given by 1D geometric optics. These results suggest a possible scheme for turbulence measurements in tokamaks, where the backward field is collected with a wide aperture antenna, and the virtual reflecting layer is imaged onto the plane of an array of detectors. Such a scheme should be capable of providing additional information on the nature of the short-scale turbulence observed in tokamaks, which still remains one of the unresolved issues in fusion research.

  2. Numerical studies of the melting transition in 2D Yukawa systems

    SciTech Connect

    Hartmann, P.; Donko, Z.; Kalman, G. J.

    2008-09-07

    We present the latest results of our systematic studies of the solid--liquid phase transition in 2D classical many-particle systems interacting with the Yukawa potential. Our previous work is extended by applying the molecular dynamic simulations to systems with up to 1.6 million particles in the computational box (for {kappa} = 2 case). Equilibrium simulations are performed for different coupling parameters in the vicinity of the expected melting transition ({gamma}{sub m}{sup {kappa}}{sup ={sup 2}}{approx_equal}415) and a wide range of observables are averaged over uncorrelated samples of the micro-canonical ensemble generated by the simulations.

  3. Numerical Evaluation of 2D Ground States

    NASA Astrophysics Data System (ADS)

    Kolkovska, Natalia

    2016-02-01

    A ground state is defined as the positive radial solution of the multidimensional nonlinear problem \\varepsilon propto k_ bot 1 - ξ with the function f being either f(u) =a|u|p-1u or f(u) =a|u|pu+b|u|2pu. The numerical evaluation of ground states is based on the shooting method applied to an equivalent dynamical system. A combination of fourth order Runge-Kutta method and Hermite extrapolation formula is applied to solving the resulting initial value problem. The efficiency of this procedure is demonstrated in the 1D case, where the maximal difference between the exact and numerical solution is ≈ 10-11 for a discretization step 0:00025. As a major application, we evaluate numerically the critical energy constant. This constant is defined as a functional of the ground state and is used in the study of the 2D Boussinesq equations.

  4. Numerical and experimental studies of the elastic enhancement factor of 2D open systems

    NASA Astrophysics Data System (ADS)

    Sirko, Leszek; Białous, Małgorzata; Yunko, Vitalii; Bauch, Szymon; Ławniczak, Michał

    We present the results of numerical and experimental studies of the elastic enhancement factor W for microwave rough and rectangular cavities simulating two-dimensional chaotic and partially chaotic quantum billiards in the presence of moderate absorption strength. We show that for the frequency range ν = 15 . 0 - 18 . 5 GHz, in which the coupling between antennas and the system is strong enough, the values of W for the microwave rough cavity lie below the predictions of random matrix theory and on average they are above the theoretical results of V. Sokolov and O. Zhirov, Phys. Rev. E, 91, 052917 (2015). We also show that the enhancement factor W of a microwave rectangular cavity coupled to the external channels via microwave antennas, simulating a partially chaotic quantum billiard, calculated by applying the Potter-Rosenzweig model with κ = 2 . 8 +/- 0 . 5 is close to the experimental one. Our numerical and experimental results suggest that the enhancement factor can be used as a measure of internal chaos which can be especially useful for systems with significant openness or absorption. This work was partially supported by the Ministry of Science and Higher Education Grants N N202 130239 and UMO-2013/09/D/ST2/03727.

  5. Numerical Study of Sound Emission by 2D Regular and Chaotic Vortex Configurations

    NASA Astrophysics Data System (ADS)

    Knio, Omar M.; Collorec, Luc; Juvé, Daniel

    1995-02-01

    The far-field noise generated by a system of three Gaussian vortices lying over a flat boundary is numerically investigated using a two-dimensional vortex element method. The method is based on the discretization of the vorticity field into a finite number of smoothed vortex elements of spherical overlapping cores. The elements are convected in a Lagrangian reference along particle trajectories using the local velocity vector, given in terms of a desingularized Biot-Savart law. The initial structure of the vortex system is triangular; a one-dimensional family of initial configurations is constructed by keeping one side of the triangle fixed and vertical, and varying the abscissa of the centroid of the remaining vortex. The inviscid dynamics of this vortex configuration are first investigated using non-deformable vortices. Depending on the aspect ratio of the initial system, regular or chaotic motion occurs. Due to wall-related symmetries, the far-field sound always exhibits a time-independent quadrupolar directivity with maxima parallel end perpendicular to the wall. When regular motion prevails, the noise spectrum is dominated by discrete frequencies which correspond to the fundamental system frequency and its superharmonics. For chaotic motion, a broadband spectrum is obtained; computed soundlevels are substantially higher than in non-chaotic systems. A more sophisticated analysis is then performed which accounts for vortex core dynamics. Results show that the vortex cores are susceptible to inviscid instability which leads to violent vorticity reorganization within the core. This phenomenon has little effect on the large-scale features of the motion of the system or on low frequency sound emission. However, it leads to the generation of a high-frequency noise band in the acoustic pressure spectrum. The latter is observed in both regular and chaotic system simulations.

  6. Temperature and Pinning Effects on Driving a 2D Electron System on a Helium Film: A Numerical Study

    NASA Astrophysics Data System (ADS)

    Damasceno, Pablo F.; Dasilva, Cláudio José; Rino, José Pedro; Cândido, Ladir

    2010-07-01

    Using numerical simulations we investigated the dynamic response to an externally driven force of a classical two-dimensional (2D) electron system on a helium film at finite temperatures. A potential barrier located at the center of the system behaves as a pinning center that results in an insulator state below a threshold driving force. We have found that the current-voltage characteristic obeys the scaling relation I= f ξ , with ξ ranging from ˜(1.0-1.7) for different pinning strengths and temperatures. Our results may be used to understand the spread range of ξ in experiments with typical characteristic of plastic depinning.

  7. Numerical Study of Turbulence Model Predictions for the MD 30P/30N and NHLP-2D Three-Element Highlift Configurations

    NASA Technical Reports Server (NTRS)

    Morrison, Joseph H.

    1998-01-01

    This report details calculations for the McDonnell-Douglas 30P/30N and the NHLP-2D three-element highlift configurations. Calculations were performed with the Reynolds averaged Navier-Stokes code ISAAC to study the effects of various numerical issues on high lift predictions. These issues include the effect of numerical accuracy on the advection terms of the turbulence equations, Navier-Stokes versus the thin-layer Navier-Stokes approximation, an alternative formulation of the production term, and the performance of several turbulence models. The effect of the transition location on the NHLP-2D flow solution was investigated. Two empirical transition models were used to estimate the transition location.

  8. Radioactive Sediment Transport on Ogaki Dam Reservoir in Fukushima Evacuated Zone: Numerical Simulation Studies by 2-D River Simulation Code

    NASA Astrophysics Data System (ADS)

    Yamada, Susumu; Kitamura, Akihiro; Kurikami, Hiroshi; Machida, Masahiko

    2015-04-01

    Fukushima Daiichi Nuclear Power Plant (FDNPP) accident on March 2011 released significant quantities of radionuclides to atmosphere. The most significant nuclide is radioactive cesium isotopes. Therefore, the movement of the cesium is one of the critical issues for the environmental assessment. Since the cesium is strongly sorbed by soil particles, the cesium transport can be regarded as the sediment transport which is mainly brought about by the aquatic system such as a river and a lake. In this research, our target is the sediment transport on Ogaki dam reservoir which is located in about 16 km northwest from FDNPP. The reservoir is one of the principal irrigation dam reservoirs in Fukushima Prefecture and its upstream river basin was heavily contaminated by radioactivity. We simulate the sediment transport on the reservoir using 2-D river simulation code named Nays2D originally developed by Shimizu et al. (The latest version of Nays2D is available as a code included in iRIC (http://i-ric.org/en/), which is a river flow and riverbed variation analysis software package). In general, a 2-D simulation code requires a huge amount of calculation time. Therefore, we parallelize the code and execute it on a parallel computer. We examine the relationship between the behavior of the sediment transport and the height of the reservoir exit. The simulation result shows that almost all the sand that enter into the reservoir deposit close to the entrance of the reservoir for any height of the exit. The amounts of silt depositing within the reservoir slightly increase by raising the height of the exit. However, that of the clay dramatically increases. Especially, more than half of the clay deposits, if the exit is sufficiently high. These results demonstrate that the water level of the reservoir has a strong influence on the amount of the clay discharged from the reservoir. As a result, we conclude that the tuning of the water level has a possibility for controlling the

  9. A Numerical Study of Continuous Data Assimilation for the 2D-NS Equations Using Nodal Points

    NASA Astrophysics Data System (ADS)

    Gesho, Masakazu

    This thesis conducts a number of numerical experiments using massively parallel GPU computations to study a new continuous data assimilation algorithm. We test the algorithm on two-dimensional incompressible fluid flows given by the Navier--Stokes equations. In this context, observations of the Eulerian velocity field given at a finite resolution of nodal points in space may be used to recover the exact velocity field over time. We also consider nodal measurements of the vorticity field and stream function. The main difference between this new algorithm and previous continuous data assimilation methods is the inclusion of a relaxation parameter micro that controls the rate at which the approximate solution is forced toward the observational measurements. If micro is too small, the approximate solution obtained by data assimilation may not converge to the reference solution; however, if micro is too large then high frequency spill-over from the observations may contaminate the approximate solution. Our focus is on the resolution of the nodal points necessary for the algorithm to recover the exact velocity field and how best to choose the parameter micro.

  10. Optoacoustic temperature monitoring during HIFU impact on biological tissues: ex vivo study and numerical simulations of 2D temperature reconstruction

    NASA Astrophysics Data System (ADS)

    Nikitin, Sergey; Khokhlova, Tatiana; Pelivanov, Ivan

    2012-02-01

    Dependencies of the optoacoustic (OA) transformation efficiency on tissue temperature were obtained for the application in OA temperature monitoring during thermal therapies. Accurate measurement of the OA signal amplitude versus temperature was performed in different ex-vivo tissues in the temperature range 25°C - 80°C. The investigated tissues were selected to represent different structural components: chicken breast (skeletal muscle), porcine lard (fatty tissue) and porcine liver (richly perfused tissue). Backward mode of the OA signal detection and a narrow probe laser beam were used in the experiments to avoid the influence of changes in light scattering with tissue coagulation on the OA signal amplitude. Measurements were performed in heating and cooling regimes. Characteristic behavior of the OA signal amplitude temperature dependences in different temperature ranges were described in terms of changes in different structural components of the tissue samples. Finally, numerical simulation of the OA temperature monitoring with a linear transducers array was performed to demonstrate the possibility of real-time temperature mapping.

  11. On the effects of assembly compression on the performance of liquid-feed DMFCs under methanol-limiting conditions: A 2D numerical study

    NASA Astrophysics Data System (ADS)

    García-Salaberri, P. A.; Vera, M.

    2015-07-01

    The influence of assembly compression on the performance of liquid-feed DMFCs under methanol-limiting conditions is explored by means of a 2D/1D multiphysics across-the-channel model. The numerical formulation incorporates a comprehensive 2D description of the anode GDL, including two-phase phenomena, non-uniform anisotropic transport properties, and electrical contact resistances at the GDL/BPP interface. GDL effective properties are evaluated using empirical data corresponding to Toray® carbon paper. A simplified but physically sound 1D description, locally coupled to the 2D anode GDL model, is adopted to describe transport processes in the MPLs, membrane and cathode GDL, whereas the catalyst layers are treated as infinitely thin surfaces. Good agreement is found between the numerical results and previous experimental data. The interplay between assembly compression, bipolar plate material, and channel configuration is also investigated. The results show that there is an optimum GDL compression ratio in terms of overall power density, the optimal compression level being strongly dependent on bipolar plate material. Beyond the optimum, the detrimental effect of compression is larger in non-parallel flow fields due to the additional reduction of methanol transported by under-rib convection. The results suggest that, under certain conditions, this transport mechanism could be more important than diffusion in the anode of liquid-feed DMFCs.

  12. 2D numerical modelling of meandering channel formation

    NASA Astrophysics Data System (ADS)

    XIAO, Y.; ZHOU, G.; YANG, F. S.

    2016-03-01

    A 2D depth-averaged model for hydrodynamic sediment transport and river morphological adjustment was established. The sediment transport submodel takes into account the influence of non-uniform sediment with bed surface armoring and considers the impact of secondary flow in the direction of bed-load transport and transverse slope of the river bed. The bank erosion submodel incorporates a simple simulation method for updating bank geometry during either degradational or aggradational bed evolution. Comparison of the results obtained by the extended model with experimental and field data, and numerical predictions validate that the proposed model can simulate grain sorting in river bends and duplicate the characteristics of meandering river and its development. The results illustrate that by using its control factors, the improved numerical model can be applied to simulate channel evolution under different scenarios and improve understanding of patterning processes.

  13. Evolution of crustal stress, pressure and temperature around shear zones during orogenic wedge formation: a 2D thermo-mechanical numerical study

    NASA Astrophysics Data System (ADS)

    Markus Schmalholz, Stefan; Jaquet, Yoann

    2016-04-01

    We study the formation of an orogenic wedge during lithospheric shortening with 2D numerical simulations. We consider a viscoelastoplastic rheology, thermo-mechanical coupling by shear heating and temperature-dependent viscosities, gravity and erosion. In the initial model configuration there is either a lateral temperature variation at the model base or a lateral variation in crustal thickness to generate slight stress variations during lithospheric shortening. These stress variations can trigger the formation of shear zones which are caused by thermal softening associated with shear heating. We do not apply any kind of strain softening, such as reduction of friction angle with progressive plastic strain. The first major shear zone that appears during shortening crosscuts the entire crust and initiates the asymmetric subduction/underthrusting of mainly the mechanically strong lower crust. After some deformation, the first shear zone in the upper crust is abandoned, the deformation propagates towards the foreland and a new shear zone forms only in the upper crust. The shear zone propagation occurs several times where new shear zones form in the upper crust and the mechanically strong top of the lower crust acts as detachment horizon. We calculate the magnitudes of the maximal and minimal principal stresses and of the mean stress (or dynamic pressure), and we record also the temperature for several marker points in the upper and lower crust. We analyse the evolution of stresses and temperature with burial depth and time. Deviatoric stresses (half the differential stress) in the upper crust are up to 200 MPa and associated shear heating in shear zones ranges between 40 - 80 °C. Lower crustal rocks remain either at the base of the orogenic wedge at depths of around 50 km or are subducted to depths of up to 120 km, depending on their position when the first shear zone formed. Largest deviatotric stresses in the strong part of the lower crust are about 1000 MPa and

  14. Numerical modeling of seismogram envelopes in 2-D random media

    NASA Astrophysics Data System (ADS)

    Fehler, Michael

    2002-11-01

    Several portions of seismograms recorded from regional earthquakes cannot be easily explained as resulting from waves propagating along deterministic paths within the Earth. For example, seismic coda, which is the tail portion of the seismogram of an earthquake recorded at distances of less than 100 km, is considered as resulting from waves that are multiply scattered from random heterogeneities in the Earth's lithosphere. At greater distances, observations that the duration of the initial arriving wave packet is much longer than the source-time duration is explained as being due to multiple forward scattering along the path between the source and the receiver. To investigate these phenomena, we use a finite difference method to numerically simulate 2-D scalar-waves that propagate through random media characterized by a von Karman autocorrelation function. Such media are considered to be appropriate models for the random component of the structure of the Earth's lithosphere. We investigate the characteristics of the resulting wavefields and compare them with those of observed seismograms.

  15. Advantages of 3D FEM numerical modeling over 2D, analyzed in a case study of transient thermal-hydraulic groundwater utilization

    NASA Astrophysics Data System (ADS)

    Fuchsluger, Martin; Götzl, Gregor

    2014-05-01

    In general most aquifers have a much larger lateral extent than vertical. This fact leads to the application of the Dupuit-Forchheimer assumptions to many groundwater problems, whereas a two dimensional simulation is considered sufficient. By coupling transient fluid flow modeling with heat transport the 2D aquifer approximation is in many cases insufficient as it does not consider effects of the subjacent and overlying aquitards on heat propagation as well as the impact of surface climatic effects on shallow aquifers. A shallow Holocene aquifer in Vienna served as a case study to compare different modeling approaches in two and three dimensions in order to predict the performance and impact of a thermal aquifer utilization for heating (1.3 GWh) and cooling (1.4 GWh) of a communal building. With the assumption of a 6 doublets well field, the comparison was realized in three steps: At first a two dimensional model for unconfined flow was set up, assuming a varying hydraulic conductivity as well as a varying top and bottom elevation of the aquifer (gross - thickness). The model area was chosen along constant hydraulic head at steady state conditions. A second model was made by mapping solely the aquifer in three dimensions using the same subdomain and boundary conditions as defined in step one. The third model consists of a complete three dimensional geological build-up including the aquifer as well as the overlying and subjacent layers and additionally an annually variable climatic boundary condition at the surface. The latter was calibrated with measured water temperature at a nearby water gauge. For all three models the same annual operating mode of the 6 hydraulic doublets was assumed. Furthermore a limited maximal groundwater temperature at a range between 8 and 18 °C as well as a constrained well flow rate has been given. Finally a descriptive comparison of the three models concerning the extracted thermal power, drawdown, temperature distribution and Darcy

  16. Numerical simulation of rock cutting using 2D AUTODYN

    NASA Astrophysics Data System (ADS)

    Woldemichael, D. E.; Rani, A. M. Abdul; Lemma, T. A.; Altaf, K.

    2015-12-01

    In a drilling process for oil and gas exploration, understanding of the interaction between the cutting tool and the rock is important for optimization of the drilling process using polycrystalline diamond compact (PDC) cutters. In this study the finite element method in ANSYS AUTODYN-2D is used to simulate the dynamics of cutter rock interaction, rock failure, and fragmentation. A two-dimensional single PDC cutter and rock model were used to simulate the orthogonal cutting process and to investigate the effect of different parameters such as depth of cut, and back rake angle on two types of rocks (sandstone and limestone). In the simulation, the cutting tool was dragged against stationary rock at predetermined linear velocity and the depth of cut (1,2, and 3 mm) and the back rake angles(-10°, 0°, and +10°) were varied. The simulation result shows that the +10° back rake angle results in higher rate of penetration (ROP). Increasing depth of cut leads to higher ROP at the cost of higher cutting force.

  17. Numerical simulation of ( T 2, T 1) 2D NMR and fluid responses

    NASA Astrophysics Data System (ADS)

    Tan, Mao-Jin; Zou, You-Long; Zhang, Jin-Yan; Zhao, Xin

    2012-12-01

    One-dimensional nuclear magnetic resonance (1D NMR) logging technology is limited for fluid typing, while two-dimensional nuclear magnetic resonance (2D NMR) logging can provide more parameters including longitudinal relaxation time ( T 1) and transverse relaxation time ( T 2) relative to fluid types in porous media. Based on the 2D NMR relaxation mechanism in a gradient magnetic field, echo train simulation and 2D NMR inversion are discussed in detail. For 2D NMR inversion, a hybrid inversion method is proposed based on the damping least squares method (LSQR) and an improved truncated singular value decomposition (TSVD) algorithm. A series of spin echoes are first simulated with multiple waiting times ( T W s) in a gradient magnetic field for given fluid models and these synthesized echo trains are inverted by the hybrid method. The inversion results are consistent with given models. Moreover, the numerical simulation of various fluid models such as the gas-water, light oil-water, and vicious oil-water models were carried out with different echo spacings ( T E s) and T W s by this hybrid method. Finally, the influences of different signal-to-noise ratios (SNRs) on inversion results in various fluid models are studied. The numerical simulations show that the hybrid method and optimized observation parameters are applicable to fluid typing of gas-water and oil-water models.

  18. Numerical Verification of a 2-D PSF Equalization Technique

    NASA Astrophysics Data System (ADS)

    Atwood, Shane; Kankelborg, C.

    2013-07-01

    The Multi-Order Extreme Ultraviolet Spectrograph (MOSES) forms images of the transition region at HE II 30.4 in three spectral orders. Subtle differences between these images encode line profile information. However, differences in instrument point-spread function (PSF) in the three orders lead to non-negligible systematic errors in the retrieval of the line profiles. We describe a technique for equalizing the PSFs, and provide numerical verification of the technique's validity.

  19. Resistivity inversion in 2-D anisotropic media: numerical experiments

    NASA Astrophysics Data System (ADS)

    Wiese, Timothy; Greenhalgh, Stewart; Zhou, Bing; Greenhalgh, Mark; Marescot, Laurent

    2015-04-01

    Many rocks and layered/fractured sequences have a clearly expressed electrical anisotropy although it is rare in practice to incorporate anisotropy into resistivity inversion. In this contribution, we present a series of 2.5-D synthetic inversion experiments for various electrode configurations and 2-D anisotropic models. We examine and compare the image reconstructions obtained using the correct anisotropic inversion code with those obtained using the false but widely used isotropic assumption. Superior reconstruction in terms of reduced data misfit, true anomaly shape and position, and anisotropic background parameters were obtained when the correct anisotropic assumption was employed for medium to high coefficients of anisotropy. However, for low coefficient values the isotropic assumption produced better-quality results. When an erroneous isotropic inversion is performed on medium to high level anisotropic data, the images are dominated by patterns of banded artefacts and high data misfits. Various pole-pole, pole-dipole and dipole-dipole data sets were investigated and evaluated for the accuracy of the inversion result. The eigenvalue spectra of the pseudo-Hessian matrix and the formal resolution matrix were also computed to determine the information content and goodness of the results. We also present a data selection strategy based on high sensitivity measurements which drastically reduces the number of data to be inverted but still produces comparable results to that of the comprehensive data set. Inversion was carried out using transversely isotropic model parameters described in two different co-ordinate frames for the conductivity tensor, namely Cartesian versus natural or eigenframe. The Cartesian frame provided a more stable inversion product. This can be simply explained from inspection of the eigenspectra of the pseudo-Hessian matrix for the two model descriptions.

  20. 2D and 3D numerical models on compositionally buoyant diapirs in the mantle wedge

    NASA Astrophysics Data System (ADS)

    Hasenclever, Jörg; Morgan, Jason Phipps; Hort, Matthias; Rüpke, Lars H.

    2011-11-01

    We present 2D and 3D numerical model calculations that focus on the physics of compositionally buoyant diapirs rising within a mantle wedge corner flow. Compositional buoyancy is assumed to arise from slab dehydration during which water-rich volatiles enter the mantle wedge and form a wet, less dense boundary layer on top of the slab. Slab dehydration is prescribed to occur in the 80-180 km deep slab interval, and the water transport is treated as a diffusion-like process. In this study, the mantle's rheology is modeled as being isoviscous for the benefit of easier-to-interpret feedbacks between water migration and buoyant viscous flow of the mantle. We use a simple subduction geometry that does not change during the numerical calculation. In a large set of 2D calculations we have identified that five different flow regimes can form, in which the position, number, and formation time of the diapirs vary as a function of four parameters: subduction angle, subduction rate, water diffusivity (mobility), and mantle viscosity. Using the same numerical method and numerical resolution we also conducted a suite of 3D calculations for 16 selected parameter combinations. Comparing the 2D and 3D results for the same model parameters reveals that the 2D models can only give limited insights into the inherently 3D problem of mantle wedge diapirism. While often correctly predicting the position and onset time of the first diapir(s), the 2D models fail to capture the dynamics of diapir ascent as well as the formation of secondary diapirs that result from boundary layer perturbations caused by previous diapirs. Of greatest importance for physically correct results is the numerical resolution in the region where diapirs nucleate, which must be high enough to accurately capture the growth of the thin wet boundary layer on top of the slab and, subsequently, the formation, morphology, and ascent of diapirs. Here 2D models can be very useful to quantify the required resolution, which we

  1. 2D numerical simulation of the resistive reconnection layer

    SciTech Connect

    D. A. Uzdensky; R. M. Kulsrud

    2000-07-21

    In this paper the authors present a two-dimensional numerical simulation of a reconnection current layer in incompressible resistive magnetohydrodynamics with uniform resistivity in the limit of very large Lundquist numbers. They use realistic boundary conditions derived consistently from the outside magnetic field, and they also take into account the effect of the backpressure from flow into the separatrix region. They find that within a few Alfven times the system reaches a steady state consistent with the Sweet-Parker model, even if the initial state is Petschek-like.

  2. 2D Numerical Simulation of the Resistive Reconnection Layer

    SciTech Connect

    Kulsrud, R.M.; Uzdensky, D.A.

    1999-03-01

    In this paper we present a two-dimensional numerical simulation of a reconnection current layer in incompressible resistive magnetohydrodynamics with uniform resistivity in the limit of very large Lundquist numbers. We use realistic boundary conditions derived consistently from the outside magnetic field, and we also take into account the effect of the back pressure from flow into the separatrix region. We find that within a few Alfvén times the system reaches a steady state consistent with the Sweet-Parker model, even if the initial state is Petschek-like.

  3. Improvement of a 2D numerical model of lava flows

    NASA Astrophysics Data System (ADS)

    Ishimine, Y.

    2013-12-01

    I propose an improved procedure that reduces an improper dependence of lava flow directions on the orientation of Digital Elevation Model (DEM) in two-dimensional simulations based on Ishihara et al. (in Lava Flows and Domes, Fink, JH eds., 1990). The numerical model for lava flow simulations proposed by Ishihara et al. (1990) is based on two-dimensional shallow water model combined with a constitutive equation for a Bingham fluid. It is simple but useful because it properly reproduces distributions of actual lava flows. Thus, it has been regarded as one of pioneer work of numerical simulations of lava flows and it is still now widely used in practical hazard prediction map for civil defense officials in Japan. However, the model include an improper dependence of lava flow directions on the orientation of DEM because the model separately assigns the condition for the lava flow to stop due to yield stress for each of two orthogonal axes of rectangular calculating grid based on DEM. This procedure brings a diamond-shaped distribution as shown in Fig. 1 when calculating a lava flow supplied from a point source on a virtual flat plane although the distribution should be circle-shaped. To improve the drawback, I proposed a modified procedure that uses the absolute value of yield stress derived from both components of two orthogonal directions of the slope steepness to assign the condition for lava flows to stop. This brings a better result as shown in Fig. 2. Fig. 1. (a) Contour plots calculated with the original model of Ishihara et al. (1990). (b) Contour plots calculated with a proposed model.

  4. A numerical study of steady 2D flow around NACA 0015 and NACA 0012 hydrofoil with free surface using VOF method

    NASA Astrophysics Data System (ADS)

    Adjali, Saadia; Belkadi, Mustapha; Aounallah, Mohammed; Imine, Omar

    2015-05-01

    Accurate simulation of turbulent free surface flows around surface ships has a central role in the optimal design of such naval vessels. The flow problem to be simulated is rich in complexity and poses many modeling challenges because of the existence of breaking waves around the ship hull, and because of the interaction of the two-phase flow with the turbulent boundary layer. In this paper, our goal is to estimate the lift and drag coefficients for NACA 0012 of hydrofoil advancing in calm water under steady conditions with free surface and emerged NACA 0015. The commercial CFD software FLUENT version 14 is used for the computations in the present study. The calculated grid is established using the code computer GAMBIT 2.3.26.The shear stress k-ωSST model is used for turbulence modeling and the volume of fluid technique is employed to simulate the free-surface motion. In this computation, the second order upwind scheme is used for discretizing the convection terms in the momentum transport equations, the Modified HRIC scheme for VOF discretisation. The results obtained compare well with the experimental data.

  5. A new model for two-dimensional numerical simulation of pseudo-2D gas-solids fluidized beds

    SciTech Connect

    Li, Tingwen; Zhang, Yongmin

    2013-10-11

    Pseudo-two dimensional (pseudo-2D) fluidized beds, for which the thickness of the system is much smaller than the other two dimensions, is widely used to perform fundamental studies on bubble behavior, solids mixing, or clustering phenomenon in different gas-solids fluidization systems. The abundant data from such experimental systems are very useful for numerical model development and validation. However, it has been reported that two-dimensional (2D) computational fluid dynamic (CFD) simulations of pseudo-2D gas-solids fluidized beds usually predict poor quantitative agreement with the experimental data, especially for the solids velocity field. In this paper, a new model is proposed to improve the 2D numerical simulations of pseudo-2D gas-solids fluidized beds by properly accounting for the frictional effect of the front and back walls. Two previously reported pseudo-2D experimental systems were simulated with this model. Compared to the traditional 2D simulations, significant improvements in the numerical predictions have been observed and the predicted results are in better agreement with the available experimental data.

  6. Finger Counting and (2D:4D) Digit Ratio in Spatial-Numerical Association.

    PubMed

    Fabbri, Marco; Natale, Vincenzo

    2016-01-01

    It is reported that a canonical and cultural finger counting habit influences the spatial-numerical association. The digit ratio (the ratio between the lengths of the index and ring fingers as a putative indicator of prenatal androgen exposure) also plays an effect on space-number representation, reflecting a stronger left-to-right number representation in people with a short index finger and longer ring finger (i.e., 2D:4D ratio). It is unknown whether the finger counting habit and digit ratio have an effect on spatial-numerical association independently from each other or whether they interact with each other. In Study 1, the digit ratio and finger counting mapping were recorded in right handers. The participants performed number-to-position, digit string bisection, and physical line bisection tasks. In the number-to-position task, a finger counting effect was found, as well as a significant interaction between factors. A digit ratio effect was observed in the digit string bisection task. In Study 2, digit ratio and finger counting mapping were recorded in right and left handers. The results showed that the finger counting habit influenced the spatial biases in both numerical tasks. A significant interaction between finger counting and digit ratio was found in both numerical tasks when only the left hand was considered. The results are discussed considering the embodied nature of the spatial-numerical association. PMID:26562848

  7. Accelerating numerical modeling of wave propagation through 2-D anisotropic materials using OpenCL.

    PubMed

    Molero, Miguel; Iturrarán-Viveros, Ursula

    2013-03-01

    We present an implementation of the numerical modeling of elastic waves propagation, in 2D anisotropic materials, using the new parallel computing devices (PCDs). Our study is aimed both to model laboratory experiments and explore the capabilities of the emerging PCDs by discussing performance issues. In the experiments a sample plate of an anisotropic material placed inside a water tank is rotated and, for every angle of rotation it is subjected to an ultrasonic wave (produced by a large source transducer) that propagates in the water and through the material producing some reflection and transmission signals that are recording by a "point-like" receiver. This experiment is numerically modeled by running a finite difference code covering a set of angles θ∈[-50°, 50°], and recorded the signals for the transmission and reflection results. Transversely anisotropic and weakly orthorhombic materials are considered. We accelerated the computation using an open-source toolkit called PyOpenCL, which lets one to easily access the OpenCL parallel computation API's from the high-level programming environment of Python. A speedup factor over 19 using the GPU is obtained when compared with the execution of the same program in parallel using a CPU multi-core (in this case we use the 4-cores that has the CPU). The performance for different graphic cards and operating systems is included together with the full 2-D finite difference code with PyOpenCL. PMID:23290584

  8. Numerical characterization of DNA sequences in a 2-D graphical representation scheme of low degeneracy

    NASA Astrophysics Data System (ADS)

    Guo, Xiaofeng; Nandy, Ashesh

    2003-02-01

    Some 2-D and 3-D graphical representations of DNA sequences have been given by Gate, Nandy, Leong, Randic, and Guo et al. Based on 2-D graphical representation of DNA sequences, Raychaudhury and Nandy introduced the first-order moments of the x and y coordinates and the radius of the plot of a DNA sequence for indexing scheme and similarity measures of DNA sequences. In this Letter, based on Guo's novel 2-D graphical representation of DNA sequences of low degeneracy, we introduce the improved first-order moments of the x and y coordinates and the radius of DNA sequences, and the distance of two DNA sequences. The new descriptors of DNA sequences give a good numerical characterization of DNA sequences, which have lower degeneracy.

  9. 2D/1D approximations to the 3D neutron transport equation. II: Numerical comparisons

    SciTech Connect

    Kelley, B. W.; Collins, B.; Larsen, E. W.

    2013-07-01

    In a companion paper [1], (i) several new '2D/1D equations' are introduced as accurate approximations to the 3D Boltzmann transport equation, (ii) the simplest of these approximate equations is systematically discretized, and (iii) a theoretically stable iteration scheme is developed to solve the discrete equations. In this paper, numerical results are presented that confirm the theoretical predictions made in [1]. (authors)

  10. Modelling 2001 lahars at Popocatépetl volcano using FLO2D numerical code

    NASA Astrophysics Data System (ADS)

    Caballero, L.; Capra, L.

    2013-12-01

    Popocatépetl volcano is located on the central part of the Transmexican Volcanic Belt. It is one of the most active volcanoes in Mexico and endanger more than 25 million people that lives in its surroundings. In the last months, the renewal of its volcanic activity put into alert scientific community. One of the possible scenarios is the 2001 explosive activity, which was characterized by a 8 km eruptive column and the subsequent formation of pumice flows up to 4 km from the crater. Lahars were generated few hours after, remobilizing the new deposits towards NE flank of the volcano, along Huiloac Gorge, almost reaching Santiago Xalitzintla town (Capra et al., 2004). The occurrence of a similar scenario makes very important to reproduce this event to delimitate accurately lahar hazard zones. In this work, 2001 lahar deposit is modeled using FLO2D numerical code. Geophone data is used to reconstruct initial hydrograph and sediment concentration. Sensitivity study of most important parameters used by this code like Manning, and α and β coefficients was conducted in order to achieve a good simulation. Results obtained were compared with field data and demonstrated a good agreement in thickness and flow distribution. A comparison with previously published data with laharZ program (Muñoz-Salinas, 2009) is also made. Additionally, lahars with fluctuating sediment concentrations but with similar volume are simulated to observe the influence of the rheological behavior on lahar distribution.

  11. 2D vs. 3D mammography observer study

    NASA Astrophysics Data System (ADS)

    Fernandez, James Reza F.; Hovanessian-Larsen, Linda; Liu, Brent

    2011-03-01

    Breast cancer is the most common type of non-skin cancer in women. 2D mammography is a screening tool to aid in the early detection of breast cancer, but has diagnostic limitations of overlapping tissues, especially in dense breasts. 3D mammography has the potential to improve detection outcomes by increasing specificity, and a new 3D screening tool with a 3D display for mammography aims to improve performance and efficiency as compared to 2D mammography. An observer study using a mammography phantom was performed to compare traditional 2D mammography with this ne 3D mammography technique. In comparing 3D and 2D mammography there was no difference in calcification detection, and mass detection was better in 2D as compared to 3D. There was a significant decrease in reading time for masses, calcifications, and normals in 3D compared to 2D, however, as well as more favorable confidence levels in reading normal cases. Given the limitations of the mammography phantom used, however, a clearer picture in comparing 3D and 2D mammography may be better acquired with the incorporation of human studies in the future.

  12. Validation of a 2-D semi-coupled numerical model for fluid-structure-seabed interaction

    NASA Astrophysics Data System (ADS)

    Ye, Jianhong; Jeng, Dongsheng; Wang, Ren; Zhu, Changqi

    2013-10-01

    A 2-D semi-coupled model PORO-WSSI 2D (also be referred as FSSI-CAS 2D) for the Fluid-Structure-Seabed Interaction (FSSI) has been developed by employing RANS equations for wave motion in fluid domain, VARANS equations for porous flow in porous structures; and taking the dynamic Biot's equations (known as "u - p" approximation) for soil as the governing equations. The finite difference two-step projection method and the forward time difference method are adopted to solve the RANS, VARANS equations; and the finite element method is adopted to solve the "u - p" approximation. A data exchange port is developed to couple the RANS, VARANS equations and the dynamic Biot's equations together. The analytical solution proposed by Hsu and Jeng (1994) and some experiments conducted in wave flume or geotechnical centrifuge in which various waves involved are used to validate the developed semi-coupled numerical model. The sandy bed involved in these experiments is poro-elastic or poro-elastoplastic. The inclusion of the interaction between fluid, marine structures and poro-elastoplastic seabed foundation is a special point and highlight in this paper, which is essentially different with other previous coupled models The excellent agreement between the numerical results and the experiment data indicates that the developed coupled model is highly reliablefor the FSSI problem.

  13. Numerical Simulations of High-Frequency Respiratory Flows in 2D and 3D Lung Bifurcation Models

    NASA Astrophysics Data System (ADS)

    Chen, Zixi; Parameswaran, Shamini; Hu, Yingying; He, Zhaoming; Raj, Rishi; Parameswaran, Siva

    2014-07-01

    To better understand the human pulmonary system and optimize the high-frequency oscillatory ventilation (HFOV) design, numerical simulations were conducted under normal breathing frequency and HFOV condition using a CFD code Ansys Fluent and its user-defined C programs. 2D and 3D double bifurcating lung models were created, and the geometry corresponds to fifth to seventh generations of airways with the dimensions based on the Weibel's pulmonary model. Computations were carried out for different Reynolds numbers (Re = 400 and 1000) and Womersley numbers (α = 4 and 16) to study the air flow fields, gas transportation, and wall shear stresses in the lung airways. Flow structure was compared with experimental results. Both 2D and 3D numerical models successfully reproduced many results observed in the experiment. The oxygen concentration distribution in the lung model was investigated to analyze the influence of flow oscillation on gas transport inside the lung model.

  14. Water cycling beneath subduction zones in 2D and 3D numerical models (Invited)

    NASA Astrophysics Data System (ADS)

    Rupke, L.; Iyer, K. H.; Hasenclever, J.; Morgan, J.

    2013-12-01

    Tracing the cycling of fluids and volatiles through subduction zones continues to be a challenging task with budgets still having large error bars attached to them. In this contribution we show how numerical models can help to integrate various geological, geophysical, and geochemical datasets and how they can be used to put better bounds on the likely amounts of water being subducted, released into the arc and back-arc melting regions, and recycled to the deeper mantle. To achieve this task we use a suite of numerical models. Bending related faulting and hydration of the incoming lithosphere is resolved using a reactive flow model that solves for crustal scale fluid flow and mantle serpentinization using reaction kinetics. Seismic tomography studies from offshore Chile and Central America are used to evaluate and constrain the effective reaction rate. These rates are then used to assess the contribution of serpentinization to the water budget at subduction zones. The pattern of hydration is controlled by the reaction kinetics and serpentinization is most intense around the 270°C isotherm. The depth of this isotherm correlates well with the dominant spacing of double seismic zones observed globally. Comparison of the results with heat flow data suggests that observed seafloor temperature gradients in the bend-fault region are too low to be caused by ';one-pass' downward water flow into the serpentinizing lithosphere, but rather suggest that bend-faults are areas of active hydrothermal circulation. This implies that serpentine-sourced vents and chemosynthetic vent communities should be found in this deep-sea environment as well. Dehydration reactions are resolved with a 2D kinematic subduction zone model that computes the temperature field and the likely locations and volumes of slab fluid release due to metamorphic dehydration reactions. Here we find that up to 1/3 of the subducted water may be transported into the deeper mantle for the coldest subduction zones

  15. Numerical computation of 2D Sommerfeld integrals - Decomposition of the angular integral

    NASA Astrophysics Data System (ADS)

    Dvorak, Steven L.; Kuester, Edward F.

    1992-02-01

    The computational efficiency of the 2D Sommerfeld integrals is shown to undergo improvement through the discovery of novel ways to compute the inner angular integral in polar representations. It is shown that the angular integral can be decomposed into a finite number of incomplete Lipschitz-Hankel integrals; these can in turn be calculated through a series of expansions, so that the angular integral can be computed by summing a series rather than applying a standard numerical integration algorithm. The technique is most efficient and accurate when piecewise-sinusoidal basis functions are employed to analyze a printed strip-dipole antenna in a layered medium.

  16. On craton thinning/destruction: Insight from 2D thermal-mechanical numerical modeling

    NASA Astrophysics Data System (ADS)

    Liao, J.

    2014-12-01

    Although most cratons maintain stable, some exceptions are present, such as the North China craton, North Atlantic craton, and Wyoming craton, which have experienced dramatic lithospheric deformation/thinning. Mechanisms triggering cratonic thinning remains enigmatic [Lee et al., 2011]. Using a 2D thermo-mechanical coupled numerical model [Gerya and Yuen, 2007], we investigate two possible mechanisms: (1) stratification of cratonic lithospheric mantle, and (2) rheological weakening due to hydration.Lithospheric mantle stratification is a common feature in cratonic areas which has been demonstrated by geophysical and geochemical studies [Thybo and Perchuc, 1997; Griffin et al., 2004; Romanowicz, 2009; Rychert and Shearer, 2009; Yuan and Romanowicz, 2010]. The influence of lithospheric mantle stratification during craton evolution remains poorly understood. A rheologically weak layer representing hydrated and/or metasomatized composition is implemented in the lithospheric mantle. Our results show that the weak mantle layer changes the dynamics of lithospheric extension by enhancing the deformation of the overlying mantle and crust and inhibiting deformation of the underlying mantle [Liao et al., 2013; Liao and Gerya, 2014]. Modeling results are compared with North China and North Atlantic cratons. Our work indicates that although the presence of a weak layer may not be sufficient to initiate craton deformation, it enhances deformation by lowering the required extensional plate boundary force. Rheological weakening due to hydration is a possible mechanism triggering/enhancing craton deformation, especially for cratons jaxtaposing with a subduction, since water can release from a subducting slab. We investigate the influence of wet mantle flow laws [Hirth and Kohlstedt, 2003], in which a water parameter (i.e. constant water content) is involved. Our results show that wet dislocation alone does not accelerate cratonic deformation significantly. However, if wet diffusion

  17. Comparison of 3-D finite element model of ashlar masonry with 2-D numerical models of ashlar masonry

    NASA Astrophysics Data System (ADS)

    Beran, Pavel

    2016-06-01

    3-D state of stress in heterogeneous ashlar masonry can be also computed by several suitable chosen 2-D numerical models of ashlar masonry. The results obtained from 2-D numerical models well correspond to the results obtained from 3-D numerical model. The character of thermal stress is the same. While using 2-D models the computational time is reduced more than hundredfold and therefore this method could be used for computation of thermal stresses during long time periods with 10 000 of steps.

  18. Mechanical Modelling of Pultrusion Process: 2D and 3D Numerical Approaches

    NASA Astrophysics Data System (ADS)

    Baran, Ismet; Hattel, Jesper H.; Akkerman, Remko; Tutum, Cem C.

    2015-02-01

    The process induced variations such as residual stresses and distortions are a critical issue in pultrusion, since they affect the structural behavior as well as the mechanical properties and geometrical precision of the final product. In order to capture and investigate these variations, a mechanical analysis should be performed. In the present work, the two dimensional (2D) quasi-static plane strain mechanical model for the pultrusion of a thick square profile developed by the authors is further improved using generalized plane strain elements. In addition to that, a more advanced 3D thermo-chemical-mechanical analysis is carried out using 3D quadratic elements which is a novel application for the numerical modelling of the pultrusion process. It is found that the 2D mechanical models give relatively reasonable and accurate stress and displacement evolutions in the transverse direction as compared to the 3D model. Moreover, the generalized plane strain model predicts the longitudinal process induced stresses more similar to the ones calculated in the 3D model as compared with the plane strain model.

  19. Optical fiber poling by induction: analysis by 2D numerical modeling.

    PubMed

    De Lucia, F; Huang, D; Corbari, C; Healy, N; Sazio, P J A

    2016-04-15

    Since their first demonstration some 25 years ago, thermally poled silica fibers have been used to realize device functions such as electro-optic modulation, switching, polarization-entangled photons, and optical frequency conversion with a number of advantages over bulk free-space components. We have recently developed an innovative induction poling technique that could allow for the development of complex microstructured fiber geometries for highly efficient χ(2)-based device applications. To systematically implement these more advanced poled fiber designs, we report here the development of comprehensive numerical models of the induction poling mechanism itself via two-dimensional (2D) simulations of ion migration and space-charge region formation using finite element analysis. PMID:27082323

  20. Numerical analysis of InSb parameters and InSb 2D infrared focal plane arrays

    NASA Astrophysics Data System (ADS)

    Zhang, Xiaolei; Zhang, Hongfei; Sun, Weiguo; Zhang, Lei; Meng, Chao; Lu, Zhengxiong

    2012-10-01

    Accurate and reliable numerical simulation tools are necessary for the development of advanced semiconductor devices. InSb is using the MATLAB and TCAD simulation tool to calculatet the InSb body bandstructure, blackbody's radiant emittance and simultaneously solve the Poisson, Continuity and transport equations for 2D detector structures. In this work the material complexities of InSb, such as non-parabolicity, degenergcy, mobility and Auger recombination/generation are explained, and physics based models are developed. The Empirical Tight Binding Method (ETBM) was been using to calculate the bandstructure for InSb at 77 K by Matlab. We describe a set of systematic experiments performed in order to calibrate the simulation to semiconductor devices backside illuminated InSb focal plane arrays realized with planar technology. The spectral photoresponse and crosstalk characteristic for mid-wavelength InSb infrared focal plane arrays have been numerically studied.

  1. Numerical simulation of HTPB combustion in a 2D hybrid slab combustor

    NASA Astrophysics Data System (ADS)

    Gariani, Gabriela; Maggi, Filippo; Galfetti, Luciano

    2011-09-01

    A code for the numerical simulation of combustion processes in hybrid rockets, developed at the Space Propulsion Laboratory of Politecnico di Milano (SPLab), is presented. The code deals with Navier-Stokes equations solved with RANS approach, blowing effect, combustion kinetics and radiation. The equations are closed with k-epsilon turbulence model and well stirred reactor model. The P1 model, a simplification of the PN radiation model, is adopted. Specific simulation tools were developed using OpenFOAM®open source technology. The computational domain is 2D and split in two subdomains, simulating the reacting gas mixture on one side and the solid fuel grain on the other. The interface between the two regions plays a key role as the solid grain pyrolysis comes from a straight solution of the model without shortcuts. A propellant combination with polybutadiene and gaseous oxygen has been chosen and a reduced kinetic model for combustion of butadiene, considered as the major gaseous constituent coming from polybutadiene pyrolysis, has been developed for reactions occurring in oxygen atmosphere. The computational domain tries to replicate the real experimental setup and is split into three areas: pre-chamber, slab zone and post-chamber. High speed camera visualizations of the combustion processes allow to compare the flame height, obtained by the code and by experimental tests, along the grain for given boundary conditions.

  2. Numerical computation of 2D sommerfeld integrals— A novel asymptotic extraction technique

    NASA Astrophysics Data System (ADS)

    Dvorak, Steven L.; Kuester, Edward F.

    1992-02-01

    The accurate and efficient computation of the elements in the impedance matrix is a crucial step in the application of Galerkin's method to the analysis of planar structures. As was demonstrated in a previous paper, it is possible to decompose the angular integral, in the polar representation for the 2D Sommerfeld integrals, in terms of incomplete Lipschitz-Hankel integrals (ILHIs) when piecewise sinusoidal basis functions are employed. Since Bessel series expansions can be used to compute these ILHIs, a numerical integration of the inner angular integral is not required. This technique provides an efficient method for the computation of the inner angular integral; however, the outer semi-infinite integral still converges very slowly when a real axis integration is applied. Therefore, it is very difficult to compute the impedance elements accurately and efficiently. In this paper, it is shown that this problem can be overcome by using the ILHI representation for the angular integral to develop a novel asymptotic extraction technique for the outer semi-infinite integral. The usefulness of this asymptotic extraction technique is demonstrated by applying it to the analysis of a printed strip dipole antenna in a layered medium.

  3. von Neumann Stability Analysis of Numerical Solution Schemes for 1D and 2D Euler Equations

    NASA Astrophysics Data System (ADS)

    Konangi, Santosh; Palakurthi, Nikhil Kumar; Ghia, Urmila

    2014-11-01

    A von Neumann stability analysis is conducted for numerical schemes for the full system of coupled, density-based 1D and 2D Euler equations, closed by an isentropic equation of state. The governing equations are discretized on a staggered grid, which permits equivalence to finite-volume discretization. Presently, first-order accurate spatial and temporal finite-difference techniques are analyzed. The momentum convection term is treated as explicit, semi-implicit or implicit. Density upwind bias is included in the spatial operator of the continuity equation. By combining the discretization techniques, ten solution schemes are formulated. For each scheme, unstable and stable regimes are identified through the stability analysis, and the maximum allowable CFL number is predicted. The predictions are verified for selected schemes, using the Riemann problem at incompressible and compressible Mach numbers. Very good agreement is obtained between the analytically predicted and ``experimentally'' observed CFL values for all cases, thereby validating the analysis. The demonstrated analysis provides an accurate indication of stability conditions for the Euler equations, in contrast to the simplistic conditions arising from model equations, such as the wave equation.

  4. Numerical simulation of 2D buoyant jets in ice-covered and temperature-stratified water

    NASA Astrophysics Data System (ADS)

    Gu, Ruochuan

    A two-dimensional (2D) unsteady simulation model is applied to the problem of a submerged warm water discharge into a stratified lake or reservoir with an ice cover. Numerical simulations and analyses are conducted to gain insight into large-scale convective recirculation and flow processes in a cold waterbody induced by a buoyant jet. Jet behaviors under various discharge temperatures are captured by directly modeling flow and thermal fields. Flow structures and processes are described by the simulated spatial and temporal distributions of velocity and temperature in various regions: deflection, recirculation, attachment, and impingement. Some peculiar hydrothermal and dynamic features, e.g. reversal of buoyancy due to the dilution of a warm jet by entraining cold ambient water, are identified and examined. Simulation results show that buoyancy is the most important factor controlling jet behavior and mixing processes. The inflow boundary is treated as a liquid wall from which the jet is offset. Similarity and difference in effects of boundaries perpendicular and parallel to flow, and of buoyancy on jet attachment and impingement, are discussed. Symmetric flow configuration is used to de-emphasize the Coanda effect caused by offset.

  5. Absorption and Scattering 2D Volcano Images from Numerically Calculated Space-weighting functions

    NASA Astrophysics Data System (ADS)

    Del Pezzo, Edoardo; Ibañez, Jesus; Prudencio, Janire; Bianco, Francesca; De Siena, Luca

    2016-04-01

    Short period small magnitude seismograms mainly comprise scattered waves in the form of coda waves (the tail part of the seismogram, starting after S-waves and ending when the noise prevails), spanning more than 70% of the whole seismogram duration. Corresponding coda envelopes provide important information about the earth inhomogeneity, which can be stochastically modeled in terms of distribution of scatterers in a random medium. In suitable experimental conditions (i.e. high earth heterogeneity) either the two parameters describing heterogeneity (scattering coefficient), intrinsic energy dissipation (coefficient of intrinsic attenuation) or a combination of them (extinction length and seismic albedo) can be used to image Earth structures. Once a set of such parameter couples has been measured in a given area and for a number of sources and receivers, imaging their space distribution with standard methods is straightforward. However, as for finite-frequency and full-waveform tomography, the essential problem for a correct imaging is the determination of the weighting function describing the spatial sensitivity of observable data to scattering and absorption anomalies. Due to the nature of coda waves, the measured parameter-couple can be seen as a weighted space average of the real parameters characterizing the rock volumes illuminated by the scattered waves. This paper uses the Monte Carlo numerical solution of the Energy Transport Equation to find approximate but realistic 2D space-weighting functions for coda waves. Separate images for scattering and absorption based on these sensitivity functions are then compared with those obtained with commonly-used sensitivity functions in an application to data from an active seismic experiment carried out at Deception Island (Antarctica). Results show the that these novel functions are based on a reliable and physically grounded method to image magnitude and shape of scattering and absorption anomalies. Their extension to

  6. Absorption and scattering 2-D volcano images from numerically calculated space-weighting functions

    NASA Astrophysics Data System (ADS)

    Del Pezzo, Edoardo; Ibañez, Jesus; Prudencio, Janire; Bianco, Francesca; De Siena, Luca

    2016-08-01

    Short-period small magnitude seismograms mainly comprise scattered waves in the form of coda waves (the tail part of the seismogram, starting after S waves and ending when the noise prevails), spanning more than 70 per cent of the whole seismogram duration. Corresponding coda envelopes provide important information about the earth inhomogeneity, which can be stochastically modeled in terms of distribution of scatterers in a random medium. In suitable experimental conditions (i.e. high earth heterogeneity), either the two parameters describing heterogeneity (scattering coefficient), intrinsic energy dissipation (coefficient of intrinsic attenuation) or a combination of them (extinction length and seismic albedo) can be used to image Earth structures. Once a set of such parameter couples has been measured in a given area and for a number of sources and receivers, imaging their space distribution with standard methods is straightforward. However, as for finite-frequency and full-waveform tomography, the essential problem for a correct imaging is the determination of the weighting function describing the spatial sensitivity of observable data to scattering and absorption anomalies. Due to the nature of coda waves, the measured parameter couple can be seen as a weighted space average of the real parameters characterizing the rock volumes illuminated by the scattered waves. This paper uses the Monte Carlo numerical solution of the Energy Transport Equation to find approximate but realistic 2-D space-weighting functions for coda waves. Separate images for scattering and absorption based on these sensitivity functions are then compared with those obtained with commonly used sensitivity functions in an application to data from an active seismic experiment carried out at Deception Island (Antarctica). Results show that these novel functions are based on a reliable and physically grounded method to image magnitude and shape of scattering and absorption anomalies. Their

  7. A nonlocal finite difference scheme for simulation of wave propagation in 2D models with reduced numerical dispersion

    NASA Astrophysics Data System (ADS)

    Martowicz, A.; Ruzzene, M.; Staszewski, W. J.; Rimoli, J. J.; Uhl, T.

    2014-03-01

    The work deals with the reduction of numerical dispersion in simulations of wave propagation in solids. The phenomenon of numerical dispersion naturally results from time and spatial discretization present in a numerical model of mechanical continuum. Although discretization itself makes possible to model wave propagation in structures with complicated geometries and made of different materials, it inevitably causes simulation errors when improper time and length scales are chosen for the simulations domains. Therefore, by definition, any characteristic parameter for spatial and time resolution must create limitations on maximal wavenumber and frequency for a numerical model. It should be however noted that expected increase of the model quality and its functionality in terms of affordable wavenumbers, frequencies and speeds should not be achieved merely by denser mesh and reduced time integration step. The computational cost would be simply unacceptable. The authors present a nonlocal finite difference scheme with the coefficients calculated applying a Fourier series, which allows for considerable reduction of numerical dispersion. There are presented the results of analyses for 2D models, with isotropic and anisotropic materials, fulfilling the planar stress state. Reduced numerical dispersion is shown in the dispersion surfaces for longitudinal and shear waves propagating for different directions with respect to the mesh orientation and without dramatic increase of required number of nonlocal interactions. A case with the propagation of longitudinal wave in composite material is studied with given referential solution of the initial value problem for verification of the time-domain outcomes. The work gives a perspective of modeling of any type of real material dispersion according to measurements and with assumed accuracy.

  8. Numerical Simulation of Supersonic Compression Corners and Hypersonic Inlet Flows Using the RPLUS2D Code

    NASA Technical Reports Server (NTRS)

    Kapoor, Kamlesh; Anderson, Bernhard H.; Shaw, Robert J.

    1994-01-01

    A two-dimensional computational code, PRLUS2D, which was developed for the reactive propulsive flows of ramjets and scramjets, was validated for two-dimensional shock-wave/turbulent-boundary-layer interactions. The problem of compression corners at supersonic speeds was solved using the RPLUS2D code. To validate the RPLUS2D code for hypersonic speeds, it was applied to a realistic hypersonic inlet geometry. Both the Baldwin-Lomax and the Chien two-equation turbulence models were used. Computational results showed that the RPLUS2D code compared very well with experimentally obtained data for supersonic compression corner flows, except in the case of large separated flows resulting from the interactions between the shock wave and turbulent boundary layer. The computational results compared well with the experiment results in a hypersonic NASA P8 inlet case, with the Chien two-equation turbulence model performing better than the Baldwin-Lomax model.

  9. Pool Formation in Boulder-Bed Streams: Implications From 1-D and 2-D Numerical Modeling

    NASA Astrophysics Data System (ADS)

    Harrison, L. R.; Keller, E. A.

    2003-12-01

    In mountain rivers of Southern California, boulder-large roughness elements strongly influence flow hydraulics and pool formation and maintenance. In these systems, boulders appear to control the stream morphology by converging flow and producing deep pools during channel forming discharges. Our research goal is to develop quantitative relationships between boulder roughness elements, temporal patterns of scour and fill, and geomorphic processes that are important in producing pool habitat. The longitudinal distribution of shear stress, unit stream power and velocity were estimated along a 48 m reach on Rattlesnake Creek, using the HEC-RAS v 3.0 and River 2-D numerical models. The reach has an average slope of 0.02 and consists of a pool-riffle sequence with a large boulder constriction directly above the pool. Model runs were performed for a range of stream discharges to test if scour and fill thresholds for pool and riffle environments could be identified. Results from the HEC-RAS simulations identified that thresholds in shear stress, unit stream power and mean velocity occur above a discharge of 5.0 cms. Results from the one-dimensional analysis suggest that the reversal in competency is likely due to changes in cross-sectional width at varying flows. River 2-D predictions indicated that strong transverse velocity gradients were present through the pool at higher modeled discharges. At a flow of 0.5 cms (roughly 1/10th bankfull discharge), velocities are estimated at 0.6 m/s and 1.3 m/s for the pool and riffle, respectively. During discharges of 5.15 cms (approximate bankfull discharge), the maximum velocity in the pool center increased to nearly 3.0 m/s, while the maximum velocity over the riffle is estimated at approximately 2.5 cms. These results are consistent with those predicted by HEC-RAS, though the reversal appears to be limited to a narrow jet that occurs through the pool head and pool center. Model predictions suggest that the velocity reversal is

  10. 2-D Numerical Simulation of Eruption Clouds : Effects of Turbulent Mixing between Eruption Cloud and Air

    NASA Astrophysics Data System (ADS)

    Suzuki, Y.; KOYAGUCHI, T.; OGAWA, M.; Hachisu, I.

    2001-05-01

    Mixing of eruption cloud and air is one of the most important processes for eruption cloud dynamics. The critical condition of eruption types (eruption column or pyroclastic flow) depends on efficiency of mixing of eruption cloud and the ambient air. However, in most of the previous models (e.g., Sparks,1986; Woods, 1988), the rate of mixing between cloud and air is taken into account by introducing empirical parameters such as entrainment coefficient or turbulent diffusion coefficient. We developed a numerical model of 2-D (axisymmetrical) eruption columns in order to simulate the turbulent mixing between eruption column and air. We calculated the motion of an eruption column from a circular vent on the flat surface of the earth. Supposing that relative velocity of gas and ash particles is sufficiently small, we can treat eruption cloud as a single gas. Equation of state (EOS) for the mixture of the magmatic component (i.e. volcanic gas plus pyroclasts) and air can be expressed by EOS for an ideal gas, because volume fraction of the gas phase is very large. The density change as a function of mixing ratio between air and the magmatic component has a strong non-linear feature, because the density of the mixture drastically decreases as entrained air expands by heating. This non-linear feature can be reproduced by changing the gas constant and the ratio of specific heat in EOS for ideal gases; the molecular weight increases and the ratio of specific heat approaches 1 as the magmatic component increases. It is assumed that the dynamics of eruption column follows the Euler equation, so that no viscous effect except for the numerical viscosity is taken into account. Roe scheme (a general TVD scheme for compressible flow) is used in order to simulate the generation of shock waves inside and around the eruption column. The results show that many vortexes are generated around the boundary between eruption cloud and air, which results in violent mixing. When the size of

  11. 2D Quantum Mechanical Study of Nanoscale MOSFETs

    NASA Technical Reports Server (NTRS)

    Svizhenko, Alexei; Anantram, M. P.; Govindan, T. R.; Biegel, B.; Kwak, Dochan (Technical Monitor)

    2000-01-01

    With the onset of quantum confinement in the inversion layer in nanoscale MOSFETs, behavior of the resonant level inevitably determines all device characteristics. While most classical device simulators take quantization into account in some simplified manner, the important details of electrostatics are missing. Our work addresses this shortcoming and provides: (a) a framework to quantitatively explore device physics issues such as the source-drain and gate leakage currents, DIBL, and threshold voltage shift due to quantization, and b) a means of benchmarking quantum corrections to semiclassical models (such as density-gradient and quantum-corrected MEDICI). We have developed physical approximations and computer code capable of realistically simulating 2-D nanoscale transistors, using the non-equilibrium Green's function (NEGF) method. This is the most accurate full quantum model yet applied to 2-D device simulation. Open boundary conditions and oxide tunneling are treated on an equal footing. Electrons in the ellipsoids of the conduction band are treated within the anisotropic effective mass approximation. We present the results of our simulations of MIT 25, 50 and 90 nm "well-tempered" MOSFETs and compare them to those of classical and quantum corrected models. The important feature of quantum model is smaller slope of Id-Vg curve and consequently higher threshold voltage. Surprisingly, the self-consistent potential profile shows lower injection barrier in the channel in quantum case. These results are qualitatively consistent with ID Schroedinger-Poisson calculations. The effect of gate length on gate-oxide leakage and subthreshold current has been studied. The shorter gate length device has an order of magnitude smaller current at zero gate bias than the longer gate length device without a significant trade-off in on-current. This should be a device design consideration.

  12. Power production locality of bluff body flutter mills using fully coupled 2D direct numerical simulation

    NASA Astrophysics Data System (ADS)

    Kuhl, J. M.; Desjardin, P. E.

    2012-01-01

    Two-dimensional, fully coupled direct numerical simulations (DNS) are conducted to examine the local energy dynamics of a flexible cantilevered plate in the wake of a two-dimensional circular cylinder. The motion of the cantilevered plate is described using a finite element formulation and a fully compressible, finite volume Navier Stokes solver is used to compute the flow field. A sharp interface level set method is employed in conjunction with a ghost fluid method to describe the immersed boundaries of the bluff body and flexible plate. DNS is first conducted to validate the numerical methodology and compared with previous studies of flexible cantilevered plates and flow over bluff bodies; excellent agreement with previous results is observed. A newly defined power production/loss geometry metric is introduced based on surface curvature and plate velocity. The metric is found to be useful for determining which sections of the plate will produce energy based on curvature and deflection rate. Scatter plots and probability measures are presented showing a high correlation between the direction of energy transfer (i.e., to or from the plate) and the sign of the newly defined curvature-deflection-rate metric. The findings from this study suggest that a simple local geometry/kinematic based metric can be devised to aid in the development and design of flexible wind energy harvesting flutter mills.

  13. Numerical Simulations of the Propagation of a Liquid Plug through a 2D Airway Bifurcation

    NASA Astrophysics Data System (ADS)

    Vaughan, Benjamin L., Jr.; Grotberg, James B.

    2010-11-01

    Numerous medical therapies require the instillation of liquids plugs and their delivery throughout the pulmonary airways. This process and the effect on the resulting liquid distribution is controlled by a number of parameters, including airway orientation with respect to gravity, initial plug volume, liquid physical properties, and the imposed airflow rate which drives the plug from behind. The airflow rate defines an operative Capillary number, Ca, and the influence of gravity appears as an effective Bond number, Bo, whose magnitude varies with orientation. In this study, we develop a numerical method for solving the propagation of a liquid plug into a two-dimensional airway bifurcation consisting of a parent channel branching into two daughter channels. We measure the splitting ratio, RS, which is defined as the ratio of the liquid plug volumes between the daughter branches. RS increases with Ca and asymptotes to 1 as Ca goes to infinity, which corresponds to an equal split, while increasing Bo requires a higher value of Ca for an equal split. We also examine the normal and shear stresses on the bifurcation walls and observe that the stresses on the upper walls increase as Bo increases while the stresses on the lower walls decrease as Bo increases.

  14. Comparison between 2D and 3D Numerical Modelling of a hot forging simulative test

    SciTech Connect

    Croin, M.; Ghiotti, A.; Bruschi, S.

    2007-04-07

    The paper presents the comparative analysis between 2D and 3D modelling of a simulative experiment, performed in laboratory environment, in which operating conditions approximate hot forging of a turbine aerofoil section. The plane strain deformation was chosen as an ideal case to analyze the process because of the thickness variations in the final section and the consequent distributions of contact pressure and sliding velocity at the interface that are closed to the conditions of the real industrial process. In order to compare the performances of 2D and 3D approaches, two different analyses were performed and compared with the experiments in terms of loads and temperatures peaks at the interface between the dies and the workpiece.

  15. 2D transient granular flows over obstacles: experimental and numerical work

    NASA Astrophysics Data System (ADS)

    Juez, Carmelo; Caviedes-Voullième, Daniel; Murillo, Javier; García-Navarro, Pilar

    2016-04-01

    Landslides are an ubiquitous natural hazard, and therefore human infrastructure and settlements are often at risk in mountainous regions. In order to better understand and predict landslides, systematic studies of the phenomena need to be undertaken. In particular, computational tools which allow for analysis of field problems require to be thoroughly tested, calibrated and validated under controlled conditions. And to do so, it is necessary for such controlled experiments to be fully characterized in the same terms as the numerical model requires. This work presents an experimental study of dry granular flow over a rough bed with topography which resembles a mountain valley. It has an upper region with a very high slope. The geometry of the bed describes a fourth order polynomial curve, with a low point with zero slope, and afterwards a short region with adverse slope. Obstacles are present in the lower regions which are used as model geometries of human structures. The experiments consisted of a sudden release a mass of sand on the upper region, and allowing it to flow downslope. Furthermore, it has been frequent in previous studies to measure final states of the granular mass at rest, but seldom has transient data being provided, and never for the entire field. In this work we present transient measurements of the moving granular surfaces, obtained with a consumer-grade RGB-D sensor. The sensor, developed for the videogame industry, allows to measure the moving surface of the sand, thus obtaining elevation fields. The experimental results are very consistent and repeatable. The measured surfaces clearly show the distinctive features of the granular flow around the obstacles and allow to qualitatively describe the different flow patterns. More importantly, the quantitative description of the granular surface allows for benchmarking and calibration of predictive numerical models, key in scaling the small-scale experimental knowledge into the field. In addition, as

  16. Numerical Real Space Renormalization of a 2D Random Boson Model

    NASA Astrophysics Data System (ADS)

    Iyer, Shankar; Refael, Gil

    2011-03-01

    Interest in the random boson problem originated in experiments on Helium adsorbed in Vycor, but the problem arises in many contexts, including Josephson junction arrays and disordered cold atom systems. Recently, Altman, Kafri, Polkovnikov, and Refael have studied a rotor model description of interacting bosons subjected to quenched disorder in one dimension. Using a real space renormalization approach, they have identified a random fixed point that marks the transition between superfluid and Mott-glass phases. Here, we describe work that numerically extends their approach to the random boson problem in two dimensions. We first test the validity of the real space renormalization by comparison to exact diagonalization of small systems. Then, we move to larger systems and explore what the renormalization scheme can tell us about the nature of the insulating and superfluid phases.

  17. Installed Transonic 2D Nozzle Nacelle Boattail Drag Study

    NASA Technical Reports Server (NTRS)

    Malone, Michael B.; Peavey, Charles C.

    1999-01-01

    The Transonic Nozzle Boattail Drag Study was initiated in 1995 to develop an understanding of how external nozzle transonic aerodynamics effect airplane performance and how strongly those effects are dependent on nozzle configuration (2D vs. axisymmetric). MDC analyzed the axisymmetric nozzle. Boeing subcontracted Northrop-Grumman to analyze the 2D nozzle. AU participants analyzed the AGARD nozzle as a check-out and validation case. Once the codes were checked out and the gridding resolution necessary for modeling the separated flow in this region determined, the analysis moved to the installed wing/body/nacelle/diverter cases. The boat tail drag validation case was the AGARD B.4 rectangular nozzle. This test case offered both test data and previous CFD analyses for comparison. Results were obtained for test cases B.4.1 (M=0.6) and B.4.2 (M=0.938) and compared very well with the experimental data. Once the validation was complete a CFD grid was constructed for the full Ref. H configuration (wing/body/nacelle/diverter) using a combination of patched and overlapped (Chimera) grids. This was done to ensure that the grid topologies and density would be adequate for the full model. The use of overlapped grids allowed the same grids from the full configuration model to be used for the wing/body alone cases, thus eliminating the risk of grid differences affecting the determination of the installation effects. Once the full configuration model was run and deemed to be suitable the nacelle/diverter grids were removed and the wing/body analysis performed. Reference H wing/body results were completed for M=0.9 (a=0.0, 2.0, 4.0, 6.0 and 8.0), M=1.1 (a=4.0 and 6.0) and M=2.4 (a=0.0, 2.0, 4.4, 6.0 and 8.0). Comparisons of the M=0.9 and M=2.4 cases were made with available wind tunnel data and overall comparisons were good. The axi-inlet/2D nozzle nacelle was analyzed isolated. The isolated nacelle data coupled with the wing/body result enabled the interference effects of the

  18. Numerical solution of 2D-vector tomography problem using the method of approximate inverse

    NASA Astrophysics Data System (ADS)

    Svetov, Ivan; Maltseva, Svetlana; Polyakova, Anna

    2016-08-01

    We propose a numerical solution of reconstruction problem of a two-dimensional vector field in a unit disk from the known values of the longitudinal and transverse ray transforms. The algorithm is based on the method of approximate inverse. Numerical simulations confirm that the proposed method yields good results of reconstruction of vector fields.

  19. Effect of River Training Project on Hydrodynamics Flow Circumstances by 2D Finite Element Numerical Model

    NASA Astrophysics Data System (ADS)

    Zou, B.; Li, D. F.; Hu, H. J.; Zhang, H. W.; Lou, L. H.; Chen, M.; Lv, Z. Y.

    Based on the verified two dimensional(2D) finite element model for river flow simulation, the effect of estuary training levees on the water flow and sediment movement in the Yellow River estuary is analyzed. For disclosing the effect of setting the two training levees on the flow and sediment motion, the calculation and analysis for the two projects, (one is no levees, the other is setting up two no levees) are given. The results show that when setting up two training levees, water flow is bound by levees and the water flows become more concentrated. As a result, velocity increases in the main channel, sediment carrying capacity of water flow increases correspondingly.

  20. Numerical method of crack analysis in 2D finite magnetoelectroelastic media

    NASA Astrophysics Data System (ADS)

    Zhao, Minghao; Xu, Guangtao; Fan, Cuiying

    2010-04-01

    The present paper extends the hybrid extended displacement discontinuity fundamental solution method (HEDD-FSM) (Eng Anal Bound Elem 33:592-600, 2009) to analysis of cracks in 2D finite magnetoelectroelastic media. The solution of the crack is expressed approximately by a linear combination of fundamental solutions of the governing equations, which includes the extended point force fundamental solutions with sources placed at chosen points outside the domain of the problem under consideration, and the extended Crouch fundamental solutions with extended displacement discontinuities placed on the crack. The coefficients of the fundamental solutions are determined by letting the approximated solution satisfy the prescribed boundary conditions on the boundary of the domain and on the crack face. The Crouch fundamental solution for a parabolic element at the crack tip is derived to model the square root variations of near tip fields. The extended stress intensity factors are calculated under different electric and magnetic boundary conditions.

  1. Reliability of astrophysical jet simulations in 2D. On inter-code reliability and numerical convergence

    NASA Astrophysics Data System (ADS)

    Krause, M.; Camenzind, M.

    2001-12-01

    In the present paper, we examine the convergence behavior and inter-code reliability of astrophysical jet simulations in axial symmetry. We consider both pure hydrodynamic jets and jets with a dynamically significant magnetic field. The setups were chosen to match the setups of two other publications, and recomputed with the MHD code NIRVANA. We show that NIRVANA and the two other codes give comparable, but not identical results. We explain the differences by the different application of artificial viscosity in the three codes and numerical details, which can be summarized in a resolution effect, in the case without magnetic field: NIRVANA turns out to be a fair code of medium efficiency. It needs approximately twice the resolution as the code by Lind (Lind et al. 1989) and half the resolution as the code by Kössl (Kössl & Müller 1988). We find that some global properties of a hydrodynamical jet simulation, like e.g. the bow shock velocity, converge at 100 points per beam radius (ppb) with NIRVANA. The situation is quite different after switching on the toroidal magnetic field: in this case, global properties converge even at 10 ppb. In both cases, details of the inner jet structure and especially the terminal shock region are still insufficiently resolved, even at our highest resolution of 70 ppb in the magnetized case and 400 ppb for the pure hydrodynamic jet. The magnetized jet even suffers from a fatal retreat of the Mach disk towards the inflow boundary, which indicates that this simulation does not converge, in the end. This is also in definite disagreement with earlier simulations, and challenges further studies of the problem with other codes. In the case of our highest resolution simulation, we can report two new features: first, small scale Kelvin-Helmholtz instabilities are excited at the contact discontinuity next to the jet head. This slows down the development of the long wavelength Kelvin-Helmholtz instability and its turbulent cascade to smaller

  2. Numerical Modeling of Oxidized 2D C/SiC Composites in Air Environments Below 900 °C: Microstructure and Elastic Properties

    NASA Astrophysics Data System (ADS)

    Sun, Zhigang; Chen, Xihui; Shao, Hongyan; Song, Yingdong

    2016-08-01

    A numerical model is presented for simulation of the oxidation-affected behaviors of two dimensional carbon fiber-reinforced silcon carbide matrix composite (2D C/SiC) exposed to air oxidizing environments below 900 °C, which incorporates the modeling of oxidized microstructure and computing of degraded elastic properties. This model is based upon the analysis of the representative volume cell (RVC) of the composite. The multi-scale model of 2D C/SiC composites is concerned in the present study. Analysis results of such a composite can provide a guideline for the real 2D C/SiC composite. The micro-structure during oxidation process is firstly modeled in the RVC. The elastic moduli of oxidized composite under non-stress oxidation environment is computed by finite element analysis. The elastic properties of 2D-C/SiC composites in air oxidizing environment are evaluated and validated in comparison to experimental data. The oxidation time, temperature and fiber volume fractions of C/SiC composite are investigated to show their influences upon the elastic properties of 2D C/SiC composites.

  3. Numerical Modeling of Oxidized 2D C/SiC Composites in Air Environments Below 900 °C: Microstructure and Elastic Properties

    NASA Astrophysics Data System (ADS)

    Sun, Zhigang; Chen, Xihui; Shao, Hongyan; Song, Yingdong

    2016-04-01

    A numerical model is presented for simulation of the oxidation-affected behaviors of two dimensional carbon fiber-reinforced silcon carbide matrix composite (2D C/SiC) exposed to air oxidizing environments below 900 °C, which incorporates the modeling of oxidized microstructure and computing of degraded elastic properties. This model is based upon the analysis of the representative volume cell (RVC) of the composite. The multi-scale model of 2D C/SiC composites is concerned in the present study. Analysis results of such a composite can provide a guideline for the real 2D C/SiC composite. The micro-structure during oxidation process is firstly modeled in the RVC. The elastic moduli of oxidized composite under non-stress oxidation environment is computed by finite element analysis. The elastic properties of 2D-C/SiC composites in air oxidizing environment are evaluated and validated in comparison to experimental data. The oxidation time, temperature and fiber volume fractions of C/SiC composite are investigated to show their influences upon the elastic properties of 2D C/SiC composites.

  4. 2D-Combined ICP/CCP numerical modeling for RF plasma source

    NASA Astrophysics Data System (ADS)

    Miyashita, Masaru; Ikeda, Kei; Ochi, Syuta

    2015-09-01

    A numerical investigation of sputtering distribution on antenna cover in Radio Frequency (13.56 MHz) plasma(RF plasma) source by energetic ions bombardment has been performed including influences of static electric field from voltage of antenna and of inductive electric field from current of antenna. In order to validate the developed technique, the static electron heating distribution and the inductive electron heating distribution in simulation are compared. The comparison shows the static electric field is shielded in the sheath of the high electron density (1017m-3) plasma and the plasma is sustained by inductive electric field from current of antenna. The deep sheath potential in simulation is generated over the region of large vulnerable in experiment. The numerical simulation technique with calculating static electric field and inductive electric field is important for development of the RF plasma source with large current and long life time.

  5. Graphene as a platform to study 2D electronic transitions

    NASA Astrophysics Data System (ADS)

    Bouchiat, Vincent; Kessler, Brian; Girit, Caglar; Zettl, Alex

    2010-03-01

    The easily accessible 2D electron gas in graphene provides an ideal platform on which to tune, via application of an electrostatic gate, the coupling between electronically ordered dopants deposited on its surface. To demonstrate this concept, we have measured arrays of superconducting clusters deposited on Graphene capable to induce via the proximity effect a gate-tunable superconducting transition. Using a simple fabrication procedure based on metal layer dewetting, doped graphene sheets can be decorated with a non percolating network on nanoscale tin clusters. This hybrid material displays a two-step superconducting transition. The higher transition step is gate independent and corresponds to the transition of the tin clusters to the superconducting state. The lower transition step towards a real zero resistance state exhibiting a well developped supercurrent, is strongly gate-tunable and is quantitatively described by Berezinskii-Kosterlitz-Thouless 2D vortex unbinding. Our simple self-assembly method and tunable coupling can readily be extended to other electronic order parameters such as ferro/antiferromagnetism, charge/spin density waves using similar decoration techniques. [1] B. M. Kessler, C.O. Girit, A. Zettl, and V. Bouchiat, Tunable Superconducting Phase Transition in Metal-Decorated Graphene Sheets submitted to PRL, arXiv:0907.3661

  6. A numerical method for computing unsteady 2-D boundary layer flows

    NASA Technical Reports Server (NTRS)

    Krainer, Andreas

    1988-01-01

    A numerical method for computing unsteady two-dimensional boundary layers in incompressible laminar and turbulent flows is described and applied to a single airfoil changing its incidence angle in time. The solution procedure adopts a first order panel method with a simple wake model to solve for the inviscid part of the flow, and an implicit finite difference method for the viscous part of the flow. Both procedures integrate in time in a step-by-step fashion, in the course of which each step involves the solution of the elliptic Laplace equation and the solution of the parabolic boundary layer equations. The Reynolds shear stress term of the boundary layer equations is modeled by an algebraic eddy viscosity closure. The location of transition is predicted by an empirical data correlation originating from Michel. Since transition and turbulence modeling are key factors in the prediction of viscous flows, their accuracy will be of dominant influence to the overall results.

  7. A hybrid experimental-numerical technique for determining 3D velocity fields from planar 2D PIV data

    NASA Astrophysics Data System (ADS)

    Eden, A.; Sigurdson, M.; Mezić, I.; Meinhart, C. D.

    2016-09-01

    Knowledge of 3D, three component velocity fields is central to the understanding and development of effective microfluidic devices for lab-on-chip mixing applications. In this paper we present a hybrid experimental-numerical method for the generation of 3D flow information from 2D particle image velocimetry (PIV) experimental data and finite element simulations of an alternating current electrothermal (ACET) micromixer. A numerical least-squares optimization algorithm is applied to a theory-based 3D multiphysics simulation in conjunction with 2D PIV data to generate an improved estimation of the steady state velocity field. This 3D velocity field can be used to assess mixing phenomena more accurately than would be possible through simulation alone. Our technique can also be used to estimate uncertain quantities in experimental situations by fitting the gathered field data to a simulated physical model. The optimization algorithm reduced the root-mean-squared difference between the experimental and simulated velocity fields in the target region by more than a factor of 4, resulting in an average error less than 12% of the average velocity magnitude.

  8. 2D and 3D numerical simulations of morphodynamics structures in a large-amplitude meanders

    Technology Transfer Automated Retrieval System (TEKTRAN)

    In the pioneering study of the Ishikari River, Japan, Kinoshita (Kinoshita 1957, 1961) described two types of meandering channels: (1) channel with two bars per meander wavelength (one bar per bend), and (2) channel with three or more bars per meander wavelength (multiple bars per bend). Based on th...

  9. Numerical modeling of electromagnetic waves scattering from 2D coastal breaking sea waves

    NASA Astrophysics Data System (ADS)

    Khairi, Refzul; Coatanhay, Arnaud; Khenchaf, Ali; Scolan, Yves Marie

    2013-11-01

    The aim of this work is to model the interaction of L-band electromagnetic waves with coastal breaking sea waves. The breaking sea waves' profiles are generated using the desingularized technique and the electromagnetic waves scattering is computed using the high-order method of moments (HO-MoM) combined with non uniform rational basis spline (NURBS) geometry. Our study mainly focuses upon the electromagnetic waves behavior in the crest and the cavity of breaking sea waves. Contribution to the Topical Issue "Numelec 2012", Edited by Adel Razek.

  10. 2D numerical modeling of gravity-driven giant-scale deformation processes in the offshore Barreirinhas Basin (Brazil)

    NASA Astrophysics Data System (ADS)

    Cruciani, Francesco; Manconi, Andrea; Rinaldo Barchi, Massimiliano

    2014-05-01

    this particular place and also elsewhere. We set up a 2D fluid dynamic model by considering a Finite Element Method (FEM) environment, which allows us to well represent the geometries, densities and viscosities of the geological materials, as derived from geophysical investigations. Our study aims at understanding whether the long-term mechanical behavior of the Barreirinhas Basin DW-FTB can be reproduced by considering a simplified Newtonian fluid dynamics environment or it is controlled by a more complex rheology, which might include the effect of additional parameters such as internal friction, cohesive strength and pore-fluid pressure at the basal detachment.

  11. 2D Numerical Model And Self-Consistent Particle-In-Cell Simulations Of Coherent Synchrotron Radiation

    NASA Astrophysics Data System (ADS)

    Kwan, Thomas; Huang, Chengkun; Carlsten, Bruce

    2012-10-01

    Understanding CSR effects in a bunch compressor requires accurate and self-consistent dynamical simulations accounting for the realistic beam shape and parameters, transient dynamics and possibly a material boundary. We first extend the well-known 1D CSR model into two dimensions and develop a simple numerical algorithm based on the Lienard-Wiechert formula for the electric field of a stiff beam. This numerical model includes the 2D spatial dependence of the field in the bending plane and is accurate for arbitrary beam energy. It also removes the singularity in space charge field presented in a 1D model. Good agreement is obtained with 1D CSR analytic [1] result for FEL related beam parameters but deviations are also found for low-energy or large spot size beams and off-axis fields. We also employ fully electromagnetic Particle-In-Cell (PIC) simulations for self-consistent CSR modeling. The relatively large numerical phase error and anisotropy in a standard PIC algorithm is improved with a high order Finite Difference Time Domain scheme. Detail self-consistent PIC simulations of the CSR fields and beam dynamics will be presented and discussed.

  12. 2D dynamic studies combined with the surface curvature analysis to predict Arias Intensity amplification

    NASA Astrophysics Data System (ADS)

    Torgoev, Almaz; Havenith, Hans-Balder

    2016-01-01

    A 2D elasto-dynamic modelling of the pure topographic seismic response is performed for six models with a total length of around 23.0 km. These models are reconstructed from the real topographic settings of the landslide-prone slopes situated in the Mailuu-Suu River Valley, Southern Kyrgyzstan. The main studied parameter is the Arias Intensity (Ia, m/sec), which is applied in the GIS-based Newmark method to regionally map the seismically-induced landslide susceptibility. This method maps the Ia values via empirical attenuation laws and our studies investigate a potential to include topographic input into them. Numerical studies analyse several signals with varying shape and changing central frequency values. All tests demonstrate that the spectral amplification patterns directly affect the amplification of the Ia values. These results let to link the 2D distribution of the topographically amplified Ia values with the parameter called as smoothed curvature. The amplification values for the low-frequency signals are better correlated with the curvature smoothed over larger spatial extent, while those values for the high-frequency signals are more linked to the curvature with smaller smoothing extent. The best predictions are provided by the curvature smoothed over the extent calculated according to Geli's law. The sample equations predicting the Ia amplification based on the smoothed curvature are presented for the sinusoid-shape input signals. These laws cannot be directly implemented in the regional Newmark method, as 3D amplification of the Ia values addresses more problem complexities which are not studied here. Nevertheless, our 2D results prepare the theoretical framework which can potentially be applied to the 3D domain and, therefore, represent a robust basis for these future research targets.

  13. 2D dynamic studies combined with the surface curvature analysis to predict Arias Intensity amplification

    NASA Astrophysics Data System (ADS)

    Torgoev, Almaz; Havenith, Hans-Balder

    2016-07-01

    A 2D elasto-dynamic modelling of the pure topographic seismic response is performed for six models with a total length of around 23.0 km. These models are reconstructed from the real topographic settings of the landslide-prone slopes situated in the Mailuu-Suu River Valley, Southern Kyrgyzstan. The main studied parameter is the Arias Intensity (Ia, m/sec), which is applied in the GIS-based Newmark method to regionally map the seismically-induced landslide susceptibility. This method maps the Ia values via empirical attenuation laws and our studies investigate a potential to include topographic input into them. Numerical studies analyse several signals with varying shape and changing central frequency values. All tests demonstrate that the spectral amplification patterns directly affect the amplification of the Ia values. These results let to link the 2D distribution of the topographically amplified Ia values with the parameter called as smoothed curvature. The amplification values for the low-frequency signals are better correlated with the curvature smoothed over larger spatial extent, while those values for the high-frequency signals are more linked to the curvature with smaller smoothing extent. The best predictions are provided by the curvature smoothed over the extent calculated according to Geli's law. The sample equations predicting the Ia amplification based on the smoothed curvature are presented for the sinusoid-shape input signals. These laws cannot be directly implemented in the regional Newmark method, as 3D amplification of the Ia values addresses more problem complexities which are not studied here. Nevertheless, our 2D results prepare the theoretical framework which can potentially be applied to the 3D domain and, therefore, represent a robust basis for these future research targets.

  14. Probabilistic landslide run-out assessment with a 2-D dynamic numerical model using a Monte Carlo method

    NASA Astrophysics Data System (ADS)

    Cepeda, Jose; Luna, Byron Quan; Nadim, Farrokh

    2013-04-01

    An essential component of a quantitative landslide hazard assessment is establishing the extent of the endangered area. This task requires accurate prediction of the run-out behaviour of a landslide, which includes the estimation of the run-out distance, run-out width, velocities, pressures, and depth of the moving mass and the final configuration of the deposits. One approach to run-out modelling is to reproduce accurately the dynamics of the propagation processes. A number of dynamic numerical models are able to compute the movement of the flow over irregular topographic terrains (3-D) controlled by a complex interaction between mechanical properties that may vary in space and time. Given the number of unknown parameters and the fact that most of the rheological parameters cannot be measured in the laboratory or field, the parametrization of run-out models is very difficult in practice. For this reason, the application of run-out models is mostly used for back-analysis of past events and very few studies have attempted to achieve forward predictions. Consequently all models are based on simplified descriptions that attempt to reproduce the general features of the failed mass motion through the use of parameters (mostly controlling shear stresses at the base of the moving mass) which account for aspects not explicitly described or oversimplified. The uncertainties involved in the run-out process have to be approached in a stochastic manner. It is of significant importance to develop methods for quantifying and properly handling the uncertainties in dynamic run-out models, in order to allow a more comprehensive approach to quantitative risk assessment. A method was developed to compute the variation in run-out intensities by using a dynamic run-out model (MassMov2D) and a probabilistic framework based on a Monte Carlo simulation in order to analyze the effect of the uncertainty of input parameters. The probability density functions of the rheological parameters

  15. Numerical simulations of instabilities in the implosion process of inertial confined fusion in 2D cylindrical coordinates

    NASA Astrophysics Data System (ADS)

    Yong, Heng; Zhai, ChuanLei; Jiang, Song; Song, Peng; Dai, ZhenSheng; Gu, JianFa

    2016-01-01

    In this paper, we introduce a multi-material arbitrary Lagrangian and Eulerian method for the hydrodynamic radiative multi-group diffusion model in 2D cylindrical coordinates. The basic idea in the construction of the method is the following: In the Lagrangian step, a closure model of radiation-hydrodynamics is used to give the states of equations for materials in mixed cells. In the mesh rezoning step, we couple the rezoning principle with the Lagrangian interface tracking method and an Eulerian interface capturing scheme to compute interfaces sharply according to their deformation and to keep cells in good geometric quality. In the interface reconstruction step, a dual-material Moment-of-Fluid method is introduced to obtain the unique interface in mixed cells. In the remapping step, a conservative remapping algorithm of conserved quantities is presented. A number of numerical tests are carried out and the numerical results show that the new method can simulate instabilities in complex fluid field under large deformation, and are accurate and robust.

  16. Multipoint studies of 2D magnetotail current sheet

    NASA Astrophysics Data System (ADS)

    Petrukovich, Anatoli; Zelenyi, Lev; Nakamura, Rumi; Artemyev, Anton

    2016-07-01

    CLUSTER and Themis projects provide unique tools for magnetotail current sheet studies at a wide range of downtail distances: multipoint curlometer allows to measure electric current density, whereas regular electron data contains information on largescale tail structure. Observations show that moderately thin ion-scale embedded sheet is formed during substorm growth phase. Comparison of curlometer with particle data helps to estimate contributions of transient and magnetized ions as well as electrons to current density. Thin intense sheet with sub-ion scale is appearing after onset near reconnection zones, but vertical pressure balance requirement substantially limits the possible range of sheet thickness. Horizontal (along the tail) gradients become more important only in the near tail, within 10-12 Earth radii. Essential quantitative characteristics of ions-scale embedded sheet are boundary field b0 and maximal possible intensity of ion current.

  17. First-principles study of 2D electride : Gadolinium carbide

    NASA Astrophysics Data System (ADS)

    Nandadasa, Chandani; Kim, Seong-Gon; Kim, Sungho; Kim, Sung Wng

    Electrides are an exclusive class of ionic compounds in which some electrons are occupying crystal voids instead of attaching to specific atoms or bonds. Using first-principles density functional theory calculations, we study structural, electronic and magnetic properties of Gd2C. The theoretically predicted structure of Gd2C is in good agreement with the available experimental data. Energy band diagram of Gd2C shows that they are crossing the Fermi level. Projected electronic density of states plots indicate that the interstitial sites are the main contributor to the density of states at the Fermi level. Charge of individual atoms including interstitial site are obtained using Bader analysis. Magnetic properties of Gd2C is determined from magnetization density plots. Work functions of Gd2C are determined for (001) and (100) surfaces with the technique of macroscopic average of electrostatic potential with the Fermi energy of bulk.

  18. THE 2D HEISENBERG ANTIFERROMAGNET IN HIGH-Tc SUPERCONDUCTIVITY:. A Review of Numerical Techniques and Results

    NASA Astrophysics Data System (ADS)

    Barnes, T.

    In this article we review numerical studies of the quantum Heisenberg antiferromagnet on a square lattice, which is a model of the magnetic properties of the undoped “precursor insulators” of the high temperature superconductors. We begin with a brief pedagogical introduction and then discuss zero and nonzero temperature properties and compare the numerical results to analytical calculations and to experiment where appropriate. We also review the various algorithms used to obtain these results, and discuss algorithm developments and improvements in computer technology which would be most useful for future numerical work in this area. Finally we list several outstanding problems which may merit further investigation.

  19. Numerical simulations of heavily polluted fine-grained sediment remobilization using 1D, 1D+, and 2D channel schematization.

    PubMed

    Kaiglová, Jana; Langhammer, Jakub; Jiřinec, Petr; Janský, Bohumír; Chalupová, Dagmar

    2015-03-01

    This article used various hydrodynamic and sediment transport models to analyze the potential and the limits of different channel schematizations. The main aim was to select and evaluate the most suitable simulation method for fine-grained sediment remobilization assessment. Three types of channel schematization were selected to study the flow potential for remobilizing fine-grained sediment in artificially modified channels. Schematization with a 1D cross-sectional horizontal plan, a 1D+ approach, splitting the riverbed into different functional zones, and full 2D mesh, adopted in MIKE by the DHI modeling suite, was applied to the study. For the case study, a 55-km stretch of the Bílina River, in the Czech Republic, Central Europe, which has been heavily polluted by the chemical and coal mining industry since the mid-twentieth century, was selected. Long-term exposure to direct emissions of toxic pollutants including heavy metals and persistent organic pollutants (POPs) resulted in deposits of pollutants in fine-grained sediments in the riverbed. Simulations, based on three hydrodynamic model schematizations, proved that for events not exceeding the extent of the riverbed profile, the 1D schematization can provide comparable results to a 2D model. The 1D+ schematization can improve accuracy while keeping the benefits of high-speed simulation and low requirements of input DEM data, but the method's suitability is limited by the channel properties. PMID:25687259

  20. Numerical model of water flow and solute accumulation in vertisols using HYDRUS 2D/3D code

    NASA Astrophysics Data System (ADS)

    Weiss, Tomáš; Dahan, Ofer; Turkeltub, Tuvia

    2015-04-01

    Keywords: dessication-crack-induced-salinization, preferential flow, conceptual model, numerical model, vadose zone, vertisols, soil water retention function, HYDRUS 2D/3D Vertisols cover a hydrologically very significant area of semi-arid regions often through which water infiltrates to groundwater aquifers. Understanding of water flow and solute accumulation is thus very relevant to agricultural activity and water resources management. Previous works suggest a conceptual model of dessication-crack-induced-salinization where salinization of sediment in the deep section of the vadose zone (up to 4 m) is induced by subsurface evaporation due to convective air flow in the dessication cracks. It suggests that the salinization is induced by the hydraulic gradient between the dry sediment in the vicinity of cracks (low potential) and the relatively wet sediment further from the main cracks (high potential). This paper presents a modified previously suggested conceptual model and a numerical model. The model uses a simple uniform flow approach but unconventionally prescribes the boundary conditions and the hydraulic parameters of soil. The numerical model is bound to one location close to a dairy farm waste lagoon, but the application of the suggested conceptual model could be possibly extended to all semi-arid regions with vertisols. Simulations were conducted using several modeling approaches with an ultimate goal of fitting the simulation results to the controlling variables measured in the field: temporal variation in water content across thick layer of unsaturated clay sediment (>10 m), sediment salinity and salinity the water draining down the vadose zone to the water table. The development of the model was engineered in several steps; all computed as forward solutions by try-and-error approach. The model suggests very deep instant infiltration of fresh water up to 12 m, which is also supported by the field data. The paper suggests prescribing a special atmospheric

  1. Numerical analysis and synthesis of 2D quasi-optical reflectors and beam waveguides based on an integral-equation approach with Nystrom's discretization.

    PubMed

    Nosich, Andrey A; Gandel, Yuriy V; Magath, Thore; Altintas, Ayhan

    2007-09-01

    Considered is the beam wave guidance and scattering by 2D quasi-optical reflectors modeling the components of beam waveguides. The incident field is taken as the complex-source-point field to simulate a finite-width beam generated by a small-aperture source. A numerical solution is obtained from the coupled singular integral equations (SIEs) for the surface currents on reflectors, discretized by using the recently introduced Nystrom-type quadrature formulas. This analysis is applied to study what effect the edge illumination has on the performance of a chain of confocal elliptic reflectors. We also develop a semianalytical approach for shaped reflector synthesis after a prescribed near-field pattern. Here a new point is the use of auxiliary SIEs of the same type as in the scattering analysis problem, however, for the gradient of the objective function. Sample results are presented for the synthesis of a reflector-type beam splitter. PMID:17767252

  2. CYP2D6 genotype and adjuvant tamoxifen: meta-analysis of heterogeneous study populations.

    PubMed

    Province, M A; Goetz, M P; Brauch, H; Flockhart, D A; Hebert, J M; Whaley, R; Suman, V J; Schroth, W; Winter, S; Zembutsu, H; Mushiroda, T; Newman, W G; Lee, M-T M; Ambrosone, C B; Beckmann, M W; Choi, J-Y; Dieudonné, A-S; Fasching, P A; Ferraldeschi, R; Gong, L; Haschke-Becher, E; Howell, A; Jordan, L B; Hamann, U; Kiyotani, K; Krippl, P; Lambrechts, D; Latif, A; Langsenlehner, U; Lorizio, W; Neven, P; Nguyen, A T; Park, B-W; Purdie, C A; Quinlan, P; Renner, W; Schmidt, M; Schwab, M; Shin, J-G; Stingl, J C; Wegman, P; Wingren, S; Wu, A H B; Ziv, E; Zirpoli, G; Thompson, A M; Jordan, V C; Nakamura, Y; Altman, R B; Ames, M M; Weinshilboum, R M; Eichelbaum, M; Ingle, J N; Klein, T E

    2014-02-01

    The International Tamoxifen Pharmacogenomics Consortium was established to address the controversy regarding cytochrome P450 2D6 (CYP2D6) status and clinical outcomes in tamoxifen therapy. We performed a meta-analysis on data from 4,973 tamoxifen-treated patients (12 globally distributed sites). Using strict eligibility requirements (postmenopausal women with estrogen receptor-positive breast cancer, receiving 20 mg/day tamoxifen for 5 years, criterion 1); CYP2D6 poor metabolizer status was associated with poorer invasive disease-free survival (IDFS: hazard ratio = 1.25; 95% confidence interval = 1.06, 1.47; P = 0.009). However, CYP2D6 status was not statistically significant when tamoxifen duration, menopausal status, and annual follow-up were not specified (criterion 2, n = 2,443; P = 0.25) or when no exclusions were applied (criterion 3, n = 4,935; P = 0.38). Although CYP2D6 is a strong predictor of IDFS using strict inclusion criteria, because the results are not robust to inclusion criteria (these were not defined a priori), prospective studies are necessary to fully establish the value of CYP2D6 genotyping in tamoxifen therapy. PMID:24060820

  3. Floodplain mapping via 1D and quasi-2D numerical models in the valley of Thessaly, Greece

    NASA Astrophysics Data System (ADS)

    Oikonomou, Athanasios; Dimitriadis, Panayiotis; Koukouvinos, Antonis; Tegos, Aristoteles; Pagana, Vasiliki; Panagopoulos, Panayiotis-Dionisios; Mamassis, Nikolaos; Koutsoyiannis, Demetris

    2013-04-01

    The European Union Floods Directive defines a flood as 'a covering by water of land not normally covered by water'. Human activities, such as agriculture, urban development, industry and tourism, contribute to an increase in the likelihood and adverse impacts of flood events. The study of the hydraulic behaviour of a river is important in flood risk management. Here, we investigate the behaviour of three hydraulic models, with different theoretical frameworks, in a real case scenario. The area is located in the Penios river basin, in the plain of Thessaly (Greece). The three models used are the one-dimensional HEC-RAS and the quasi two-dimensional LISFLOOD-FP and FLO-2D which are compared to each other, in terms of simulated maximum water depth as well as maximum flow velocity, and to a real flood event. Moreover, a sensitivity analysis is performed to determine how each simulation is affected by the river and floodplain roughness coefficient, in terms of flood inundation.

  4. Estimating elastic moduli of rocks from thin sections: Digital rock study of 3D properties from 2D images

    NASA Astrophysics Data System (ADS)

    Saxena, Nishank; Mavko, Gary

    2016-03-01

    Estimation of elastic rock moduli using 2D plane strain computations from thin sections has several numerical and analytical advantages over using 3D rock images, including faster computation, smaller memory requirements, and the availability of cheap thin sections. These advantages, however, must be weighed against the estimation accuracy of 3D rock properties from thin sections. We present a new method for predicting elastic properties of natural rocks using thin sections. Our method is based on a simple power-law transform that correlates computed 2D thin section moduli and the corresponding 3D rock moduli. The validity of this transform is established using a dataset comprised of FEM-computed elastic moduli of rock samples from various geologic formations, including Fontainebleau sandstone, Berea sandstone, Bituminous sand, and Grossmont carbonate. We note that using the power-law transform with a power-law coefficient between 0.4-0.6 contains 2D moduli to 3D moduli transformations for all rocks that are considered in this study. We also find that reliable estimates of P-wave (Vp) and S-wave velocity (Vs) trends can be obtained using 2D thin sections.

  5. Comparison of 2D versus 3D mammography with screening cases: an observer study

    NASA Astrophysics Data System (ADS)

    Fernandez, James Reza; Deshpande, Ruchi; Hovanessian-Larsen, Linda; Liu, Brent

    2012-02-01

    Breast cancer is the most common type of non-skin cancer in women. 2D mammography is a screening tool to aid in the early detection of breast cancer, but has diagnostic limitations of overlapping tissues, especially in dense breasts. 3D mammography has the potential to improve detection outcomes by increasing specificity, and a new 3D screening tool with a 3D display for mammography aims to improve performance and efficiency as compared to 2D mammography. An observer study using human studies collected from was performed to compare traditional 2D mammography with this new 3D mammography technique. A prior study using a mammography phantom revealed no difference in calcification detection, but improved mass detection in 2D as compared to 3D. There was a significant decrease in reading time for masses, calcifications, and normals in 3D compared to 2D, however, as well as more favorable confidence levels in reading normal cases. Data for this current study is currently being obtained, and a full report should be available in the next few weeks.

  6. Numerical Studies of Topological phases

    NASA Astrophysics Data System (ADS)

    Geraedts, Scott

    The topological phases of matter have been a major part of condensed matter physics research since the discovery of the quantum Hall effect in the 1980s. Recently, much of this research has focused on the study of systems of free fermions, such as the integer quantum Hall effect, quantum spin Hall effect, and topological insulator. Though these free fermion systems can play host to a variety of interesting phenomena, the physics of interacting topological phases is even richer. Unfortunately, there is a shortage of theoretical tools that can be used to approach interacting problems. In this thesis I will discuss progress in using two different numerical techniques to study topological phases. Recently much research in topological phases has focused on phases made up of bosons. Unlike fermions, free bosons form a condensate and so interactions are vital if the bosons are to realize a topological phase. Since these phases are difficult to study, much of our understanding comes from exactly solvable models, such as Kitaev's toric code, as well as Levin-Wen and Walker-Wang models. We may want to study systems for which such exactly solvable models are not available. In this thesis I present a series of models which are not solvable exactly, but which can be studied in sign-free Monte Carlo simulations. The models work by binding charges to point topological defects. They can be used to realize bosonic interacting versions of the quantum Hall effect in 2D and topological insulator in 3D. Effective field theories of ''integer'' (non-fractionalized) versions of these phases were available in the literature, but our models also allow for the construction of fractional phases. We can measure a number of properties of the bulk and surface of these phases. Few interacting topological phases have been realized experimentally, but there is one very important exception: the fractional quantum Hall effect (FQHE). Though the fractional quantum Hall effect we discovered over 30

  7. The Effects of Far-Field Boundary Conditions on 2D Numerical Solutions for Continental Rifting: Tests and Recipes for Improved Treatment of Asthenosphere Flow and Melting

    NASA Astrophysics Data System (ADS)

    Morgan, J. P.; de Monserrat, A.; Hall, R.; Taramon, J. M.; Perez-Gussinye, M.

    2015-12-01

    This work focuses on improving current 2D numerical approaches to modeling the boundary conditions associated with computing accurate deformation and melting associated with continental rifting. Recent models primarily use far-field boundary conditions that have been used for decades with little assessment of their effects on asthenospheric flow beneath the rifting region. All are clearly extremely oversimplified — Huismans and Buiter assume there is no vertical flow into the rifting region, with the asthenosphere flowing uniformly into the rifting region from the sides beneath lithosphere moving in the opposing direction, Armitage et al. and van Wijk use divergent velocities on the upper boundary to impose break-up within a Cartesian box, while other studies generally assume there is uniform horizontal flow away from the center of rifting, with uniform vertical flow replenishing the material pulled out of the sides of the computational region. All are likely to significantly shape the pattern of asthenospheric flow beneath the stretching lithosphere that is associated with pressure-release melting and rift volcanism. Thus while ALL may lead to similar predictions of the effects of crustal stretching and thinning, NONE may lead to accurate determination of the the asthenospheric flow and melting associated with lithospheric stretching and breakup. Here we discuss a suite of numerical experiments that compare these choices to likely more realistic boundary condition choices like the analytical solution for flow associated with two diverging plates stretching over a finite-width region, and a high-resolution 2-D region embedded within a cylindrical annulus 'whole mantle cross-section' at 5% extra numerical problem size. Our initial results imply that the choice of far-field boundary conditions does indeed significantly influence predicted melting distributions and melt volumes associated with continental breakup. For calculations including asthenospheric melting

  8. 2D Numerical Investigation of the Laminar and Turbulent Flow Over Different Airfoils Using OpenFOAM

    NASA Astrophysics Data System (ADS)

    Rahimi, H.; Medjroubi, W.; Stoevesandt, B.; Peinke, J.

    2014-12-01

    The aim of this work is to assess the prediction capabilities of the turbulence models and the transition model kkl-ω available in OpenFOAM and to achieve a database of airfoil aerodynamical characteristics. The airfoils chosen for the simulations are FX 79-W- 15A and NACA 63-430, which are widely used in wind turbines. The numerically obtained lift and drag coefficients are compared with available experimental results. A quantitative and qualitative study is conducted to determine the influence of meshing strategies, computational time step together with interpolation and temporal schemes. Two Reynolds Averaged Navier- Stokes models (RANS models) are used, which are the k-ω SST model by Menter and the kkl-ω model (which involves transition modeling) by Walters and Davor.

  9. Experimental and numerical investigation of DNAPL infiltration and spreading in a 2-D sandbox by means of light transmission method

    NASA Astrophysics Data System (ADS)

    Zheng, F.; Shi, X.; Wu, J.; Gao, Y. W.

    2013-12-01

    Chlorinated solvents such as trichloroethene (TCE) and tetrachloroethene (PCE) are widespread groundwater contaminants often referred to as dense non-aqueous phase liquids (DNAPLs). Accuracy description of the spreading behavior and configuration for subsurface DNAPL migration is important, especially favourable for design effective remediation strategies. In this study, a 2-D experiment was conducted to investigate the infiltration behavior and spatial distribution of PCE in saturated porous media. Accusand 20/30 mesh sand (Unimin, Le Sueur, MN) was used as the background medium with two 70/80 and 60/70 mesh lenses embedded to simulate heterogeneous conditions. Dyed PCE of 100 ml was released into the flow cell at a constant rate of 2ml/min using a Harvard Apparatus syringe pump with a 50 ml glass syringe for two times, and 5 ml/min water was continuously injected through the inlet at the left side of the sandbox, while kept the same effluent rate at right side to create hydrodynamic condition. A light transmission (LT) system was used to record the migration of PCE and determine the saturation distribution of PCE in the sandbox experiment with a thermoelectrically air-cooled charged-coupled device (CCD) camera. All images were processed using MATLAB to calculate thickness-averaged PCE saturation for each pixel. Mass balance was checked through comparing injected known mounts of PCE with that calculated from LT analysis. Results showed that LT method is effective to delineate PCE migration pathways and quantify the saturation distribution. The relative errors of total PCE volumes calculated by LT analysis at different times were within 15% of the injected PCE volumes. The simulation are conducted using the multiphase modeling software T2VOC, which calibrated by the LT analysis results of three recorded time steps to fit with the complete spatial-temporal distribution of the PCE saturation. Model verification was then performed using the other eight recorded time

  10. Advanced Tsunami Numerical Simulations and Energy Considerations by use of 3D-2D Coupled Models: The October 11, 1918, Mona Passage Tsunami

    NASA Astrophysics Data System (ADS)

    López-Venegas, Alberto M.; Horrillo, Juan; Pampell-Manis, Alyssa; Huérfano, Victor; Mercado, Aurelio

    2015-06-01

    The most recent tsunami observed along the coast of the island of Puerto Rico occurred on October 11, 1918, after a magnitude 7.2 earthquake in the Mona Passage. The earthquake was responsible for initiating a tsunami that mostly affected the northwestern coast of the island. Runup values from a post-tsunami survey indicated the waves reached up to 6 m. A controversy regarding the source of the tsunami has resulted in several numerical simulations involving either fault rupture or a submarine landslide as the most probable cause of the tsunami. Here we follow up on previous simulations of the tsunami from a submarine landslide source off the western coast of Puerto Rico as initiated by the earthquake. Improvements on our previous study include: (1) higher-resolution bathymetry; (2) a 3D-2D coupled numerical model specifically developed for the tsunami; (3) use of the non-hydrostatic numerical model NEOWAVE (non-hydrostatic evolution of ocean WAVE) featuring two-way nesting capabilities; and (4) comprehensive energy analysis to determine the time of full tsunami wave development. The three-dimensional Navier-Stokes model tsunami solution using the Navier-Stokes algorithm with multiple interfaces for two fluids (water and landslide) was used to determine the initial wave characteristic generated by the submarine landslide. Use of NEOWAVE enabled us to solve for coastal inundation, wave propagation, and detailed runup. Our results were in agreement with previous work in which a submarine landslide is favored as the most probable source of the tsunami, and improvement in the resolution of the bathymetry yielded inundation of the coastal areas that compare well with values from a post-tsunami survey. Our unique energy analysis indicates that most of the wave energy is isolated in the wave generation region, particularly at depths near the landslide, and once the initial wave propagates from the generation region its energy begins to stabilize.

  11. A Convective Vorticity Vector Associated With Tropical Convection: A 2D Cloud-Resolving Modeling Study

    NASA Technical Reports Server (NTRS)

    Gao, Shou-Ting; Ping, Fan; Li, Xiao-Fan; Tao, Wei-Kuo

    2004-01-01

    Although dry/moist potential vorticity is a useful physical quantity for meteorological analysis, it cannot be applied to the analysis of 2D simulations. A convective vorticity vector (CVV) is introduced in this study to analyze 2D cloud-resolving simulation data associated with 2D tropical convection. The cloud model is forced by the vertical velocity, zonal wind, horizontal advection, and sea surface temperature obtained from the TOGA COARE, and is integrated for a selected 10-day period. The CVV has zonal and vertical components in the 2D x-z frame. Analysis of zonally-averaged and mass-integrated quantities shows that the correlation coefficient between the vertical component of the CVV and the sum of the cloud hydrometeor mixing ratios is 0.81, whereas the correlation coefficient between the zonal component and the sum of the mixing ratios is only 0.18. This indicates that the vertical component of the CVV is closely associated with tropical convection. The tendency equation for the vertical component of the CVV is derived and the zonally-averaged and mass-integrated tendency budgets are analyzed. The tendency of the vertical component of the CVV is determined by the interaction between the vorticity and the zonal gradient of cloud heating. The results demonstrate that the vertical component of the CVV is a cloud-linked parameter and can be used to study tropical convection.

  12. Melt-rock reaction in the asthenospheric mantle: Perspectives from high-order accurate numerical simulations in 2D and 3D

    NASA Astrophysics Data System (ADS)

    Tirupathi, S.; Schiemenz, A. R.; Liang, Y.; Parmentier, E.; Hesthaven, J.

    2013-12-01

    The style and mode of melt migration in the mantle are important to the interpretation of basalts erupted on the surface. Both grain-scale diffuse porous flow and channelized melt migration have been proposed. To better understand the mechanisms and consequences of melt migration in a heterogeneous mantle, we have undertaken a numerical study of reactive dissolution in an upwelling and viscously deformable mantle where solubility of pyroxene increases upwards. Our setup is similar to that described in [1], except we use a larger domain size in 2D and 3D and a new numerical method. To enable efficient simulations in 3D through parallel computing, we developed a high-order accurate numerical method for the magma dynamics problem using discontinuous Galerkin methods and constructed the problem using the numerical library deal.II [2]. Linear stability analyses of the reactive dissolution problem reveal three dynamically distinct regimes [3] and the simulations reported in this study were run in the stable regime and the unstable wave regime where small perturbations in porosity grows periodically. The wave regime is more relevant to melt migration beneath the mid-ocean ridges but computationally more challenging. Extending the 2D simulations in the stable regime in [1] to 3D using various combinations of sustained perturbations in porosity at the base of the upwelling column (which may result from a viened mantle), we show the geometry and distribution of dunite channel and high-porosity melt channels are highly correlated with inflow perturbation through superposition. Strong nonlinear interactions among compaction, dissolution, and upwelling give rise to porosity waves and high-porosity melt channels in the wave regime. These compaction-dissolution waves have well organized but time-dependent structures in the lower part of the simulation domain. High-porosity melt channels nucleate along nodal lines of the porosity waves, growing downwards. The wavelength scales

  13. Studies of a suitable mask error enhancement factor for 2D patterns

    NASA Astrophysics Data System (ADS)

    Wei, Chih I.; Cheng, Yung Feng; Chen, Ming Jui

    2013-04-01

    In advanced 20nm and below technology nodes, the mask enhanced error factor (MEEF) plays an important rule due to the request of stable process control and quality of mask manufacture. It provides us an effective parameter to analyze the process window for lithography. In advanced nodes, MEEF criterion becomes more important than previous nodes because very tight process tolerance is requested, especially in OPC and mask capability control. Therefore, we have to do further studies on this topic. In the simple line/trench design layers (for example: Active and poly), the MEEF is easy to be defined because mask bias is isotropic. However, in the complicated two-dimensional (2D) design layers (for example: Contact and Mvia), they are hard to be defined a suitable definition of MEEF. In the first part, we used the global bias to calculate the MEEF on all patterns. It makes calculation easier to compare with other patterns which are different shapes. However, when we inspected the 2D line-end patterns on the wafer, we found the significant differences between the MEEF of wafer data and aerial simulation. In order to clarify this issue, we perform series simulation studies of the line-end MEEF. Then we knew that it came from the different bias strategies. Furthermore, the simulation studies show that the line-end MEEF of non-preferable orientation is very sensitive to mask X/Y ratio bias due to strong OAI optical behavior by the SMO source. As a result, a new point of view of 2D MEEF is suggested according to physical mask CD error measurement data. In this study, we would find a better description of the MEEF than traditional one for lithographic process development on 2D region.

  14. Interaction of water molecules with hexagonal 2D systems. A DFT study

    NASA Astrophysics Data System (ADS)

    Rojas, Ángela; Rey, Rafael

    Over the years water sources have been contaminated with many chemical agents, becoming issues that affect health of the world population. The advances of the nanoscience and nanotechnology in the development new materials constitute an alternative for design molecular filters with great efficiencies and low cost for water treatment and purification. In the nanoscale, the process of filtration or separation of inorganic and organic pollutants from water requires to study interactions of these atoms or molecules with different nano-materials. Specifically, it is necessary to understand the role of these interactions in physical and chemical properties of the nano-materials. In this work, the main interest is to do a theoretical study of interaction between water molecules and 2D graphene-like systems, such as silicene (h-Si) or germanene (h-Ge). Using Density Functional Theory we calculate total energy curves as function of separation between of water molecules and 2D systems. Different spatial configurations of water molecules relative to 2D systems are considered. Structural relaxation effects and changes of electronic charge density also are reported. Universidad Nacional de Colombia.

  15. Protein Dynamics Studied with Ultrafast 2D IR Vibrational Echo Spectroscopy

    PubMed Central

    THIELGES, MEGAN C.; FAYER, MICHAEL D.

    2012-01-01

    CONSPECTUS Proteins, enzymes, and other biological molecules undergo structural dynamics as an intrinsic part of their biological functions. While many biological processes occur on the millisecond, second, and even longer time scales, the fundamental structural dynamics that eventually give rise to such processes occur on much faster time scales. Many decades ago, chemical kineticists focused on the inverse of the reaction rate constant as the important time scale for a chemical reaction. However, through transition state theory and a vast amount of experimental evidence, we now know that the key events in a chemical reaction can involve structural fluctuations that take a system of reactants to its transitions state, the crossing of a barrier, and the eventual relaxation to product states. Such dynamics occur on very fast time scales. Today researchers would like to investigate the fast structural fluctuations of biological molecules to gain an understanding of how biological processes proceed from simple structural changes in biomolecules to the final, complex biological function. The study of the fast structural dynamics of biological molecules requires experiments that operate on the appropriate time scales, and in this Account, we discuss the application of ultrafast two-dimensional infrared (2D IR) vibrational echo spectroscopy to the study of dynamics. The 2D IR vibrational echo experiment is akin to 2D NMR, but it operates on time scales many orders of magnitude faster. In the experiments, a particular vibrational oscillator serves as a vibrational dynamics probe. As the structure of the protein evolves in time, the structural changes are manifested as time dependent changes in the frequency of the vibrational dynamics probe. The 2D IR vibrational echo experiments can track the vibrational frequency evolution, which we then relate to the time evolution of the protein structure. In particular, we measured protein substate interconversion for mutants of

  16. Comparison of 2D and 3D Numerical Models with Experiments of Tsunami Flow through a Built Environment

    NASA Astrophysics Data System (ADS)

    LeVeque, R. J.; Motley, M. R.

    2015-12-01

    A series of tsunami wave basin experiments of flow through a scale model of Seaside, Oregon have been used as validation data for a 2015 benchmarking workshop hosted by the National Tsunami Mitigation Program, which focused on better understanding the ability of tsunami models to predict flow velocities and inundation depths following a coastal inundation event. As researchers begin to assess the safety of coastal infrastructures, proper assessment of tsunami-induced forces on coastal structures is critical. Hydrodynamic forces on these structures are fundamentally proportional to the local momentum flux of the fluid, and experimental data included momentum flux measurements at many instrumented gauge locations. The GeoClaw tsunami model, which solves the two-dimensional shallow water equations, was compared against other codes during the benchmarking workshop, and more recently a three-dimensional computational fluid dynamics model using the open-source OpenFOAM software has been developed and results from this model are being compared with both the experimental data and the 2D GeoClaw results. In addition, the 3D model allows for computation of fluid forces on the faces of structures, permitting an investigation of the common use of momentum flux as a proxy for these forces. This work aims to assess the potential to apply these momentum flux predictions locally within the model to determine tsunami-induced forces on critical structures. Difficulties in working with these data sets and cross-model comparisons will be discussed. Ultimately, application of the more computationally efficient GeoClaw model, informed by the 3D OpenFOAM models, to predict forces on structures at the community scale can be expected to improve the safety and resilience of coastal communities.

  17. Modelling river bank erosion using a 2D depth-averaged numerical model of flow and non-cohesive, non-uniform sediment transport

    NASA Astrophysics Data System (ADS)

    El Kadi Abderrezzak, Kamal; Die Moran, Andrés; Tassi, Pablo; Ata, Riadh; Hervouet, Jean-Michel

    2016-07-01

    Bank erosion can be an important form of morphological adjustment in rivers. With the advances made in computational techniques, two-dimensional (2D) depth-averaged numerical models have become valuable tools for resolving many engineering problems dealing with sediment transport. The objective of this research work is to present a simple, new, bank-erosion operator that is integrated into a 2D Saint-Venant-Exner morphodynamic model. The numerical code is based on an unstructured grid of triangular elements and finite-element algorithms. The slope of each element in the grid is compared to the angle of repose of the bank material. Elements for which the slope is too steep are tilted to bring them to the angle of repose along a horizontal axis defined such that the volume loss above the axis is equal to the volume gain below, thus ensuring mass balance. The model performance is assessed using data from laboratory flume experiments and a scale model of the Old Rhine. For the flume experiment case with uniform bank material, relevant results are obtained for bank geometry changes. For the more challenging case (i.e. scale model of the Old Rhine with non-uniform bank material), the numerical model is capable of reproducing the main features of the bank failure, induced by the newly designed groynes, as well as the transport of the mobilized sediment material downstream. Some deviations between the computed results and measured data are, however, observed. They are ascribed to the effects of three-dimensional (3D) flow structures, pore pressure and cohesion, which are not considered in the present 2D model.

  18. Numerical investigation of ultrasonic attenuation through 2D trabecular bone structures reconstructed from CT scans and random realizations.

    PubMed

    Gilbert, Robert P; Guyenne, Philippe; Li, Jing

    2014-02-01

    In this paper, we compare ultrasound interrogations of actual CT-scanned images of trabecular bone with artificial randomly constructed bone. Even though it is known that actual bone does not have randomly distributed trabeculae, we find that the ultrasound attenuations are close enough to cast doubt on any microstructural information, such as trabeculae width and distance between trabeculae, being gleaned from such experiments. More precisely, we perform numerical simulations of ultrasound interrogation on cancellous bone to investigate the phenomenon of ultrasound attenuation as a function of excitation frequency and bone porosity. The theoretical model is based on acoustic propagation equations for a composite fluid-solid material and is solved by a staggered-grid finite-difference scheme in the time domain. Numerical experiments are performed on two-dimensional bone samples reconstructed from CT-scanned images of real human calcaneus and from random distributions of fluid-solid particles generated via the turning bands method. A detailed comparison is performed on various parameters such as the attenuation rate and speed of sound through the bone samples as well as the normalized broadband ultrasound attenuation coefficient. Comparing results from these two types of bone samples allows us to assess the role of bone microstructure in ultrasound attenuation. It is found that the random model provides suitable bone samples for ultrasound interrogation in the transverse direction of the trabecular network. PMID:24480174

  19. Multipacting Simulation Study for 56 MHz Quarter Wave Resonator using 2D Code

    SciTech Connect

    Naik,D.; Ben-Zvi, I.

    2009-01-02

    A beam excited 56 MHz Radio Frequency (RF) Niobium Quarter Wave Resonator (QWR) has been proposed to enhance RHIC beam luminosity and bunching. Being a RF cavity, multipacting is expected; therefore an extensive study was carried out with the Multipac 2.1 2D simulation code. The study revealed that multipacting occurs in various bands up to peak surface electric field 50 kV/m and is concentrated mostly above the beam gap and on the outer conductor. To suppress multipacting, a ripple structure was introduced to the outer conductor and the phenomenon was successfully eliminated from the cavity.

  20. 2D and 3D-QSAR studies on antiproliferative thiazolidine analogs

    NASA Astrophysics Data System (ADS)

    Liao, Si Yan; Qian, Li; Chen, Jin Can; Lu, Hai Liang; Zheng, Kang Cheng

    Two-dimensional (2D) and three-dimensional (3D) quantitative structure-activity relationships (QSARs) of 22 thiazolidine analogs with antiproliferative activity expressed as pIC50, which is defined as the negative value of the logarithm of necessary molar concentration of these compounds to cause 50% growth inhibition against melanoma cell lines WM-164, have been studied by using a combined method of the DFT, MM2 and statistics for 2D, as well as the comparative molecular field analysis (CoMFA) method for 3D. The established 2D-QSAR model in training set comprised of random 18 compounds shows not only significant statistical quality, but also predictive ability, with the square of adjusted correlation coefficient (R2A = 0.832) and the square of the cross-validation coefficient (q2 = 0.803). The same model was further applied to predict pIC50 values of the four compounds in the test set, and the resulting R2pred reaching 0.784, further confirms that this 2D-QSAR model has high predictive ability. The 3D-QSAR model also shows good correlative and predictive capabilities in terms of R2 (0.956) and q2 (0.615) obtained from CoMFA model. Further, the robustness of the CoMFA model was verified by bootstrapping analysis (100 runs) with R2bs (0.979) and SDbs (0.056). It is very interesting to find that the results from 2D- and 3D-QSAR analyses accord with each other, and they all show that the steric interaction plays a crucial role in determining the cytotoxicities of the compounds, and that selecting a moderate-size or appropriate-hydrophobicity substituent R as well as increasing the negative charges of C4 on phenyl ring at the same time are advantageous to improving the cytotoxicity. Such results can offer some useful theoretical references for directing the molecular design and understanding the action mechanism of this kind of compound with antiproliferative activity.

  1. Numerical simulations - Some results for the 2- and 3-D Hubbard models and a 2-D electron phonon model

    NASA Technical Reports Server (NTRS)

    Scalapino, D. J.; Sugar, R. L.; White, S. R.; Bickers, N. E.; Scalettar, R. T.

    1989-01-01

    Numerical simulations on the half-filled three-dimensional Hubbard model clearly show the onset of Neel order. Simulations of the two-dimensional electron-phonon Holstein model show the competition between the formation of a Peierls-CDW state and a superconducting state. However, the behavior of the partly filled two-dimensional Hubbard model is more difficult to determine. At half-filling, the antiferromagnetic correlations grow as T is reduced. Doping away from half-filling suppresses these correlations, and it is found that there is a weak attractive pairing interaction in the d-wave channel. However, the strength of the pair field susceptibility is weak at the temperatures and lattice sizes that have been simulated, and the nature of the low-temperature state of the nearly half-filled Hubbard model remains open.

  2. Positron-annihilation 2D-ACAR studies of disordered and defected alloys

    SciTech Connect

    Bansil, A.; Prasad, R.; Smedskjaer, L.C.; Benedek, R.; Mijnarends, P.E.

    1987-09-01

    Theoretical and experimental progess in connection with 2D-ACAR positron annihilation studies of ordered, disordered, and defected alloys is discussed. We present, in particular, some of the recent developments concerning the electronic structure of disordered alloys, and the work in the area of annihilation from positrons trapped at vacancy-type defects in metals and alloys. The electronic structure and properties of a number of compounds are also discussed briefly; we comment specifically on high T/sub c/ ceramic superconductors, Heusler alloys, and transition-metal aluminides. 58 refs., 116 figs.

  3. Broadband microwave study of 2D superconductor-insulator quantum phase transition

    NASA Astrophysics Data System (ADS)

    Liu, Wei; Pan, Lidong; Kim, Minsoo; Ganapathy, Sambandamurthy; Armitage, Peter

    2012-02-01

    Using our broadband microwave spectrometer, we investigate the complex AC conductance of disordered InOx films as a function of magnetic field through the 2D superconductor-insulator quantum phase transition. We have studied the behaviors of the frequency dependent complex response function of a particular InOx sample near the critical point in the limit of φ< K BT and φ> K BT and compare our results to theoretical models. We discuss the possibility for a novel insulating state on the insulating side of the transition through the frequency dependent conductance.

  4. A broadband microwave study of the superconducting fluctuations in 2D InOx thin films

    NASA Astrophysics Data System (ADS)

    Liu, Wei; Kim, Minsoo; Wu, Tailung; Ganapathy, Sambandamurthy; Armitage, Peter

    2009-03-01

    We apply a broadband microwave `Corbino' spectrometer covering the range from 10MHz to 20GHz to the study of 2D disordered superconducting InOx thin films. Explicit frequency dependency of the superfluid stiffness and conductivity are obtained down to 270mK. The AC measurements are sensitive to different time scales of the superconducting fluctuations. A number of fluctuation regimes are investigated (gaussian fluctuations, vortex proliferation) as we cool the sample into the low-temperature Kosterlitz-Thouless-Berezinskii- like phase. We discuss our results in terms of prevailing scenarios for fluctuation superconductivity and make connection to other experimental results.

  5. A New Cell-Centered Implicit Numerical Scheme for Ions in the 2-D Axisymmetric Code Hall2de

    NASA Technical Reports Server (NTRS)

    Lopez Ortega, Alejandro; Mikellides, Ioannis G.

    2014-01-01

    We present a new algorithm in the Hall2De code to simulate the ion hydrodynamics in the acceleration channel and near plume regions of Hall-effect thrusters. This implementation constitutes an upgrade of the capabilities built in the Hall2De code. The equations of mass conservation and momentum for unmagnetized ions are solved using a conservative, finite-volume, cell-centered scheme on a magnetic-field-aligned grid. Major computational savings are achieved by making use of an implicit predictor/multi-corrector algorithm for time evolution. Inaccuracies in the prediction of the motion of low-energy ions in the near plume in hydrodynamics approaches are addressed by implementing a multi-fluid algorithm that tracks ions of different energies separately. A wide range of comparisons with measurements are performed to validate the new ion algorithms. Several numerical experiments with the location and value of the anomalous collision frequency are also presented. Differences in the plasma properties in the near-plume between the single fluid and multi-fluid approaches are discussed. We complete our validation by comparing predicted erosion rates at the channel walls of the thruster with measurements. Erosion rates predicted by the plasma properties obtained from simulations replicate accurately measured rates of erosion within the uncertainty range of the sputtering models employed.

  6. Investigation of capillary nanosecond discharges in air at moderate pressure: comparison of experiments and 2D numerical modelling

    NASA Astrophysics Data System (ADS)

    Klochko, Andrei V.; Starikovskaia, Svetlana M.; Xiong, Zhongmin; Kushner, Mark J.

    2014-09-01

    Nanosecond electrical discharges in the form of ionization waves are of interest for rapidly ionizing and exciting complex gas mixtures to initiate chemical reactions. Operating with a small discharge tube diameter can significantly increase the specific energy deposition and so enable optimization of the initiation process. Analysis of the uniformity of energy release in small diameter capillary tubes will aid in this optimization. In this paper, results for the experimentally derived characteristics of nanosecond capillary discharges in air at moderate pressure are presented and compared with results from a two-dimensional model. The quartz capillary tube, having inner and outer diameters of 1.5 and 3.4 mm, is about 80 mm long and filled with synthetic dry air at 27 mbar. The capillary tube with two electrodes at the ends is inserted into a break of the central wire of a long coaxial cable. A metal screen around the tube is connected to the cable ground shield. The discharge is driven by a 19 kV 35 ns voltage pulse applied to the powered electrode. The experimental measurements are conducted primarily by using a calibrated capacitive probe and back current shunts. The numerical modelling focuses on the fast ionization wave (FIW) and the plasma properties in the immediate afterglow after the conductive plasma channel has been established between the two electrodes. The FIW produces a highly focused region of electric field on the tube axis that sustains the ionization wave that eventually bridges the electrode gap. Results from the model predict FIW propagation speed and current rise time that agree with the experiment.

  7. Studying the Polarization Switching in Polycrystalline BiFeO3 Films by 2D Piezoresponse Force Microscopy.

    PubMed

    Jin, Yaming; Lu, Xiaomei; Zhang, Junting; Kan, Yi; Bo, Huifeng; Huang, Fengzhen; Xu, Tingting; Du, Yingchao; Xiao, Shuyu; Zhu, Jinsong

    2015-01-01

    For rhombohedral multiferroelectrics, non-180° ferroelectric domain switching may induce ferroelastic and/or (anti-)ferromagnetic effect. So the determination and control of ferroelectric domain switching angles is crucial for nonvolatile information storage and exchange-coupled magnetoelectric devices. We try to study the intrinsic characters of polarization switching in BiFeO3 by introducing a special data processing method to determine the switching angle from 2D PFM (Piezoresponse Force Microscopy) images of randomly oriented samples. The response surface of BiFeO3 is first plotted using the piezoelectric tensor got from first principles calculations. Then from the normalized 2D PFM signals before and after switching, the switching angles of randomly oriented BiFeO3 grains can be determined through numerical calculations. In the polycrystalline BiFeO3 films, up to 34% of all switched area is that with original out-of-plane (OP) polarization parallel to the poling field. 71° polarization switching is more favorable, with the area percentages of 71°, 109° and 180° domain switching being about 42%, 29% and 29%, respectively. Our analysis further reveals that IP stress and charge migration have comparable effect on switching, and they are sensitive to the geometric arrangements. This work helps exploring a route to control polarization switching in BiFeO3, so as to realize desirable magnetoelectric coupling. PMID:26192555

  8. Studying the Polarization Switching in Polycrystalline BiFeO3 Films by 2D Piezoresponse Force Microscopy

    NASA Astrophysics Data System (ADS)

    Jin, Yaming; Lu, Xiaomei; Zhang, Junting; Kan, Yi; Bo, Huifeng; Huang, Fengzhen; Xu, Tingting; Du, Yingchao; Xiao, Shuyu; Zhu, Jinsong

    2015-07-01

    For rhombohedral multiferroelectrics, non-180° ferroelectric domain switching may induce ferroelastic and/or (anti-)ferromagnetic effect. So the determination and control of ferroelectric domain switching angles is crucial for nonvolatile information storage and exchange-coupled magnetoelectric devices. We try to study the intrinsic characters of polarization switching in BiFeO3 by introducing a special data processing method to determine the switching angle from 2D PFM (Piezoresponse Force Microscopy) images of randomly oriented samples. The response surface of BiFeO3 is first plotted using the piezoelectric tensor got from first principles calculations. Then from the normalized 2D PFM signals before and after switching, the switching angles of randomly oriented BiFeO3 grains can be determined through numerical calculations. In the polycrystalline BiFeO3 films, up to 34% of all switched area is that with original out-of-plane (OP) polarization parallel to the poling field. 71° polarization switching is more favorable, with the area percentages of 71°, 109° and 180° domain switching being about 42%, 29% and 29%, respectively. Our analysis further reveals that IP stress and charge migration have comparable effect on switching, and they are sensitive to the geometric arrangements. This work helps exploring a route to control polarization switching in BiFeO3, so as to realize desirable magnetoelectric coupling.

  9. Studying the Polarization Switching in Polycrystalline BiFeO3 Films by 2D Piezoresponse Force Microscopy

    PubMed Central

    Jin, Yaming; Lu, Xiaomei; Zhang, Junting; Kan, Yi; Bo, Huifeng; Huang, Fengzhen; Xu, Tingting; Du, Yingchao; Xiao, Shuyu; Zhu, Jinsong

    2015-01-01

    For rhombohedral multiferroelectrics, non-180° ferroelectric domain switching may induce ferroelastic and/or (anti-)ferromagnetic effect. So the determination and control of ferroelectric domain switching angles is crucial for nonvolatile information storage and exchange-coupled magnetoelectric devices. We try to study the intrinsic characters of polarization switching in BiFeO3 by introducing a special data processing method to determine the switching angle from 2D PFM (Piezoresponse Force Microscopy) images of randomly oriented samples. The response surface of BiFeO3 is first plotted using the piezoelectric tensor got from first principles calculations. Then from the normalized 2D PFM signals before and after switching, the switching angles of randomly oriented BiFeO3 grains can be determined through numerical calculations. In the polycrystalline BiFeO3 films, up to 34% of all switched area is that with original out-of-plane (OP) polarization parallel to the poling field. 71° polarization switching is more favorable, with the area percentages of 71°, 109° and 180° domain switching being about 42%, 29% and 29%, respectively. Our analysis further reveals that IP stress and charge migration have comparable effect on switching, and they are sensitive to the geometric arrangements. This work helps exploring a route to control polarization switching in BiFeO3, so as to realize desirable magnetoelectric coupling. PMID:26192555

  10. 1D and 2D NMR studies of isobornyl acrylate - Methyl methacrylate copolymers

    NASA Astrophysics Data System (ADS)

    Khandelwal, Deepika; Hooda, Sunita; Brar, A. S.; Shankar, Ravi

    2011-10-01

    Isobornyl acrylate - methyl methacrylate (B/M) copolymers of different compositions were synthesized by atom transfer radical polymerization (ATRP) using methyl-2-bromopropionate as an initiator and PMDETA copper complex as catalyst under nitrogen atmosphere at 70 °C. 1H NMR spectrum was used to determine the compositions of copolymer. The copolymer compositions were then used to determine the reactivity ratios of monomers. Reactivity ratios of co-monomers in B/M copolymer, determined from linear Kelen-Tudos method (KT) and non linear Error-in-Variable Method (EVM), are rB = 0.41 ± 0.11, rM = 1.11 ± 0.33 and rB = 0.52, rM = 1.31 respectively. The complete resonance assignments of 1H and 13C{ 1H} NMR spectra were carried out with the help of Distortion less Enhancement by Polarization Transfer (DEPT), two-dimensional Heteronuclear Single Quantum Coherence (HSQC). 2D HSQC assignments were further confirmed by 2D Total Correlation Spectroscopy (TOCSY). The carbonyl carbon of B and M units and methyl carbon of M unit were assigned up to triad compositional and configurational sequences whereas β-methylene carbons were assigned up to tetrad compositional and configurational sequences. Similarly the methine carbon of B unit was assigned up to pentad level. 1,3 and 1,4 bond order couplings of carbonyl carbon and quaternary carbon resonances with methine, methylene and methyl protons were studied in detail using 2D Hetero Nuclear Multiple Bond Correlation (HMBC) spectra.

  11. Experimental and numerical study of pulsating transversal jets

    NASA Astrophysics Data System (ADS)

    Goldfeld, M. A.; Fedorova, N. N.; Fedorchenko, I. A.; Pozdnyakov, G. A.; Timofeev, K. Yu.; Zhakharova, Yu. V.

    2015-06-01

    Paper presents results of joint experimental and numerical investigation of pulsating jet penetration into still air and supersonic flow. Goal of the study is to investigate two-dimensional (2D) Hartmann generator (HG) properties and clear up its possibilities in providing better mixing between air and secondary (injected) gases.

  12. Theoretical study of surface plasmons coupling in transition metallic alloy 2D binary grating

    NASA Astrophysics Data System (ADS)

    Dhibi, Abdelhak; Khemiri, Mehdi; Oumezzine, Mohamed

    2016-05-01

    The excitation of a surface plasmon polariton (SPP) wave on a metal-air interface by a 2D diffraction grating is numerically investigated. The grating consists of homogeneous alloys of two metals of a formula AxB1-x, or three metals of a formula AxByCz, where A, B and C could be silver (Ag), copper (Cu), gold (Au) or aluminum (Al). It is observed that all the alloys of two metals present a very small change of surface plasmon resonance (SPR) irrespective of composition x. Moreover, the addition of 25% of Al to two metals alloy is insufficient to change the SPR curves. The influence of the different grating parameters is discussed in details using rigorous coupled-wave analysis (RCWA) method. Furthermore, the SPR is highly dependent on grating periods (dx and dy) and the height of the grating h. The results reveal that dx= dy= 700 nm, h=40 nm and duty cycle w=0.5 are the optimal parameters for exciting SPP.

  13. Fault steps and the dynamic rupture process: 2-D numerical simulations of a spontaneously propagating shear fracture

    NASA Astrophysics Data System (ADS)

    Harris, Ruth A.; Archuleta, Ralph J.; Day, Steven M.

    1991-05-01

    Fault steps may have controlled the sizes of the 1966 Parkfield, 1968 Borrego Mountain, 1979 Imperial Valley, 1979 Coyote Lake and the 1987 Superstition Hills earthquakes. This project investigates the effect of fault steps of various geometries on the dynamic rupture process. We have used a finite difference code to simulate spontaneous rupture propagation in two dimensions. We employ a slip-weakening fracture criterion as the condition for rupture propagation and examine how rupture on one plane initiates rupture on parallel fault planes. The geometry of the two parallel fault planes allows for stepover widths of 0.5 to 10.0 km and overlaps of -5 to 5 km. Our results demonstrate that the spontaneous rupture on the first fault segment continues to propagate onto the second fault segment for a range of geometries for both compressional and dilational fault steps. A major difference between the compressional and dilational cases is, that a dilational step requires a longer time delay between the rupture front reaching the end of the first fault segment and initiating rupture on the second segment. Therefore our dynamic study implies that a compressional step will be jumped quickly, whereas a dilational step will cause a time delay leading to a lower apparent rupture velocity. We also find that the rupture is capable of jumping a wider dilational step than compressional step.

  14. Fault steps and the dynamic rupture process: 2-D numerical simulations of a spontaneously propagating shear fracture

    SciTech Connect

    Harris, R.A.; Archuleta, R.J. ); Day, S.M. )

    1991-05-01

    Fault steps may have controlled the sizes of the 1966 Parkfield, 1968 Borrego Mountain, 1979 Imperial Valley, 1979 Coyote Lake and the 1987 Superstition Hills earthquakes. This project investigates the effect of fault steps of various geometries on the dynamic rupture process. The authors have used a finite difference code to simulate spontaneous rupture propagation in two dimensions. They employ a slip-weakening fracture criterion as the condition for rupture propagation and examine how rupture on one plane initiates rupture on parallel fault planes. The geometry of the two parallel fault planes allows for stepover widths of 0.5 to 10.0 m and overlaps of {minus}5 to 5 km. Results demonstrate that the spontaneous rupture on the first fault segment continues to propagate onto the second fault segment for a range of geometries for both compressional and dilational fault steps. A major difference between the compressional and dilational cases is that a dilational step requires a longer time delay between the rupture front reaching the end of the first fault segment and initiating rupture on the second segment. Therefore this dynamic study implies that a compressional step will be jumped quickly, whereas a dilational step will cause a time delay leading to a lower apparent rupture velocity. The authors also find that the rupture is capable of jumping a wider dilational step than compressional step.

  15. Transport studies in 2D transition metal dichalcogenides and black phosphorus.

    PubMed

    Du, Yuchen; Neal, Adam T; Zhou, Hong; Ye, Peide D

    2016-07-01

    Two-dimensional (2D) materials are a new family of materials with interesting physical properties, ranging from insulating hexagonal boron nitride, semiconducting or semi-metallic transition metal dichalcogenides, to gapless metallic graphene. In this review, we provide a brief discussion of transport studies in transition metal dichalcogenides, including both semiconducting and semi-metallic phases, as well as a discussion of the newly emerged narrow bandgap layered material, black phosphorus, in terms of its electrical and quantum transport properties at room and cryogenic temperatures. Ultra-thin layered channel materials with atomic layer thickness in the cross-plane direction, together with relatively high carrier mobility with appropriate passivation techniques, provide the promise for new scientific discoveries and broad device applications. PMID:27187790

  16. Transport studies in 2D transition metal dichalcogenides and black phosphorus

    NASA Astrophysics Data System (ADS)

    Du, Yuchen; Neal, Adam T.; Zhou, Hong; Ye, Peide D.

    2016-07-01

    Two-dimensional (2D) materials are a new family of materials with interesting physical properties, ranging from insulating hexagonal boron nitride, semiconducting or semi-metallic transition metal dichalcogenides, to gapless metallic graphene. In this review, we provide a brief discussion of transport studies in transition metal dichalcogenides, including both semiconducting and semi-metallic phases, as well as a discussion of the newly emerged narrow bandgap layered material, black phosphorus, in terms of its electrical and quantum transport properties at room and cryogenic temperatures. Ultra-thin layered channel materials with atomic layer thickness in the cross-plane direction, together with relatively high carrier mobility with appropriate passivation techniques, provide the promise for new scientific discoveries and broad device applications.

  17. An Experimental Study of Flow Separation over 2D Transverse Grooves

    NASA Astrophysics Data System (ADS)

    Jones, Emily; Lang, Amy; Afroz, Farhana; Wheelus, Jennifer; Smith, Drew

    2011-11-01

    A shark's scales help to reduce drag over its body by controlling boundary layer separation over its skin. It is theorized that the scales bristle when encountering a reversing flow, thereby trapping vortices between the scales, creating a partial slip condition over the surface and inducing turbulence augmentation in the boundary layer. In an attempt to replicate and study these effects, a spinning cylinder was used in a water tunnel to induce separation over a flat plate with 2 millimeter square 2D transverse grooves. The results were compared to separation occurring over a flat plate without grooves using DPIV. The angular speed of the cylinder was varied. The observed delays in separation, changes in separation bubble shedding frequency and other effects upon the boundary layer are discussed.

  18. Experimental and Computational Study of Multiphase Flow Hydrodynamics in 2D Trickle Bed Reactors

    NASA Astrophysics Data System (ADS)

    Nadeem, H.; Ben Salem, I.; Kurnia, J. C.; Rabbani, S.; Shamim, T.; Sassi, M.

    2014-12-01

    Trickle bed reactors are largely used in the refining processes. Co-current heavy oil and hydrogen gas flow downward on catalytic particle bed. Fine particles in the heavy oil and/or soot formed by the exothermic catalytic reactions deposit on the bed and clog the flow channels. This work is funded by the refining company of Abu Dhabi and aims at mitigating pressure buildup due to fine deposition in the TBR. In this work, we focus on meso-scale experimental and computational investigations of the interplay between flow regimes and the various parameters that affect them. A 2D experimental apparatus has been built to investigate the flow regimes with an average pore diameter close to the values encountered in trickle beds. A parametric study is done for the development of flow regimes and the transition between them when the geometry and arrangement of the particles within the porous medium are varied. Liquid and gas flow velocities have also been varied to capture the different flow regimes. Real time images of the multiphase flow are captured using a high speed camera, which were then used to characterize the transition between the different flow regimes. A diffused light source was used behind the 2D Trickle Bed Reactor to enhance visualizations. Experimental data shows very good agreement with the published literature. The computational study focuses on the hydrodynamics of multiphase flow and to identify the flow regime developed inside TBRs using the ANSYS Fluent Software package. Multiphase flow inside TBRs is investigated using the "discrete particle" approach together with Volume of Fluid (VoF) multiphase flow modeling. The effect of the bed particle diameter, spacing, and arrangement are presented that may be used to provide guidelines for designing trickle bed reactors.

  19. A force-based large increment method for 2D continuum solids and the mesh convergence study

    NASA Astrophysics Data System (ADS)

    Long, Danbing; Guo, Zaoyang; Liu, Xila; Natarajan, Sundararajan; Bordas, Stéphane

    2012-12-01

    In this paper, a triangular plane stress element is implemented based on the large increment method (LIM) to solve 2D continuum mechanics problems. In the LIM, after the governing equations are established using the generalized elemental force variables as primary unknowns, an iteration procedure is employed to obtain an optimised approximate solution of the problem. Two numerical examples are investigated to study the mesh convergence of the proposed triangular LIM element. Structured meshes as well as unstructured meshes with different element densities are generated to illustrate the convergence of the total strain energy in both examples. The numerical results obtained from the LIM (including the total strain energy, the displacement and the stress) are compared with the analytical solutions as well as the results from the commercial FEM software ABAQUS. All the results show that the performance of the LIM is as good as the FEM in linear elastic problems. A simple elastoplastic example suggests that the LIM may obtain better result than the FEM.

  20. Study on 2D random medium inversion algorithm based on Fuzzy C-means Clustering theory

    NASA Astrophysics Data System (ADS)

    Xu, Z.; Zhu, P.; Gu, Y.; Yang, X.; Jiang, J.

    2015-12-01

    Abstract: In seismic exploration for metal deposits, the traditional seismic inversion method based on layered homogeneous medium theory seems difficult to inverse small scale inhomogeneity and spatial variation of the actual medium. The reason is that physical properties of actual medium are more likely random distribution rather than layered. Thus, it is necessary to investigate a random medium inversion algorithm. The velocity of 2D random medium can be described as a function of five parameters: the background velocity (V0), the standard deviation of velocity (σ), the horizontal and vertical autocorrelation lengths (A and B), and the autocorrelation angle (θ). In this study, we propose an inversion algorithm for random medium based on the Fuzzy C-means Clustering (FCM) theory, whose basic idea is that FCM is used to control the inversion process to move forward to the direction we desired by clustering the estimated parameters into groups. Our method can be divided into three steps: firstly, the three parameters (A, B, θ) are estimated from 2D post-stack seismic data using the non-stationary random medium parameter estimation method, and then the estimated parameters are clustered to different groups according to FCM; secondly, the initial random medium model is constructed with clustered groups and the rest two parameters (V0 and σ) obtained from the well logging data; at last, inversion of the random medium are conducted to obtain velocity, impedance and random medium parameters using the Conjugate Gradient Method. The inversion experiments of synthetic seismic data show that the velocity models inverted by our algorithm are close to the real velocity distribution and the boundary of different media can be distinguished clearly.Key words: random medium, inversion, FCM, parameter estimation

  1. Computational Study and Analysis of Structural Imperfections in 1D and 2D Photonic Crystals

    SciTech Connect

    K.R. Maskaly

    2005-06-01

    Dielectric reflectors that are periodic in one or two dimensions, also known as 1D and 2D photonic crystals, have been widely studied for many potential applications due to the presence of wavelength-tunable photonic bandgaps. However, the unique optical behavior of photonic crystals is based on theoretical models of perfect analogues. Little is known about the practical effects of dielectric imperfections on their technologically useful optical properties. In order to address this issue, a finite-difference time-domain (FDTD) code is employed to study the effect of three specific dielectric imperfections in 1D and 2D photonic crystals. The first imperfection investigated is dielectric interfacial roughness in quarter-wave tuned 1D photonic crystals at normal incidence. This study reveals that the reflectivity of some roughened photonic crystal configurations can change up to 50% at the center of the bandgap for RMS roughness values around 20% of the characteristic periodicity of the crystal. However, this reflectivity change can be mitigated by increasing the index contrast and/or the number of bilayers in the crystal. In order to explain these results, the homogenization approximation, which is usually applied to single rough surfaces, is applied to the quarter-wave stacks. The results of the homogenization approximation match the FDTD results extremely well, suggesting that the main role of the roughness features is to grade the refractive index profile of the interfaces in the photonic crystal rather than diffusely scatter the incoming light. This result also implies that the amount of incoherent reflection from the roughened quarterwave stacks is extremely small. This is confirmed through direct extraction of the amount of incoherent power from the FDTD calculations. Further FDTD studies are done on the entire normal incidence bandgap of roughened 1D photonic crystals. These results reveal a narrowing and red-shifting of the normal incidence bandgap with

  2. Electronic and geometrical properties of monoatomic and diatomic 2D honeycomb lattices. A DFT study

    NASA Astrophysics Data System (ADS)

    Rojas, Ángela; Rey, Rafael; Fonseca, Karen; Grupo de Óptica e Información Cuántica Team

    Since the discovery of graphene by Geim and Novoselov at 2004, several analogous systems have been theoretically and experimentally studied, due to their technological interest. Both monoatomic lattices, such as silicine and germanene, and diatomic lattices (h-GaAs and h-GaN) have been studied. Using Density Functional Theory we obtain and confirm the chemical stability of these hexagonal 2D systems through the total energy curves as a function of interatomic distance. Unlike graphene, silicine and germanene, gapless materials, h-GaAs and h-GaN exhibit electronic gaps, different from that of the bulk, which could be interesting for the industry. On the other hand, the ab initio band structure calculations for graphene, silicene and germanene show a non-circular cross section around K points, at variance with the prediction of usual Tight-binding models. In fact, we have found that Dirac cones display a dihedral group symmetry. This implies that Fermi speed can change up to 30 % due to the orientation of the wave vector, for both electrons and holes. Traditional analytic studies use the Dirac equation for the electron dynamics at low energies. However, this equation assumes an isotropic, homogeneous and uniform space. Authors would like to thank the División de Investigación Sede Bogotá for their financial support at Universidad Nacional de Colombia. A. M. Rojas-Cuervo would also like to thank the Colciencias, Colombia.

  3. Evaluation of the Right Ventricular Function in Prediabetes: A 2-D Speckle Tracking Echocardiographic Study.

    PubMed

    Kowsari, Ali-Asghar; Hosseinsabet, Ali

    2016-06-01

    Pre-diabetes is a common condition associated with cardiovascular changes. The aim of our study was to evaluate the right ventricular (RV) function as assessed by 2-D speckle tracking echocardiography in pre-diabetic patients. This study recruited 94 patients (33 normal patients, 31 pre-diabetic patients and 30 diabetic patients). The absolute amount of the global peak systolic strain, the systolic strain rate and the early diastolic strain rate of the RV free wall (RVFW) was higher in the control group than in the pre-diabetic and diabetic groups. These indices were not different between the pre-diabetic and diabetic groups. The global late diastolic strain rate of RVFW was the same between the three groups. Also, pre-diabetes and diabetes were the independent predictors of the RVFW global peak systolic strain, systolic strain rate and diastolic strain rate. Our study demonstrated that the RV systolic and diastolic functions were impaired in the pre-diabetic and diabetic patients without obstructive coronary artery disease. Also, pre-diabetes and diabetes were independent predictors of systolic and diastolic functions of the RV. PMID:26996526

  4. Ionic Liquid–Solute Interactions Studied by 2D NOE NMR Spectroscopy

    DOE PAGESBeta

    Khatun, Sufia; Castner, Edward W.

    2014-11-26

    Intermolecular interactions between a Ru²⁺(bpy)₃ solute and the anions and cations of four different ionic liquids (ILs) are investigated by 2D NMR nuclear Overhauser effect (NOE) techniques, including {¹H-¹⁹F} HOESY and {¹H-¹H} ROESY. Four ILs are studied, each having the same bis(trifluoromethylsulfonyl)amide anion in common. Two of the ILs have aliphatic 1-alkyl-1-methylpyrrolidinium cations, while the other two ILs have aromatic 1-alkyl-3-methylimidazolium cations. ILs with both shorter (butyl) and longer (octyl or decyl) cationic alkyl substituents are studied. NOE NMR results suggest that the local environment of IL anions and cations near the Ru²⁺(bpy)₃ solute is rather different from the bulkmore » IL structure. The solute-anion and solute-cation interactions are significantly different both for ILs with short vs long alkyl tails and for ILs with aliphatic vs aromatic cation polar head groups. In particular, the solute-anion interactions are observed to be about 3 times stronger for the cations with shorter alkyl tails relative to the ILs with longer alkyl tails. The Ru²⁺(bpy)₃ solute interacts with both the polar head and the nonpolar tail groups of the 1- butyl-1-methylpyrrolidinium cation but only with the nonpolar tail groups of the 1-decyl-1-methylpyrrolidinium cation.« less

  5. Ionic Liquid–Solute Interactions Studied by 2D NOE NMR Spectroscopy

    SciTech Connect

    Khatun, Sufia; Castner, Edward W.

    2014-11-26

    Intermolecular interactions between a Ru²⁺(bpy)₃ solute and the anions and cations of four different ionic liquids (ILs) are investigated by 2D NMR nuclear Overhauser effect (NOE) techniques, including {¹H-¹⁹F} HOESY and {¹H-¹H} ROESY. Four ILs are studied, each having the same bis(trifluoromethylsulfonyl)amide anion in common. Two of the ILs have aliphatic 1-alkyl-1-methylpyrrolidinium cations, while the other two ILs have aromatic 1-alkyl-3-methylimidazolium cations. ILs with both shorter (butyl) and longer (octyl or decyl) cationic alkyl substituents are studied. NOE NMR results suggest that the local environment of IL anions and cations near the Ru²⁺(bpy)₃ solute is rather different from the bulk IL structure. The solute-anion and solute-cation interactions are significantly different both for ILs with short vs long alkyl tails and for ILs with aliphatic vs aromatic cation polar head groups. In particular, the solute-anion interactions are observed to be about 3 times stronger for the cations with shorter alkyl tails relative to the ILs with longer alkyl tails. The Ru²⁺(bpy)₃ solute interacts with both the polar head and the nonpolar tail groups of the 1- butyl-1-methylpyrrolidinium cation but only with the nonpolar tail groups of the 1-decyl-1-methylpyrrolidinium cation.

  6. The effect of bone fracture unevenness on ultrasound axial transmission measurements: A pilot 2D simulation study

    NASA Astrophysics Data System (ADS)

    Machado, Christiano B.; Pereira, Wagner C. A.; Padilla, Frédéric; Laugier, Pascal

    2012-05-01

    Ultrasound axial transmission (UAT) has been proposed to the diagnosis and follow-up of fracture healing. Some researchers have already pointed out the influence of fracture length, geometry and callus composition on the ultrasound time-of-flight and attenuation, with experimental and simulation studies. The aim of this work was to develop a pilot study on the effect of bone fracture unevenness on UAT measurements. Two-dimensional (2D) numerical simulations of ultrasound wave propagation were run using a custom-made finite-difference time domain code (SimSonic2D). Numerical models were composed of two 4-mm thick bone plates, with fracture lengths varying from 0 to 4 mm. For each case, an upward (UWun) and downward (DWun) unevenness of 0.5, 1.0 and 1.5 mm was implemented in the second plate. The 1-MHz emitter and receptor transducers were placed at 40 mm from each other, 20 mm apart from the center fracture. Two configurations were considered: 1.5 mm above the plates (for the 0-mm unevenness case) and transducers in contact with bone plate. For each situation, the time-of-flight of the first arriving signal (TOFFAS) and the FAS energy amplitude loss measured by the sound pressure level (SPLFAS) were computed. Results showed that there was a linear increase in TOFFAS with increasing fracture length, and a decrease of SPLFAS with the presence of a discontinuity. TOFFAS values were decreased with UWun (-0.87 μs for UWun = 1.5 mm), and increased with DWun (+0.99 μs for DWun = 1.5 mm). The SPLFAS increased with both UWun (+3.54 dB for UWun = 1.5 mm) and DWun (+8.15 dB for DWun = 1.5 mm). Both parameters showed the same variability. When transducers were put in contact with bone surface, fracture unevenness had no influence on TOF and SPL estimates. Previous works have already demonstrated that a fracture of 3 mm can increase TOFFAS in an order of 1 μs. Considering these preliminary results, it can be concluded that, although the variable fracture unevenness (until 1

  7. Test Problem: Tilted Rayleigh-Taylor for 2-D Mixing Studies

    SciTech Connect

    Andrews, Malcolm J.; Livescu, Daniel; Youngs, David L.

    2012-08-14

    reasonable quality photographic data. The photographs in Figure 2 also reveal the appearance of a boundary layer at the left and right walls; this boundary layer has not been included in the test problem as preliminary calculations suggested it had a negligible effect on plume penetration and RT mixing. The significance of this test problem is that, unlike planar RT experiments such as the Rocket-Rig (Youngs, 1984), Linear Electric Motor - LEM (Dimonte, 1990), or the Water Tunnel (Andrews, 1992), the Tilted-Rig is a unique two-dimensional RT mixing experiment that has experimental data and now (in this TP) Direct Numerical Simulation data from Livescu and Wei. The availability of DNS data for the tilted-rig has made this TP viable as it provides detailed results for comparison purposes. The purpose of the test problem is to provide 3D simulation results, validated by comparison with experiment, which can be used for the development and validation of 2D RANS models. When such models are applied to 2D flows, various physics issues are raised such as double counting, combined buoyancy and shear, and 2-D strain, which have not yet been adequately addressed. The current objective of the test problem is to compare key results, which are needed for RANS model validation, obtained from high-Reynolds number DNS, high-resolution ILES or LES with explicit sub-grid-scale models. The experiment is incompressible and so is directly suitable for algorithms that are designed for incompressible flows (e.g. pressure correction algorithms with multi-grid); however, we have extended the TP so that compressible algorithms, run at low Mach number, may also be used if careful consideration is given to initial pressure fields. Thus, this TP serves as a useful tool for incompressible and compressible simulation codes, and mathematical models. In the remainder of this TP we provide a detailed specification; the next section provides the underlying assumptions for the TP, fluids, geometry details

  8. Using the 2D VISAR to Study Dynamic Fracture and Deformation in Diamond

    NASA Astrophysics Data System (ADS)

    Ali, S. J.

    2015-12-01

    We have utilized the newly developed 2D VISAR diagnostic, in combination with the existing line-VISAR, to study heterogeneous deformation and fracture in micro- and nanocrystalline diamond. Diamond samples were shock compressed using a high energy laser drive. We obtained images and velocity maps of deformation and fracture that provide an unprecedented view into material response at the breakout surface. Our data show velocity roughening at the breakout surface as a result of spall fracture in free surface samples and as a result of the compressional inelastic wave and reflected release wave in tamped samples. The larger increase in velocity roughness associated with the microdiamond samples agrees with previously obtained data indicating a loss of reflectivity on breakout for microdiamond shock compression. Using the observed fragment size for spall fracture in the microcrystalline and nanocrystalline diamond, and Grady's model for spall fracture fragment size as a function of strain rate, we have found values for the micro- and nanocrystalline fracture toughness of 103±14 MPa m1/2 and 44±8 MPa m1/2, respectively. Using these values for the fracture toughness, the strain rate dependent spall stresses were calculated and found to agree with previous research.

  9. A case study of fluid flow in fractured rock mass based on 2-D DFN modeling

    NASA Astrophysics Data System (ADS)

    Han, Jisu; Noh, Young-Hwan; Um, Jeong-Gi; Choi, Yosoon

    2014-05-01

    A two dimensional steady-state fluid flow through fractured rock mass of an abandoned copper mine in Korea is addressed based on discrete fracture network modeling. An injection well and three observation wells were installed at the field site to monitor the variations of total heads induced by injection of fresh water. A series of packer tests were performed to estimate the rock mass permeability. First, the two dimensional stochastic fracture network model was built and validated for a granitic rock mass using the geometrical and statistical data obtained from surface exposures and borehole logs. This validated fracture network model was combined with the fracture data observed on boreholes to generate a stochastic-deterministic fracture network system. Estimated apertures for each of the fracture sets using permeability data obtained from borehole packer tests were discussed next. Finally, a systematic procedure for fluid flow modeling in fractured rock mass in two dimensional domain was presented to estimate the conductance, flow quantity and nodal head in 2-D conceptual linear pipe channel network. The results obtained in this study clearly show that fracture geometry parameters (orientation, density and size) play an important role in the hydraulic behavior of fractured rock masses.

  10. Studies of Arctic stratospheric ozone in a 2-D model including some effects of zonal asymmetries

    SciTech Connect

    Isaksen, I.S.A.; Rognerud, B.; Stordal, F. ); Coffey, M.T.; Mankin, W.G. )

    1990-03-01

    A two-dimensional (2-D) zonally averaged chemistry-transport model of the stratosphere has been extended to include some zonally asymmetric effects to study the chemically disturbed conditions in the Arctic winter during the occurrence of polar stratospheric clouds (PSCs). The model allows air parcels that have been in PSCs in the polar night to be exposed to sunlight during the passage south through a wave trough. Large enhancements of ClO are estimated as well as significant ozone reductions, most pronounced around the 20 km height level. The ozone depletions maximize in late March, about one month after the cease in PSC activity in the model, and amount to 5-8% in column ozone at 70{degree}N. In agreement with column measurements made from the DC-8, the model estimates an increase in the columns of HNO{sub 3} and ClONO{sub 2}, and a decrease in the HCl column within the polar vortex.

  11. 2D-ACAR Studies on Swift Heavy Ion Si-Implanted GaAs

    NASA Astrophysics Data System (ADS)

    Sivaji, K.; Selvakumar, S.

    Material properties modification by high energy heavy ion implantation is a prospective technology leading to many device fabrications. This technique induces defects and hence the physical properties of the materials are modified. The effects of swift heavy ion implantation induced defects by 120 MeV 28+Si ion implantation and doping in SI-GaAs are presented from the electron momentum distribution (EMD) of vacancy-type defects studied by two-dimensional angular correlation of annihilation radiation (2D-ACAR). The positron trapping due to the influence of high-energy Si- implantation in GaAs (n-type) is compared with the corresponding spectra of SI- GaAs and with Si-doped (n-type) GaAs. The EMD of the implanted sample shows a distinct increased isotropic distribution with a characteristic transform of its structure as evident from the low momentum region compared to the pristine sample. The characteristics of defects created by Si doping and by 120 MeV 28+Si ion implantation of undoped semi-insulating (SI) GaAS are discussed. These results indicate the nature of positron trapping in open volume defects such as vacancy clusters created by implantation.

  12. Numerical study of rock blasting

    NASA Astrophysics Data System (ADS)

    Stefanov, Yu. P.; Bakeev, R. A.; Yudin, A. S.; Kuznetsova, N. S.

    2015-10-01

    The paper presents numerical simulation results on fracture of a concrete block due to dynamic explosive loads applied to the walls of a blast hole. Considered in the study is the influence of the pulse shape and rock properties on the pattern of irreversible deformation and cracking. It is found that a fractured zone bounded by a plastically deformed contour always arises around the explosion site. Comparison of elastoplastic deformation and fracture induced in the concrete block by explosion pulses of different durations and amplitudes shows that shorter pulses with higher amplitudes and steeper rise times provide a higher blasting efficiency.

  13. Comparative study on 3D-2D convertible integral imaging systems

    NASA Astrophysics Data System (ADS)

    Choi, Heejin; Kim, Joohwan; Kim, Yunhee; Lee, Byoungho

    2006-02-01

    In spite of significant improvements in three-dimensional (3D) display fields, the commercialization of a 3D-only display system is not achieved yet. The mainstream of display market is a high performance two-dimensional (2D) flat panel display (FPD) and the beginning of the high-definition (HD) broadcasting accelerates the opening of the golden age of HD FPDs. Therefore, a 3D display system needs to be able to display a 2D image with high quality. In this paper, two different 3D-2D convertible methods based on integral imaging are compared and categorized for its applications. One method uses a point light source array and a polymer-dispersed liquid crystal and one display panel. The other system adopts two display panels and a lens array. The former system is suitable for mobile applications while the latter is for home applications such as monitors and TVs.

  14. Studies on the dynamics of vacuum encapsulated 2D MEMS scanners by laser Doppler vibrometry

    NASA Astrophysics Data System (ADS)

    Janes, Joachim; Hofmann, Ulrich

    2014-03-01

    2D MEMS scanners are used for e.g. Laser projection purposes or Lidar applications. Electrostatically driven resonant torsional oscillations of both axes of the scanners lead to Lissajous trajectories for Laser beams reflected from the micro mirror. Wafer level vacuum encapsulation with tilt glass capping ensures high angular amplitudes at low driving voltages additionally preventing environmental impacts. Applying Laser Doppler Vibrometry, the effect of residual gas friction, squeezed film damping and internal friction on 2D MEMS scanners is analyzed by measuring the Q-values associated with the torsional oscillations. Vibrometry is also used to analyze the oscillatory motion of the micro mirror and the gimbal of the scanners. Excited modes of the scanner structures are identified giving rise to coupling effects influencing the scanning performance of the 2D MEMS mirrors.

  15. Theoretical studies of effects of 2D plasmonic grating on electrical properties of organic solar cells

    NASA Astrophysics Data System (ADS)

    Sha, Wei E. I.; Choy, Wallace C. H.; Chew, Weng Cho

    2012-09-01

    Although various optical designs and physical mechanisms have been studied both experimentally and theoretically to improve the optical absorption of organic solar cells (OSCs) by incorporating metallic nanostructures, the effects of plasmonic nanostructures on the electrical properties of OSCs is still not fully understood. Hence, it is highly desirable to study the changes of electrical properties induced by plasmonic structures and the corresponding physics for OSCs. In this work, we develop a multiphysics model for plasmonic OSCs by solving the Maxwell's equations and semiconductor equations (Poisson, continuity, and drift-diffusion equations) with unified finite-difference method. Both the optical and electrical properties of OSCs incorporating a 2D metallic grating anode are investigated. For typical active polymer materials, low hole mobility, which is about one magnitude smaller than electron mobility, dominates the electrical property of OSCs. Since surface plasmon resonances excited by the metallic grating will produce concentrated near-field penetrated into the active polymer layer and decayed exponentially away from the metal-polymer interface, a significantly nonuniform and extremely high exciton generation rate is obtained near the grating. Interestingly, the reduced recombination loss and the increased open-circuit voltage can be achieved in plasmonic OSCs. The physical origin of the phenomena lies at direct hole collections to the metallic grating anode with a short transport path. In comparison with the plasmonic OSC, the hole transport in a multilayer planar OSC experiences a long transport path and time because the standard planar OSC has a high exciton generation rate at the transparent front cathode. The unveiled multiphysics is particularly helpful for designing high-performance plasmonic OSCs.

  16. Small post-perovskite patches at the base of lower mantle primordial reservoirs: Insights from 2-D numerical modeling and implications for ULVZs

    NASA Astrophysics Data System (ADS)

    Li, Yang; Deschamps, Frédéric; Tackley, Paul J.

    2016-04-01

    We perform numerical experiments of thermochemical mantle convection in 2-D spherical annulus geometry to investigate the distribution of post-perovskite (pPv) with respect to the location of primordial reservoirs of dense material in the lowermost mantle. High core-mantle boundary temperatures lead to strong anticorrelation between the locations of pPv and large primordial reservoirs, while low values lead to a pPv layer fully covering the outer core. Intermediate values avoid a full pPv layer but allow pPv phase change to occur within the primordial reservoirs. Through interactions between cold downwellings and primordial reservoirs, low viscosity (weak) pPv leads to the formation of long-lived, thin tails of primordial materials extending laterally at the edges of these reservoirs. Small patches of pPv also form within the primordial reservoir but are short-lived. If primordial reservoirs are enriched in iron, these patches may provide an explanation for the ultralow-velocity zones.

  17. Dosimetric study of 2D ion chamber array matrix for the modern radiotherapy treatment verification.

    PubMed

    Saminathan, Sathiyan; Manickam, Ravikumar; Chandraraj, Varatharaj; Supe, Sanjay S

    2010-01-01

    Intensity-modulated radiotherapy treatment demands stringent quality assurance and accurate dose determination for delivery of highly conformal dose to the patients. Generally 3D dose distributions obtained from a treatment planning system have to be verified by dosimetric methods. Mainly, a comparison of two-dimensional calculated and measured data in several coplanar planes is performed. In principle, there are many possibilities to measure two-dimensional dose distributions such as films, flat-panel electronic portal imaging devices (EPID), ion chambers and ionization chamber arrays, and radiographic and radiochromic films. The flat-panel EPIDs show a good resolution and offer a possibility for real-time measurements: however to convert the signal into dose, a separate commercial algorithm is required. The 2D ion chamber array system offers the real-time measurements. In this study, dosimetric characteristics of 2D ion chamber array matrix were analyzed for verification of radiotherapy treatments. The dose linearity and dose rate effect of the I'matriXX device was studied using 6 MV, 18 MV photons and 12 MeV electrons. The output factor was estimated using I'matriXX device and compared with ion chamber measurements. The ion chamber array system was found to be linear in the dose range of 2-500 cGy and the response of the detector was found to be independent of dose rate between 100 MU/min to 600 MU/min. The estimated relative output factor with I'matriXX was found to match very well with the ion chamber measurements. To check the final dose delivered during IMRT planning, dose distribution patterns such as field-in-field, pyramidal, and chair tests were generated with the treatment planning system (TPS) and the same was executed in the accelerator and measured with the I'matriXX device. The dose distribution pattern measured by the matrix device for field-in-field, pyramidal, and chair test were found to be in good agreement with the calculated dose distribution

  18. Modulation of cortical activity in 2D versus 3D virtual reality environments: an EEG study.

    PubMed

    Slobounov, Semyon M; Ray, William; Johnson, Brian; Slobounov, Elena; Newell, Karl M

    2015-03-01

    There is a growing empirical evidence that virtual reality (VR) is valuable for education, training, entertaining and medical rehabilitation due to its capacity to represent real-life events and situations. However, the neural mechanisms underlying behavioral confounds in VR environments are still poorly understood. In two experiments, we examined the effect of fully immersive 3D stereoscopic presentations and less immersive 2D VR environments on brain functions and behavioral outcomes. In Experiment 1 we examined behavioral and neural underpinnings of spatial navigation tasks using electroencephalography (EEG). In Experiment 2, we examined EEG correlates of postural stability and balance. Our major findings showed that fully immersive 3D VR induced a higher subjective sense of presence along with enhanced success rate of spatial navigation compared to 2D. In Experiment 1 power of frontal midline EEG (FM-theta) was significantly higher during the encoding phase of route presentation in the 3D VR. In Experiment 2, the 3D VR resulted in greater postural instability and modulation of EEG patterns as a function of 3D versus 2D environments. The findings support the inference that the fully immersive 3D enriched-environment requires allocation of more brain and sensory resources for cognitive/motor control during both tasks than 2D presentations. This is further evidence that 3D VR tasks using EEG may be a promising approach for performance enhancement and potential applications in clinical/rehabilitation settings. PMID:25448267

  19. A study of a sector spectrophotometer and auroral O+(2P-2D) emissions

    NASA Technical Reports Server (NTRS)

    Swenson, G. R.

    1976-01-01

    The metastable O+(2P-2D) auroral emission was investigated. The neighboring OH contaminants and low intensity levels of the emission itself necessitated the evolution of an instrument capable of separating the emission from the contaminants and having a high sensitivity in the wavelength region of interest. A new type of scanning photometer was developed and its properties are discussed. The theoretical aspects of auroral electron interaction with atomic oxygen and the resultant O+(2P-2D) emissions were examined in conjunction with N2(+)1NEG emissions. Ground based measurements of O+(2P-2D) auroral emission intensities were made using the spatial scanning photometer (sector spectrophotometer). Simultaneous measurements of N2(+)1NEG sub 1,0 emission intensity were made in the same field of view using a tilting photometer. Time histories of the ratio of these two emissions made in the magnetic zenith during auroral breakup periods are given. Theories of I sub 7319/I sub 4278 of previous investigators were presented. A rocket measurement of N2(+)1NEG sub 0,0 and O+(2P-2D) emission in aurora was examined in detail and was found to agree with the ground based measurements. Theoretical examination resulted in the deduction of the electron impact efficiency generating O+(2P) and also suggests a large source of O+(2P) at low altitude. A possible source is charge exchange of N+(1S) with OI(3P).

  20. D Recording for 2d Delivering - the Employment of 3d Models for Studies and Analyses -

    NASA Astrophysics Data System (ADS)

    Rizzi, A.; Baratti, G.; Jiménez, B.; Girardi, S.; Remondino, F.

    2011-09-01

    In the last years, thanks to the advances of surveying sensors and techniques, many heritage sites could be accurately replicated in digital form with very detailed and impressive results. The actual limits are mainly related to hardware capabilities, computation time and low performance of personal computer. Often, the produced models are not visible on a normal computer and the only solution to easily visualized them is offline using rendered videos. This kind of 3D representations is useful for digital conservation, divulgation purposes or virtual tourism where people can visit places otherwise closed for preservation or security reasons. But many more potentialities and possible applications are available using a 3D model. The problem is the ability to handle 3D data as without adequate knowledge this information is reduced to standard 2D data. This article presents some surveying and 3D modeling experiences within the APSAT project ("Ambiente e Paesaggi dei Siti d'Altura Trentini", i.e. Environment and Landscapes of Upland Sites in Trentino). APSAT is a multidisciplinary project funded by the Autonomous Province of Trento (Italy) with the aim documenting, surveying, studying, analysing and preserving mountainous and hill-top heritage sites located in the region. The project focuses on theoretical, methodological and technological aspects of the archaeological investigation of mountain landscape, considered as the product of sequences of settlements, parcelling-outs, communication networks, resources, and symbolic places. The mountain environment preserves better than others the traces of hunting and gathering, breeding, agricultural, metallurgical, symbolic activities characterised by different lengths and environmental impacts, from Prehistory to the Modern Period. Therefore the correct surveying and documentation of this heritage sites and material is very important. Within the project, the 3DOM unit of FBK is delivering all the surveying and 3D material to

  1. Interactions of sialic acid with phosphatidylcholine liposomes studied by 2D NMR spectroscopy.

    PubMed

    Timoszyk, Anna; Latanowicz, Lidia

    2013-01-01

    Biological membranes are complex systems which have attracted scientific interest for a long time and for various reasons. The sialic acid-liposome interactions at the molecular level depend on their hydro-lipophilic characteristics. The aim of the present study was to investigate the changes of conformation of the phospholipid (1,2-Diacyl-sn-glycero-3-phosphocholine) and sialic acid (2,8-(N-acetylneuraminic acid)) molecules and the type of interactions induced by the sialic acid molecules on membrane-like systems (liposomes) by 2D NMR (TOCSY, HETCOR, ROESY). The nature of the interaction of sialic acid with the model membrane depends on the structure of the phospholipid headgroups and the hydration of membrane. In ROESY spectra was observed the absence of dipole-dipole couplings within the choline head, between headgroups and glycerol, and between glycerol and fatty acid chains. It indicates an increase of the membrane dynamics in the presence of sialic acid. Moreover, the conformation of sialic acid molecule is changed in the presence of liposomes, which depends on stereochemistry of the chemical groups of the carbon atoms C7 and C8, and oxygen O8. The observed differences between the ROESY spectra of free and liposome bound sialic acid may be a consequence of a changed orientation of the pyranose ring from trans to gauche in the presence of liposomes. The sialic acid penetrate into the phospholipid bilayer to a sufficient depth to allow the dipole interaction. The present result that the correlation signal was found only between the methyl protons from the acetyl group of sialic acid and the methylene tail of phospholipid molecule in the ROESY spectrum indicates that the opposite end of the sialic acid molecule stays in the aqueous phase without interacting with membrane molecules. PMID:24364043

  2. A faster method for 3D/2D medical image registration--a simulation study.

    PubMed

    Birkfellner, Wolfgang; Wirth, Joachim; Burgstaller, Wolfgang; Baumann, Bernard; Staedele, Harald; Hammer, Beat; Gellrich, Niels Claudius; Jacob, Augustinus Ludwig; Regazzoni, Pietro; Messmer, Peter

    2003-08-21

    3D/2D patient-to-computed-tomography (CT) registration is a method to determine a transformation that maps two coordinate systems by comparing a projection image rendered from CT to a real projection image. Iterative variation of the CT's position between rendering steps finally leads to exact registration. Applications include exact patient positioning in radiation therapy, calibration of surgical robots, and pose estimation in computer-aided surgery. One of the problems associated with 3D/2D registration is the fact that finding a registration includes solving a minimization problem in six degrees of freedom (dof) in motion. This results in considerable time requirements since for each iteration step at least one volume rendering has to be computed. We show that by choosing an appropriate world coordinate system and by applying a 2D/2D registration method in each iteration step, the number of iterations can be grossly reduced from n6 to n5. Here, n is the number of discrete variations around a given coordinate. Depending on the configuration of the optimization algorithm, this reduces the total number of iterations necessary to at least 1/3 of it's original value. The method was implemented and extensively tested on simulated x-ray images of a tibia, a pelvis and a skull base. When using one projective image and a discrete full parameter space search for solving the optimization problem, average accuracy was found to be 1.0 +/- 0.6(degrees) and 4.1 +/- 1.9 (mm) for a registration in six parameters, and 1.0 +/- 0.7(degrees) and 4.2 +/- 1.6 (mm) when using the 5 + 1 dof method described in this paper. Time requirements were reduced by a factor 3.1. We conclude that this hardware-independent optimization of 3D/2D registration is a step towards increasing the acceptance of this promising method for a wide number of clinical applications. PMID:12974581

  3. Probabilistic hazard analysis of dense Pyroclastic Density Currents at Vesuvius (Italy) via parametric uncertainty characterization of TITAN2D numerical simulator

    NASA Astrophysics Data System (ADS)

    Tierz, Pablo; Ramona Stefanescu, Elena; Sandri, Laura; Patra, Abani; Marzocchi, Warner; Sulpizio, Roberto

    2014-05-01

    Probabilistic hazard assessments of Pyroclastic Density Currents (PDCs) are of great interest for decision-making purposes. However, there is a limited number of published works available on this topic. Recent advances in computation and statistical methods are offering new opportunities beyond the classical Monte Carlo (MC) sampling which is known as a simple and robust method but it usually turns out to be slow and computationally intractable. In this work, Titan2D numerical simulator has been coupled to Polynomial Chaos Quadrature (PCQ) to propagate the simulator parametric uncertainty and compute VEI-based probabilistic hazard maps of dense PDCs formed as a result of column collapse at Vesuvius volcano, Italy. Due to the lack of knowledge about the exact conditions under which these PDCs will form, Probability Distribution Functions (PDFs) are assigned to the simulator input parameters (Bed Friction Angle and Volume) according to three VEI sizes. Uniform distributions were used for both parameters since there is insufficient information to assume that any value in the range is more likely that any other value. Reasonable (and compatible) ranges for both variables were constrained according to past eruptions at Vesuvius volcanic system. On the basis of reasoning above a number of quadrature points were taken within those ranges, which resulted in one execution of the TITAN2D code at each quadrature point. With a computational cost several orders of magnitude smaller than MC, exceedance probabilities for a given threshold of flow depth (and conditional to the occurrence of VEI3, VEI4 and VEI5 eruptions) were calculated using PCQ. Moreover, PCQ can be run at different threshold values of the same output variable (flow depth, speed, kinetic energy, …) and, therefore, it can serve to compute Exceedance Probability curves (aka hazard curves) at singular points inside the hazard domain, representing the most important and useful scientific input to quantitative risk

  4. Numerical studies of frontal dynamics

    NASA Technical Reports Server (NTRS)

    Keyser, Daniel

    1986-01-01

    Efforts concentrated on the development of a two dimensional primitive equation (PE) model of frontogenesis that simultaneously incorporates the frontagenetical mechanisms of confluence and horizontal shear. Applying this model to study the effects of upper level frontogenesis, it appeared to be dominated by tilting effects associated with cross front variation of vertical motion, in which subsidence is maximized within and to the warm side of the frontal zone. Results suggest that aspects characteristic of three-dimensional baroclinic waves may be abstracted to a significant extent in a two dimensional framework. They also show that upper-level frontogenesis and tropopause folding can occur in the absence of three-dimensional curvature effects, commonly believed to be necessary for realistic upper-level frontogenesis. An implication of the dominant tilting effects is that they may have to be adequately resolved by numerical weather prediction models, thus requiring better horizontal and vertical resolution.

  5. An Experimental Study of the Potential Biological Effects Associated with 2-D Shear Wave Elastography on the Neonatal Brain.

    PubMed

    Li, Changtian; Zhang, Changsheng; Li, Junlai; Cao, Xiaolin; Song, Danfei

    2016-07-01

    2-D Shear wave elastography (SWE) imaging is widely used in clinical practice, and some researchers have applied this technique in the evaluation of neonatal brains. However, the immediate and long-term impacts of dynamic radiation force exposure on the neonatal central nervous system remain unknown. In this study, we exposed neonatal mice to 2-D SWE scanning for 10 min, 20 min and 30 min under diagnostic mode (mechanical index [MI]: 1.3; thermal index [TI]: 0.5), respectively. For the control group, the neonatal mice were sham irradiated for 30 min with the machine powered off. Their brains were collected and analyzed using histologic staining and western blot analysis at 24 h and 3 mo after the 2-D SWE scanning. The Morris water maze (MWM) test was used to assess learning and memory function of the mice at 3 mo of age. The results indicated that using 2-D SWE in evaluating brains of neonatal mice does not cause detectable histologic changes, nor does it have long-term effects on their learning and memory abilities. However, the PI3 K/AKT/mTOR pathway was disturbed when the 2-D SWE scanning lasted for more than 30 min, and the expression of p-PKCa was suppressed by 10 min or more in 2-D SWE scanning. Although these injuries may be self-repaired as the mice grow, more attention should be paid to the scanning duration when applying 2-D-SWE elastography in the assessment of neonatal brains. PMID:27112914

  6. Surface wave phase velocities from 2-D surface wave tomography studies in the Anatolian plate

    NASA Astrophysics Data System (ADS)

    Arif Kutlu, Yusuf; Erduran, Murat; Çakır, Özcan; Vinnik, Lev; Kosarev, Grigoriy; Oreshin, Sergey

    2014-05-01

    We study the Rayleigh and Love surface wave fundamental mode propagation beneath the Anatolian plate. To examine the inter-station phase velocities a two-station method is used along with the Multiple Filter Technique (MFT) in the Computer Programs in Seismology (Herrmann and Ammon, 2004). The near-station waveform is deconvolved from the far-station waveform removing the propagation effects between the source and the station. This method requires that the near and far stations are aligned with the epicentre on a great circle path. The azimuthal difference of the earthquake to the two-stations and the azimuthal difference between the earthquake and the station are restricted to be smaller than 5o. We selected 3378 teleseismic events (Mw >= 5.7) recorded by 394 broadband local stations with high signal-to-noise ratio within the years 1999-2013. Corrected for the instrument response suitable seismogram pairs are analyzed with the two-station method yielding a collection of phase velocity curves in various period ranges (mainly in the range 25-185 sec). Diffraction from lateral heterogeneities, multipathing, interference of Rayleigh and Love waves can alter the dispersion measurements. In order to obtain quality measurements, we select only smooth portions of the phase velocity curves, remove outliers and average over many measurements. We discard these average phase velocity curves suspected of suffering from phase wrapping errors by comparing them with a reference Earth model (IASP91 by Kennett and Engdahl, 1991). The outlined analysis procedure yields 3035 Rayleigh and 1637 Love individual phase velocity curves. To obtain Rayleigh and Love wave travel times for a given region we performed 2-D tomographic inversion for which the Fast Marching Surface Tomography (FMST) code developed by N. Rawlinson at the Australian National University was utilized. This software package is based on the multistage fast marching method by Rawlinson and Sambridge (2004a, 2004b). The

  7. Isolation and 2D NMR Studies of Alkaloids from Comptonella sessilifoliola1.

    PubMed

    Pusset, J; Lopez, J L; Pais, M; Neirabeyeh, M A; Veillon, J M

    1991-04-01

    Six known furanoquinoline alkaloids have been isolated from the wood and trunk bark of COMPTONELLA SESSILIFOLIOLA (Guillaumin) Hartley (Rutaceae). 2D NMR experiments gave the assignment of all the signals for both (1)H- and (13)C-NMR spectra. Pteleine and kokusaginine were used as models. The two-dimensional carbon-proton correlation experiments, performed for the first time on furanoquinoline alkaloids, led us to correct (13)C-NMR assignments previously described in the literature. PMID:17226139

  8. 32 CFR 1630.26 - Class 2-D: Registrant deferred because of study preparing for the ministry.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 32 National Defense 6 2010-07-01 2010-07-01 false Class 2-D: Registrant deferred because of study... study preparing for the ministry. In accord with part 1639 of this chapter any registrant shall be... direction of a recognized church or religious organization; and (b) Who is satisfactorily pursuing a...

  9. 32 CFR 1630.26 - Class 2-D: Registrant deferred because of study preparing for the ministry.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 32 National Defense 6 2014-07-01 2014-07-01 false Class 2-D: Registrant deferred because of study... study preparing for the ministry. In accord with part 1639 of this chapter any registrant shall be... direction of a recognized church or religious organization; and (b) Who is satisfactorily pursuing a...

  10. 32 CFR 1630.26 - Class 2-D: Registrant deferred because of study preparing for the ministry.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 32 National Defense 6 2012-07-01 2012-07-01 false Class 2-D: Registrant deferred because of study... study preparing for the ministry. In accord with part 1639 of this chapter any registrant shall be... direction of a recognized church or religious organization; and (b) Who is satisfactorily pursuing a...

  11. 32 CFR 1630.26 - Class 2-D: Registrant deferred because of study preparing for the ministry.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 32 National Defense 6 2013-07-01 2013-07-01 false Class 2-D: Registrant deferred because of study... study preparing for the ministry. In accord with part 1639 of this chapter any registrant shall be... direction of a recognized church or religious organization; and (b) Who is satisfactorily pursuing a...

  12. 32 CFR 1630.26 - Class 2-D: Registrant deferred because of study preparing for the ministry.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 32 National Defense 6 2011-07-01 2011-07-01 false Class 2-D: Registrant deferred because of study... study preparing for the ministry. In accord with part 1639 of this chapter any registrant shall be... direction of a recognized church or religious organization; and (b) Who is satisfactorily pursuing a...

  13. In-situ Hydrogen Sorption 2D-ACAR Facility for the Study of Metal Hydrides for Hydrogen Storage

    NASA Astrophysics Data System (ADS)

    Legerstee, W. J.; de Roode, J.; Anastasopol, A.; Falub, C. V.; Eijt, S. W. H.

    We developed a dedicated hydrogen sorption setup coupled to a positron 2D-ACAR (two-dimensional Angular Correlation of Annihilation Radiation) setup employing a 22Na-source, which will enable to collect 2D-ACAR momentum distributions in-situ as a function of temperature, hydrogen pressure and hydrogen content. In parallel, a dedicated glovebox was constructed for handling air-sensitive metal and metal hydride samples, with a special entrance for the 2D-ACAR sample insert. The 2D-ACAR setup was tested in first measurements on a Pd0.75Ag0.25 foil and on a ball-milled MgH2 powder in both the hydrogen loaded and desorbed states. The hydrogen loaded Pd0.75Ag0.25Hx sample was kept under a 1 bar hydrogen pressure to prevent partial desorption during measurements at room temperature. The collected 2D-ACAR distributions of Pd0.75Ag0.25 and Pd0.75Ag0.25Hx showed similar features as observed in previous studies. The broadening of the ACAR distributions observed for the Mg to MgH2 metal-insulator transition was compared in a quantitative manner to ab-initio calculations reported in the literature.

  14. Exploratory User Study to Evaluate the Effect of Street Name Changes on Route Planning Using 2d Maps

    NASA Astrophysics Data System (ADS)

    Rautenbach, Victoria; Coetzee, Serena; Hankel, Melissa

    2016-06-01

    This paper presents the results of an exploratory user study using 2D maps to observe and analyse the effect of street name changes on prospective route planning. The study is part of a larger research initiative to understand the effect of street name changes on wayfinding. The common perception is that street name changes affect our ability to navigate an environment, but this has not yet been tested with an empirical user study. A combination of a survey, the thinking aloud method and eye tracking was used with a group of 20 participants, mainly geoinformatics students. A within-subject participant assignment was used. Independent variables were the street network (regular and irregular) and orientation cues (street names and landmarks) portrayed on a 2D map. Dependent variables recorded were the performance (were the participant able to plan a route between the origin and destination?); the accuracy (was the shortest path identified?); the time taken to complete a task; and fixation points with eye tracking. Overall, the results of this exploratory study suggest that street name changes impact the prospective route planning performance and process that individuals use with 2D maps. The results contribute to understanding how route planning changes when street names are changed on 2D maps. It also contributes to the design of future user studies. To generalise the findings, the study needs to be repeated with a larger group of participants.

  15. A feasibility study using radiochromic films for fast neutron 2D passive dosimetry

    PubMed Central

    Brady, Samuel L; Gunasingha, Rathnayaka; Yoshizumi, Terry T; Howell, Calvin R; Crowell, Alexander S; Fallin, Brent; Tonchev, Anton P; Dewhirst, Mark W

    2013-01-01

    The objective of this paper is threefold: (1) to establish sensitivity of XRQA and EBT radiochromic films to fast neutron exposure; (2) to develop a film response to radiation dose calibration curve and (3) to investigate a two-dimensional (2D) film dosimetry technique for use in establishing an experimental setup for a radiobiological irradiation of mice and to assess the dose to the mice in this setup. The films were exposed to a 10 MeV neutron beam via the 2H(d,n)3He reaction. The XRQA film response was a factor of 1.39 greater than EBT film response to the 10 MeV neutron beam when exposed to a neutron dose of 165 cGy. A film response-to-soft tissue dose calibration function was established over a range of 0–10 Gy and had a goodness of fit of 0.9926 with the calibration data. The 2D film dosimetry technique estimated the neutron dose to the mice by measuring the dose using a mouse phantom and by placing a piece of film on the exterior of the experimental mouse setup. The film results were benchmarked using Monte Carlo and aluminum (Al) foil activation measurements. The radiochromic film, Monte Carlo and Al foil dose measurements were strongly correlated, and the film within the mouse phantom agreed to better than 7% of the externally mounted films. These results demonstrated the potential application of radiochromic films for passive 2D neutron dosimetry. PMID:20693612

  16. Depth-selective 2D-ACAR studies on low- k dielectric thin films

    NASA Astrophysics Data System (ADS)

    Eijt, S. W. H.; van Veen, A.; Falub, C. V.; Galindo, R. Escobar; Schut, H.; Mijnarends, P. E.; de Theije, F. K.; Balkenende, A. R.

    2003-10-01

    Depth-selective 2D-ACAR investigations on ordered mesoporous silica thin films provide direct evidence that para-positronium ( p-Ps) created deep in the films can escape through a network of interconnected pores. The depth dependence of the escape fraction and of the average kinetic energy of non-thermally excited p-Ps is in quantitative agreement with Monte Carlo modeling, assuming classical collisions of p-Ps with the pore walls. The model provides insight in the shape of the angular correlation distributions and their sensitivity to, e.g., the effective wall mass Ms and pore dimensions.

  17. High resolution study of the six lowest doubly excited vibrational states of PH 2D

    NASA Astrophysics Data System (ADS)

    Leroy, C.; Ulenikov, O. N.; Bekhtereva, E. S.; Onopenko, G. A.; Chudinova, T. D.

    2005-12-01

    The five lowest doubly excited deformational vibrational bands ν4 + ν6, 2 ν6, ν3 + ν4, ν3 + ν6, and 2 ν3 of PH 2D have been recorded for the first time using a Bruker 120 HR interferometer with a resolution 0.0033 cm -1 and analysed. Some transitions belonging to a very weak band 2 ν4 have been also assigned. From the fit 24 and 86, respectively, diagonal and resonance interaction parameters were obtained which reproduce 1089 upper energy levels obtained from more than 4600 assigned transitions with the rms deviation of 0.00059 cm -1.

  18. Optimizing limbic selective D2/D3 receptor occupancy by risperidone: a [123I]-epidepride SPET study.

    PubMed

    Bressan, Rodrigo A; Erlandsson, Kjell; Jones, Hugh M; Mulligan, Rachel S; Ell, Peter J; Pilowsky, Lyn S

    2003-02-01

    Selective action at limbic cortical dopamine D2-like receptors is a putative mechanism of atypical antipsychotic efficacy with few extrapyramidal side effects. Although risperidone is an atypical antipsychotic with high affinity for D2 receptors, low-dose risperidone treatment is effective without inducing extrapyramidal symptoms. The objective was to test the hypothesis that treatment with low-dose risperidone results in 'limbic selective' D2/D3 receptor blockade in vivo. Dynamic single photon emission tomography (SPET) sequences were obtained over 5 hours after injection of [123I]-epidepride (approximately 150 MBq), using a high-resolution triple-headed brain scanner (Marconi Prism 3000XP). Kinetic modelling was performed using the simplified reference region model to obtain binding potential values. Estimates of receptor occupancy were made relative to a normal volunteer control group (n = 5). Six patients treated with low-dose risperidone (mean = 2.6 mg) showed moderate levels of D2/D3 occupancy in striatum (49.9%), but higher levels of D2/D3 occupancy in thalamus (70.8%) and temporal cortex (75.2%). Occupancy values in striatum were significantly different from thalamus (F (1,4) = 26.3, p < 0.01) and from temporal cortex (F (1,4) = 53.4, p < 0.01). This is the first study to evaluate striatal and extrastriatal occupancy of risperidone. Low dose treatment with risperidone achieves a similar selectivity of limbic cortical over striatal D2/D3 receptor blockade to that of atypical antipsychotics with lower D2/D3 affinity such as clozapine, olanzapine and quetiapine. This finding is consistent with the relevance of 'limbic selective' D2/D3 receptor occupancy to the therapeutic efficacy of atypical antipsychotic drugs. PMID:12544369

  19. [Study on the wavelength accuracy of the 2-D slit-array Hadamard spectrometer].

    PubMed

    Chi, Ming-Bo; Hao, Peng; Wu, Yi-Hui

    2013-01-01

    The 2-D slit array mask is a new design of Hadamard spectrometer mask. Having discussed the influence of the inconsistency caused by the machining errors in the size and location between the slits in the same column on the wavelength accuracy of the Hadamard spectrometer, the authors bring up with the way to decrease the influence on the wavelength accuracy of the spectrometer caused by the difference in the height and location vertical to the spectrum between the slits in the same column, and then estimate the spectral shift caused by the relative location shift along the spectrum between the slits in the same column. A model for simulation was built, and the measurement errors in the decoded spectrum generated by one column of the slits on the mask were calculated, when there are inconsistency errors in width and location along the spectrum between the slits in another column. Based on the simulation calculation, we can determine the machining precision of the mask. The research will be meaningful to the design of the 2-D slit array mask using MEMS(micro-electro-mechanism system) technique and the revise of the decoded spectrum, which can provide the spectrometer with a reasonable wavelength accuracy. PMID:23586265

  20. Study of Unsteady Flow Actuation Produced by Surface Plasma Actuator on 2-D Airfoil

    NASA Astrophysics Data System (ADS)

    Phan, Minh Khang; Shin, Jichul

    2014-10-01

    Effect of flow actuation driven by low current continuous or pulsed DC surface glow discharge plasma actuator is studied. Schlieren image of induced flow on flat plate taken at a high repetition rate reveals that the actuation is mostly initiated near the cathode. Assuming that the actuation is mostly achieved by ions in the cathode sheath region, numerical model for the source of flow actuation is obtained by analytical estimation of ion pressure force created in DC plasma sheath near the cathode and added in momentum equation as a body force term. Modeled plasma flow actuator is simulated with NACA0012 airfoil oscillating over a certain range of angle of attack (AoA) at specific reduced frequencies of airfoil. By changing actuation authority according to the change in AoA, stabilization of unsteady flow field is improved and hence steady aerodynamic performance can be maintained. Computational result shows that plasma actuation is only effective in modifying aerodynamic characteristics of separated flow. It turns out that plasma pulse frequency should be tuned for optimal performance depending on phase angle and rotating speed. The actuation authority can be parameterized by a ratio between plasma pulse frequency and reduced frequency.

  1. Short-term groundwater fluxes in the hyporheic zone as a consequence of changing river stages; numerical simulation by HYDRUS 2D/3D.

    NASA Astrophysics Data System (ADS)

    Wyseure, Guido; Chou, Po-Yi

    2010-05-01

    All hydrological handbooks contain methods for direct runoff and base-flow separation. The semi-log separation method is the most classical one. One can, however, question the physical base for such method. In addition, the water fluxes in the riverbed are important for ecology and water quality. In our study an 2-D cross-section including the river and the surrounding aquifer was set-up in HYDRUS 2D/3D. Initial conditions were a steady-state subsurface flow feeding the river with a recharge from the soil surface. A surface runoff event was simulated by a rise and recession of the water level in the river. Differences between summer and winter situation were explored by given representative temperatures to the different components of the river-aquifer system. The simulations show that the fluxes are very different along the riverbed. Even during steady state baseflow we see that the fluxes through the bottom were 2 to 3 times smaller as compared to the side banks. During the hydrographs the proportion can become up to 5 times. Another interesting result is that within the time frame of the hydrograph and its immediate recession relatively little water, which pentetrated in the aquifer, returns to the river. Most of the water replenishes the aquifer and there is only a very small rise of baseflow. In our simulation we returned to the original level as before the hydrograph, so in reality even less or no rise in baseflow may occur immediately after a hydrograph. Of course, in a longer time-frame the recharge of the aquifer will give a rise to the actual subsurface drainage. The change in seasonal temperatures within the river-aquifer system has a substantial effect. For identical river stage hydrograph changes the hyporheic exchange fluxes are more intense in summer than in winter. If we define the hyporheic zone as the extedn to which the water fluxes from the river can penetrate, then we see that this zone is wider on the sides as compared to the bottom of the

  2. Study of the mechanical behavior of a 2-D carbon-carbon composite

    NASA Technical Reports Server (NTRS)

    Avery, W. B.; Herakovich, C. T.

    1987-01-01

    The out-of-plane fracture of a 2-D carbon-carbon composite was observed and characterized to gain an understanding of the factors influencing the stress distribution in such a laminate. Finite element analyses of a two-ply carbon-carbon composite under in-plane, out-of-plane, and thermal loading were performed. Under in-plane loading all components of stress were strong functions of geometry. Additionally, large thermal stresses were predicted. Out-of-plane tensile tests revealed that failure was interlaminar, and that cracks propagated along the fiber-matrix interface. An elasticity solution was utilized to analyze an orthotropic fiber in an isotropic matrix under uniform thermal load. The analysis reveals that the stress distributions in a transversely orthotropic fiber are radically different than those predicted assuming the fiber to be transversely isotropic.

  3. 2-D Modeling of the Variability of the Solar Interior for Climate Studies

    NASA Astrophysics Data System (ADS)

    Sofia, S.; Li, L. H.; Spada, F.; Ventura, P.

    2012-07-01

    To establish the possible influence of solar variability on climate, it is necessary to understand the luminosity changes induced by a variable dynamo magnetic field. To accomplish this, we have developed a 2D code of the structure and evolution of the solar interior (based on the 1D YREC code), that includes rotation, magnetic fields of arbitrary configuration, and turbulence, that can be run on very short time scales (down to 1 year), and that represents all global parameters (R, L, Teff) with a relative accuracy of 1 part per million, or better. This paper discusses the motivation for this work, the structure and the physical components of the code, and its application to interpret the results of the SODISM experiment on the PICARD satellite, and of the balloon-borne Solar Disk Sextant (SDS) experiment.

  4. 2D spectroscopy of galaxies with star formation regions. Study of SBS 1533+574

    NASA Astrophysics Data System (ADS)

    Hakopian, S. A.; Balayan, S. K.; Dodonov, S. N.; Movsessian, T. A.

    2006-10-01

    A preliminary analysis is given of 2D spectroscopic data on the galaxy SBS 1533+574(AB) obtained using the multipupil spectrographs on the 2.6-m telescope at the BAO (VAGR) and the 6-m telescope at the SAO (MPFS). The two components of the galaxy are star formation regions in different stages. The component SBS 1533+574B is known to be a BCDG. The plots of the intensity distribution of the radiation in the recombination lines of hydrogen and the forbidden lines of gases with a low degree of ionization obtained here make it possible to compare the basic characteristics of the HII-zones and the surrounding shell. The velocity distribution over the field of the galaxy is indicative of a common rotation of the system and of an intrinsic rotation of the components which is more distinct for component B.

  5. Toward IMRT 2D dose modeling using artificial neural networks: A feasibility study

    SciTech Connect

    Kalantzis, Georgios; Vasquez-Quino, Luis A.; Zalman, Travis; Pratx, Guillem; Lei, Yu

    2011-10-15

    Purpose: To investigate the feasibility of artificial neural networks (ANN) to reconstruct dose maps for intensity modulated radiation treatment (IMRT) fields compared with those of the treatment planning system (TPS). Methods: An artificial feed forward neural network and the back-propagation learning algorithm have been used to replicate dose calculations of IMRT fields obtained from PINNACLE{sup 3} v9.0. The ANN was trained with fluence and dose maps of IMRT fields for 6 MV x-rays, which were obtained from the amorphous silicon (a-Si) electronic portal imaging device of Novalis TX. Those fluence distributions were imported to the TPS and the dose maps were calculated on the horizontal midpoint plane of a water equivalent homogeneous cylindrical virtual phantom. Each exported 2D dose distribution from the TPS was classified into two clusters of high and low dose regions, respectively, based on the K-means algorithm and the Euclidian metric in the fluence-dose domain. The data of each cluster were divided into two sets for the training and validation phase of the ANN, respectively. After the completion of the ANN training phase, 2D dose maps were reconstructed by the ANN and isodose distributions were created. The dose maps reconstructed by ANN were evaluated and compared with the TPS, where the mean absolute deviation of the dose and the {gamma}-index were used. Results: A good agreement between the doses calculated from the TPS and the trained ANN was achieved. In particular, an average relative dosimetric difference of 4.6% and an average {gamma}-index passing rate of 93% were obtained for low dose regions, and a dosimetric difference of 2.3% and an average {gamma}-index passing rate of 97% for high dose region. Conclusions: An artificial neural network has been developed to convert fluence maps to corresponding dose maps. The feasibility and potential of an artificial neural network to replicate complex convolution kernels in the TPS for IMRT dose calculations

  6. Critical Study on 2D Superconducting Fluctuation - in a Weak Coupling Case -

    NASA Astrophysics Data System (ADS)

    Sato, Hisaaki; Kosuge, Yu; Kobayashi, Akito; Matsuura, Tamifusa; Kuroda, Yoshihiro

    2000-07-01

    Effects of the 2D superconducting fluctuation in a weak coupling case on the Cooper pairing susceptibility χ(q, ω) and the single particle Green's function are examined by taking account of the most divergent contributions to those. It is found that the most divergent terms due to vertex corrections to the irreducible parts of χ(0, 0) are renormalized to be comparable to less divergent terms due to the self-enegy corrections, which play main roles eventually. Then, χ(0, 0) diverges as T(-T F/2T)/log|T F/T| at T →0, where T and T F are temperature and the Fermi temperature, respectively, while the pseudogap is developed in the single particle spectra below T c(0) to reach its maximum value Δ(0) e-\\frac1{12} at T=0, where T c(0) and Δ(0) are the transition temperature and the energy gap at T=0 obtained in the mean field approximation, respectively.

  7. Torque Magnetometry and Thermomagnetic Capacity Studies on a 2-d Cr^4+ Antiferromagnet

    NASA Astrophysics Data System (ADS)

    Kaur, Narpinder; Nellutla, Saritha; Jo, Youn-Jung; Balicas, Luis; van Tol, Johan; Dalal, Naresh

    2007-03-01

    We report torque magnetometry and magnetic heat capacity measurements on a rare complex, Cr^IV-Diethylenetriamine diperoxo. The motivation here was to search for a simple spin-gap system that could exhibit a Bose-Einstein type condensation (BEC) of magnons. Our earlier reported magnetization and specific heat (Cp) measurements had indicated that this compound is a 2-d antiferromagnet, with a TN of 2.55 K in zero-field [1]. These magnetization and Cp data have now been augmented by use of additional magnetic fields, and the newly found B-T phase diagram is seen to be clearly parabolic. Torque magnetometry confirmed the Cp data and has enabled measurements close to the T -> 0 K, B ˜ 12.5 T region. Measurements in the dilution fridge are planned to extract the critical exponent (α) from the relation kbTc˜ (Bc-B)^α . We surmise that this system will constitute a simple new model for examining the BEC of magnons in detail. [1] C.M. Ramsey, B. Cage, P. Nguyen, K.A. Abboud, N.S. Dalal, Chem. Mater. 15, 92 (2003).

  8. 2D electrostatic PIC algorithm for laser induced studying plasma in vacuum

    NASA Astrophysics Data System (ADS)

    Álvarez, C. A.; Riascos, H.; Gonzalez, C.

    2016-02-01

    Particle-In-Cell(PIC) method is widely used for simulating plasma kinetic models. A 2D-PIC electrostatic algorithm is implemented for simulating the expansion of a laser- induced plasma plume. For potential and Electric Field calculation, Dirichlet and periodic boundary conditions are used in the X (perpendicular to the ablated material) and Y directions, respectively. Poisson-solver employs FFTW3 library and the five-point Laplacian to compute the electric potential. Electric field calculation is made by central finite differences method. Leap-frog scheme updates particle positions and velocities at each iteration. Plume expansion anlysis is done for the Emission and Post-Emission stages. In the Emission phase (while the laser is turned on), fast electron expansion is observed and ion particles remain near the surface of the ablated material. In the post-emission stage (with the laser turned off) the charge separation produces an electric field that accelerates the ions leading to the formation of a KeV per particle Ion-Front. At the end of the expansion, fastest electrons escape from the simulation space; an almost homogeneous ion-electron distribution is observed, decreasing the electric field value and the Coulomb interactions.

  9. Development of electrokinetic remediation for caesium: A feasibility study of 2D electrode configuration system

    NASA Astrophysics Data System (ADS)

    Syah Putra, Rudy

    2016-02-01

    Agar matrix was artificially contaminated with caesium and subjected to rapid assessment of electrokinetic treatment on the basis of the 2D electrode configuration. The effect of caesium concentration on the process was investigated using different electrode configuration (i.e. rectangular, hexagonal and triangular). During treatment the in situ pH distribution, the current flow, and the potential distribution were monitored. At the end of the treatment, the caesium concentration distribution was measured. The results of these experiments showed that for caesium contamination, pH control is essential in order to create a suitable environment throughout the agar matrix to enable contaminant removal. It was found that the type of electrode configuration used to control the pH affected the rate of caesium accumulation. All of the electrode configurations tested was effective, but the highest caesium extraction was achieved when the hexagonal pattern was used to control the pH. After 72 h of treatment at 50 mA, the concentration of caesium decreased gradually from the second and first layer of agar matrix throughout the cell, suggesting that most of the caesium was concentrated on the cathode part.

  10. Hα Moreton waves observed on December 06, 2006. A 2D case study

    NASA Astrophysics Data System (ADS)

    Francile, C.; Costa, A.; Luoni, M. L.; Elaskar, S.

    2013-04-01

    Context. We present high temporal resolution observations of a Moreton wave event detected with the Hα Solar Telescope for Argentina (HASTA) in the Hα line 656.3 nm, on December 6, 2006. Aims: The aim is to contribute to the discussion about the nature and triggering mechanisms of Moreton wave events. Methods: We describe the HASTA telescope capabilities and the observational techniques. We carried out a detailed analysis to determine the flare onset, the radiant point location, the kinematics of the disturbance and the activation time of two distant filaments. We used a 2D reconstruction of the HASTA and corresponding TRACE observations, together with conventional techniques, to analyze the probable origin of the phenomenon. Results: The kinematic parameters and the probable onset time of the Moreton wave event are determined. A small-scale ejectum and the winking of two remote filaments are analyzed to discuss their relation with the Moreton disturbance. Conclusions: The analysis of the Moreton wave event favors the hypothesis that the phenomenon can be described as the chromospheric imprint of a single fast coronal shock triggered from a single source in association with a coronal mass ejection. Its onset time is concurrent with a Lorentz force peak measured in the photosphere, as stated by other authors. However, the existence of multiple shock waves that were generated almost simultaneously cannot be discarded.

  11. Gyrotactic trapping: A numerical study

    NASA Astrophysics Data System (ADS)

    Ghorai, S.

    2016-04-01

    Gyrotactic trapping is a mechanism proposed by Durham et al. ["Disruption of vertical motility by shear triggers formation of thin Phytoplankton layers," Science 323, 1067-1070 (2009)] to explain the formation of thin phytoplankton layer just below the ocean surface. This mechanism is examined numerically using a rational model based on the generalized Taylor dispersion theory. The crucial role of sedimentation speed in the thin layer formation is demonstrated. The effects of variation in different parameters on the thin layer formation are also investigated.

  12. 2D dry granular free-surface transient flow over complex topography with obstacles. Part II: Numerical predictions of fluid structures and benchmarking

    NASA Astrophysics Data System (ADS)

    Juez, C.; Caviedes-Voullième, D.; Murillo, J.; García-Navarro, P.

    2014-12-01

    Dense granular flows are present in geophysics and in several industrial processes, which has lead to an increasing interest for the knowledge and understanding of the physics which govern their propagation. For this reason, a wide range of laboratory experiments on gravity-driven flows have been carried out during the last two decades. The present work is focused on geomorphological processes and, following previous work, a series of laboratory studies which constitute a further step in mimicking natural phenomena are described and simulated. Three situations are considered with some common properties: a two-dimensional configuration, variable slope of the topography and the presence of obstacles. The setup and measurement technique employed during the development of these experiments are deeply explained in the companion work. The first experiment is based on a single obstacle, the second one is performed against multiple obstacles and the third one studies the influence of a dike on which overtopping occurs. Due to the impact of the flow against the obstacles, fast moving shocks appear, and a variety of secondary waves emerge. In order to delve into the physics of these types of phenomena, a shock-capturing numerical scheme is used to simulate the cases. The suitability of the mathematical models employed in this work has been previously validated. Comparisons between computed and experimental data are presented for the three cases. The computed results show that the numerical tool is able to predict faithfully the overall behavior of this type of complex dense granular flow.

  13. Colloidal 2D-0D Lateral Nanoheterostructures: A Case Study of Site-Selective Growth of CdS Nanodots onto Bi₂Se₃ Nanosheets.

    PubMed

    Xu, Biao; Li, Haoyi; Yang, Hao; Xiang, Wentian; Zhou, Gang; Wu, Yue; Wang, Xun

    2015-06-10

    Two-dimensional (2D) nanoheterostructure (2D NHS) with nanoparticles grown on 2D nanomaterial substrates could potentially enable many novel functionalities. Controlled site-selective growth of nanoparticles on either the lateral or the basal directions of 2D nanomaterial substrates is desirable but extremely challenging. Herein, we demonstrate the rational control of lateral- and basal-selective attachment of CdS nanoparticles onto 2D Bi2Se3 nanosheets through solution phase reactions. The combination of experimental and theoretical efforts elucidate that site-relevant interfacial bonding and kinetic control of molecular precursors play vital roles for site selectivity. Furthermore, the electronic structures revealed from density functional theory calculations explain the superior performance of the lateral 2D NHSs compared to their basal counterpart in prototype photoelectrochemical cells. The present study will inspire the construction of other site-selective 2D NHSs with well-defined structure and unique properties. PMID:26024068

  14. Leonardo da Vinci's drapery studies: characterization of lead white pigments by µ-XRD and 2D scanning XRF

    NASA Astrophysics Data System (ADS)

    Gonzalez, Victor; Calligaro, Thomas; Pichon, Laurent; Wallez, Gilles; Mottin, Bruno

    2015-11-01

    This work focuses on the composition and microstructure of the lead white pigment employed in a set of paintworks, using a combination of µ-XRD and 2D scanning XRF, directly applied on five drapery studies attributed to Leonardo da Vinci (1452-1519) and conserved in the Département des Arts Graphiques, Musée du Louvre and in the Musée des Beaux- Arts de Rennes. Trace elements present in the composition as well as in the lead white highlights were imaged by 2D scanning XRF. Mineral phases were determined in a fully noninvasive way using a special µ-XRD diffractometer. Phase proportions were estimated by Rietveld refinement. The analytical results obtained will contribute to differentiate lead white qualities and to highlight the artist's technique.

  15. A Study of the Failure Mechanism of Planar Non-Persistent Open Joints Using PFC2D

    NASA Astrophysics Data System (ADS)

    Ghazvinian, A.; Sarfarazi, V.; Schubert, W.; Blumel, M.

    2012-09-01

    Particle flow code 2D (PFC2D) was adopted to simulate the shear behavior of rocklike material samples containing planar non-persistent joints. Direct shear loading was conducted to investigate the effect of joint separation on the failure behavior of rock bridges. Initially calibration of PFC was undertaken with respect to the data obtained from experimental laboratory tests to ensure the conformity of the simulated numerical models response. Furthermore, validation of the simulated models were cross checked with the results of direct shear tests performed on non-persistent jointed physical models. Through numerical direct shear tests, the failure process was visually observed, and the failure patterns were found reasonably similar to the experimentally observed trends. The discrete element simulations demonstrated that the macro-scale shear zone resulted from the progressive failure of the tension-induced micro-cracks. The failure pattern was mostly influenced by joint separation, while the shear strength was linked to the failure pattern and failure mechanism. Furthermore, it was observed that the failure zone is relatively narrow and has a symmetrical pattern when rock bridges occupy a low percentage of the total shear surface. This may be due to the high stress interactions between the subsequent joints separated by a rock bridge. In contrast, when rock bridges are occupying sufficient area prohibiting the stress interactions to occur then the rupture of surface is more complex and turns into a shear zone. This zone was observed to be relatively thick with an unsymmetrical pattern. The shear strength of rock bridges is reduced by increasing the joint length as a result of increasing both the stress concentration at tip of the joints and the stress interaction between the joints.

  16. CYP2D6 Metabolism and Patient Outcome in the Austrian Breast and Colorectal Cancer Study Group Trial (ABCSG) 8

    PubMed Central

    Goetz, Matthew P.; Suman, Vera J.; Hoskin, Tanya L.; Gnant, Michael; Filipits, Martin; Safgren, Stephanie L.; Kuffel, Mary; Jakesz, Raimund; Rudas, Margaretha; Greil, Richard; Dietze, Otto; Lang, Alois; Offner, Felix; Reynolds, Carol A.; Weinshilboum, Richard M.; Ames, Matthew M.; Ingle, James N.

    2012-01-01

    Background Controversy exists regarding CYP2D6 genotype and tamoxifen efficacy. Methods A matched case-control study was conducted utilizing the Austrian Breast and Colorectal Cancer Study Group Trial 8 that randomized post-menopausal women with estrogen receptor positive breast cancer to tamoxifen for 5 years (Arm A) or tamoxifen for 2 years followed by anastrozole for 3 years (Arm B). Cases had disease recurrence, contralateral breast cancer, second non-breast cancer, or died. For each case, controls were identified from the same treatment arm of similar age, surgery/radiation, and TNM stage. Genotyping was performed for alleles associated with no (PM; *3, *4, *6); reduced (IM; *10, and *41); and extensive (EM: absence of these alleles) CYP2D6 metabolism. Findings The common CYP2D6 *4 allele was in Hardy Weinberg Equilibrium. In Arm A during the first 5 years of therapy, women with 2 poor alleles (PM/PM: OR=2.45, 95% CI: 1.05–5.73, p=0.04) and women with one poor allele (PM/IM or PM/EM: OR=1.67, 95% CI: 0.95–2.93, p=0.07) had a higher likelihood of an event than women with two extensive alleles (EM/EM). In years 3–5 when patients remained on tamoxifen (Arm A) or switched to anastrozole (Arm B), PM/PM tended towards a higher likelihood of a disease event relative to EM/EM (OR= 2.40, 95% CI: 0.86–6.66, p=0.09) among women on Arm A but not among women on Arm B (OR= 0.28; 95% CI: 0.03–2.30). Conclusion In ABCSG8, the negative effects of reduced CYP2D6 metabolism were observed only during the period of tamoxifen administration, and not after switching to anastrozole. PMID:23213055

  17. Numerical study of Q-ball formation in gravity mediation

    SciTech Connect

    Hiramatsu, Takashi; Kawasaki, Masahiro; Takahashi, Fuminobu E-mail: kawasaki@icrr.u-tokyo.ac.jp

    2010-06-01

    We study Q-ball formation in the expanding universe on 1D, 2D and 3D lattice simulations. We obtain detailed Q-ball charge distributions, and find that the distribution is peaked at Q{sup 3D}{sub peak} ≅ 1.9 × 10{sup −2}(|Φ{sub in}|/m){sup 2}, which is greater than the existing result by about 60%. Based on the numerical simulations, we discuss how the Q-ball formation proceeds. Also we make a comment on possible deviation of the charge distributions from what was conjectured in the past.

  18. Study of the equilibrium vacancy ensemble in aluminum using 1D- and 2D-angular correlation of annihilation radiation

    SciTech Connect

    Fluss, M.J.; Berko, S.; Chakraborty, B.; Hoffmann, K.R.; Lippel, P.; Siegel, R.W.

    1985-03-12

    One- and two-dimensional angular correlation of positron-electron annihilation radiation (1D and 2D-ACAR) data have been obtained between 293 and 903 K for single crystals of aluminum. The peak counting rates vs temperature, which were measured using the 1D-ACAR technique, provide a model independent value for the temperature dependence of the positron trapping probability. Using these results it is possible to strip out the Bloch state contribution from the observed 2D-ACAR surfaces and then compare the resulting defect ACAR surfaces to calculated 2D-ACAR surfaces for positrons annihilating from the Bloch, monovacancy, and divacancy-trapped states. The result of this comparison is that the presence of an increasing equilibrium divacancy population is consistent with the observed temperature dependence of ACAR data at high temperature in Al and that the present results when compared to earlier studies on Al indicate that the ratio of the trapping rates at divacancies and monovacancies is of order two.

  19. The use of FLO2D numerical code in lahar hazard evaluation at Popocatépetl volcano: a 2001-lahar scenario

    NASA Astrophysics Data System (ADS)

    Caballero, L.; Capra, L.

    2014-07-01

    Lahar modelling represents an excellent tool to design hazard maps. It allows the definition of potential inundation zones for different lahar magnitude scenarios and sediment concentrations. Here we present the results obtained for the 2001 syneruptive lahar at Popocatépetl volcano, based on simulations performed with FLO2D software. An accurate delineation of this event is needed since it is one of the possible scenarios considered during a volcanic crisis. One of the main issues for lahar simulation using FLO2D is the calibration of the input hydrograph and rheologic flow properties. Here we verified that geophone data can be properly calibrated by means of peak discharge calculations obtained by superelevation method. Simulation results clearly show the influence of concentration and rheologic properties on lahar depth and distribution. Modifying rheologic properties during lahar simulation strongly affect lahar distribution. More viscous lahars have a more restricted aerial distribution, thicker depths, and resulting velocities are noticeable smaller. FLO2D proved to be a very successful tool to delimitate lahar inundation zones as well as to generate different lahar scenarios not only related to lahar volume or magnitude but also to take into account different sediment concentrations and rheologies widely documented to influence lahar prone areas.

  20. The use of FLO2D numerical code in lahar hazard evaluation at Popocatépetl volcano: a 2001 lahar scenario

    NASA Astrophysics Data System (ADS)

    Caballero, L.; Capra, L.

    2014-12-01

    Lahar modeling represents an excellent tool for designing hazard maps. It allows the definition of potential inundation zones for different lahar magnitude scenarios and sediment concentrations. Here, we present the results obtained for the 2001 syneruptive lahar at Popocatépetl volcano, based on simulations performed with FLO2D software. An accurate delineation of this event is needed, since it is one of the possible scenarios considered if magmatic activity increases its magnitude. One of the main issues for lahar simulation using FLO2D is the calibration of the input hydrograph and rheological flow properties. Here, we verified that geophone data can be properly calibrated by means of peak discharge calculations obtained by the superelevation method. Digital elevation model resolution also resulted as an important factor in defining the reliability of the simulated flows. Simulation results clearly show the influence of sediment concentrations and rheological properties on lahar depth and distribution. Modifying rheological properties during lahar simulation strongly affects lahar distribution. More viscous lahars have a more restricted aerial distribution and thicker depths, and resulting velocities are noticeably smaller. FLO2D proved to be a very successful tool for delimitating lahar inundation zones as well as generating different lahar scenarios not only related to lahar volume or magnitude, but also taking into account different sediment concentrations and rheologies widely documented as influencing lahar-prone areas.

  1. Comparative Variable Temperature Studies of Polyamide II with a Benchtop Fourier Transform and a Miniature Handheld Near-Infrared Spectrometer Using 2D-COS and PCMW-2D Analysis.

    PubMed

    Unger, Miriam; Pfeifer, Frank; Siesler, Heinz W

    2016-07-01

    The main objective of this communication is to compare the performance of a miniaturized handheld near-infrared (NIR) spectrometer with a benchtop Fourier transform near-infrared (FT-NIR) spectrometer. Generally, NIR spectroscopy is an extremely powerful analytical tool to study hydrogen-bonding changes of amide functionalities in solid and liquid materials and therefore variable temperature NIR measurements of polyamide II (PAII) have been selected as a case study. The information content of the measurement data has been further enhanced by exploiting the potential of two-dimensional correlation spectroscopy (2D-COS) and the perturbation correlation moving window two-dimensional (PCMW2D) evaluation technique. The data provide valuable insights not only into the changes of the hydrogen-bonding structure and the recrystallization of the hydrocarbon segments of the investigated PAII but also in their sequential order. Furthermore, it has been demonstrated that the 2D-COS and PCMW2D results derived from the spectra measured with the miniaturized NIR instrument are equivalent to the information extracted from the data obtained with the high-performance FT-NIR instrument. PMID:27287846

  2. 2D numerical modelling of gas temperature in a nanosecond pulsed longitudinal He-SrBr2 discharge excited in a high temperature gas-discharge tube for the high-power strontium laser

    NASA Astrophysics Data System (ADS)

    Chernogorova, T. P.; Temelkov, K. A.; Koleva, N. K.; Vuchkov, N. K.

    2016-05-01

    An active volume scaling in bore and length of a Sr atom laser excited in a nanosecond pulse longitudinal He-SrBr2 discharge is carried out. Considering axial symmetry and uniform power input, a 2D model (r, z) is developed by numerical methods for determination of gas temperature in a new large-volume high-temperature discharge tube with additional incompact ZrO2 insulation in the discharge free zone, in order to find out the optimal thermal mode for achievement of maximal output laser parameters. A 2D model (r, z) of gas temperature is developed by numerical methods for axial symmetry and uniform power input. The model determines gas temperature of nanosecond pulsed longitudinal discharge in helium with small additives of strontium and bromine.

  3. Numerical simulation studies of unsteady low Reynolds number separated flows

    NASA Astrophysics Data System (ADS)

    Tatineni, Mahidhar

    Numerical simulations were used to study unsteady low-Reynolds-number separated flows. The studies were focused on the instability of the separation bubbles, the associated vortex shedding, and the response to imposed disturbances. The simulations were performed for separation bubbles in both low Mach number compressible and incompressible flow regimes. The compressible study consisted of unsteady simulations of flows over the Eppler 387 airfoil and the APEX airfoil. For a sufficiently high Reynolds number the simulations showed that the flow over the airfoils is inherently unsteady, with associated vortex shedding. A Fourier analysis of the unsteady flowfield revealed the presence of a dominant frequency in the flow. The dominant frequency from the numerical solution was found to agree with the most unstable frequency calculated using linear stability theory. The vortex shedding was shown to be caused by the growth of the disturbance waves corresponding to the dominant mode calculated from the linear stability analysis. In order to study the separation bubble and the vortex shedding in detail, a simpler two-dimensional (2-D) and three-dimensional (3-D) incompressible flow over a flat plate was considered. The onset of self excited vortex shedding, and the response of the separation bubble to 2-D and 3-D disturbances was studied in detail through numerical simulations. The incompressible Navier-Stokes equations were solved using a fifth order finite difference scheme for spatial discretization and a fourth order Runge-Kutta scheme for time advancement. A new high-order nonuniform grid finite difference scheme was also developed for the simulations. The incompressible simulation results showed that it was possible to induce vortex shedding by imposing disturbances upstream of the separation bubble. For a sufficiently large freestream velocity gradient the separation bubble was globally unstable, leading to a growth in the size of the separation bubble and the

  4. T2D-Db: An integrated platform to study the molecular basis of Type 2 diabetes

    PubMed Central

    Agrawal, Shipra; Dimitrova, Nevenka; Nathan, Prasanthi; Udayakumar, K; Lakshmi, S Sai; Sriram, S; Manjusha, N; Sengupta, Urmi

    2008-01-01

    Background Type 2 Diabetes Mellitus (T2DM) is a non insulin dependent, complex trait disease that develops due to genetic predisposition and environmental factors. The advanced stage in type 2 diabetes mellitus leads to several micro and macro vascular complications like nephropathy, neuropathy, retinopathy, heart related problems etc. Studies performed on the genetics, biochemistry and molecular biology of this disease to understand the pathophysiology of type 2 diabetes mellitus has led to the generation of a surfeit of data on candidate genes and related aspects. The research is highly progressive towards defining the exact etiology of this disease. Results T2D-Db (Type 2 diabetes Database) is a comprehensive web resource, which provides integrated and curated information on almost all known molecular components involved in the pathogenesis of type 2 diabetes mellitus in the three widely studied mammals namely human, mouse and rat. Information on candidate genes, SNPs (Single Nucleotide Polymorphism) in candidate genes or candidate regions, genome wide association studies (GWA), tissue specific gene expression patterns, EST (Expressed Sequence Tag) data, expression information from microarray data, pathways, protein-protein interactions and disease associated risk factors or complications have been structured in this on line resource. Conclusion Information available in T2D-Db provides an integrated platform for the better molecular level understanding of type 2 diabetes mellitus and its pathogenesis. Importantly, the resource facilitates graphical presentation of the gene/genome wide map of SNP markers and protein-protein interaction networks, besides providing the heat map diagram of the selected gene(s) in an organism across microarray expression experiments from either single or multiple studies. These features aid to the data interpretation in an integrative way. T2D-Db is to our knowledge the first publicly available resource that can cater to the needs of

  5. Experimental and numerical studies on standing surface acoustic wave microfluidics.

    PubMed

    Mao, Zhangming; Xie, Yuliang; Guo, Feng; Ren, Liqiang; Huang, Po-Hsun; Chen, Yuchao; Rufo, Joseph; Costanzo, Francesco; Huang, Tony Jun

    2016-02-01

    Standing surface acoustic waves (SSAW) are commonly used in microfluidics to manipulate cells and other micro/nano particles. However, except for a simple one-dimensional (1D) harmonic standing waves (HSW) model, a practical model that can predict particle behaviour in SSAW microfluidics is still lacking. Herein, we established a two-dimensional (2D) SSAW microfluidic model based on the basic theory in acoustophoresis and our previous modelling strategy to predict the acoustophoresis of microparticles in SSAW microfluidics. This 2D SSAW microfluidic model considers the effects of boundary vibrations, channel materials, and channel dimensions on the acoustic propagation; as an experimental validation, the acoustophoresis of microparticles under continuous flow through narrow channels made of PDMS and silicon was studied. The experimentally observed motion of the microparticles matched well with the numerical predictions, while the 1D HSW model failed to predict many of the experimental observations. Particularly, the 1D HSW model cannot account for particle aggregation on the sidewall in PDMS channels, which is well explained by our 2D SSAW microfluidic model. Our model can be used for device design and optimization in SSAW microfluidics. PMID:26698361

  6. Influence of anthraquinone scaffold on E/Z isomer distribution of two thiosemicarbazone derivatives. 2D NMR and DFT studies

    NASA Astrophysics Data System (ADS)

    Marković, Violeta; Joksović, Milan D.; Marković, Svetlana; Jakovljević, Ivan

    2014-01-01

    A distribution of possible isomeric and tautomeric forms of two tautomerizable anthraquinone-thiosemicarbazones with pronounced cytotoxic potential was investigated using 2D NMR and DFT studies. Conformational analysis of the E and Z isomers of both thiosemicarbazones was performed to find out the most stable conformation for each molecule. It was found that superior stability of E-isomers results from ten-membered intramolecular hydrogen bond between thiosemicarbazone N2H and anthraquinone carbonyl group. This hydrogen bond is stronger than that between thiosemicarbazone N2H and ester oxygen, owing to the large partial negative charge on the anthraquinone oxygen.

  7. Use of pharmacogenetics in bioequivalence studies to reduce sample size: an example with mirtazapine and CYP2D6.

    PubMed

    González-Vacarezza, N; Abad-Santos, F; Carcas-Sansuan, A; Dorado, P; Peñas-Lledó, E; Estévez-Carrizo, F; Llerena, A

    2013-10-01

    In bioequivalence studies, intra-individual variability (CV(w)) is critical in determining sample size. In particular, highly variable drugs may require enrollment of a greater number of subjects. We hypothesize that a strategy to reduce pharmacokinetic CV(w), and hence sample size and costs, would be to include subjects with decreased metabolic enzyme capacity for the drug under study. Therefore, two mirtazapine studies, two-way, two-period crossover design (n=68) were re-analysed to calculate the total CV(w) and the CV(w)s in three different CYP2D6 genotype groups (0, 1 and ≥ 2 active genes). The results showed that a 29.2 or 15.3% sample size reduction would have been possible if the recruitment had been of individuals carrying just 0 or 0 plus 1 CYP2D6 active genes, due to the lower CV(w). This suggests that there may be a role for pharmacogenetics in the design of bioequivalence studies to reduce sample size and costs, thus introducing a new paradigm for the biopharmaceutical evaluation of drug products. PMID:22733239

  8. CYP2D7 Sequence Variation Interferes with TaqMan CYP2D6*15 and *35 Genotyping

    PubMed Central

    Riffel, Amanda K.; Dehghani, Mehdi; Hartshorne, Toinette; Floyd, Kristen C.; Leeder, J. Steven; Rosenblatt, Kevin P.; Gaedigk, Andrea

    2016-01-01

    TaqMan™ genotyping assays are widely used to genotype CYP2D6, which encodes a major drug metabolizing enzyme. Assay design for CYP2D6 can be challenging owing to the presence of two pseudogenes, CYP2D7 and CYP2D8, structural and copy number variation and numerous single nucleotide polymorphisms (SNPs) some of which reflect the wild-type sequence of the CYP2D7 pseudogene. The aim of this study was to identify the mechanism causing false-positive CYP2D6*15 calls and remediate those by redesigning and validating alternative TaqMan genotype assays. Among 13,866 DNA samples genotyped by the CompanionDx® lab on the OpenArray platform, 70 samples were identified as heterozygotes for 137Tins, the key SNP of CYP2D6*15. However, only 15 samples were confirmed when tested with the Luminex xTAG CYP2D6 Kit and sequencing of CYP2D6-specific long range (XL)-PCR products. Genotype and gene resequencing of CYP2D6 and CYP2D7-specific XL-PCR products revealed a CC>GT dinucleotide SNP in exon 1 of CYP2D7 that reverts the sequence to CYP2D6 and allows a TaqMan assay PCR primer to bind. Because CYP2D7 also carries a Tins, a false-positive mutation signal is generated. This CYP2D7 SNP was also responsible for generating false-positive signals for rs769258 (CYP2D6*35) which is also located in exon 1. Although alternative CYP2D6*15 and *35 assays resolved the issue, we discovered a novel CYP2D6*15 subvariant in one sample that carries additional SNPs preventing detection with the alternate assay. The frequency of CYP2D6*15 was 0.1% in this ethnically diverse U.S. population sample. In addition, we also discovered linkage between the CYP2D7 CC>GT dinucleotide SNP and the 77G>A (rs28371696) SNP of CYP2D6*43. The frequency of this tentatively functional allele was 0.2%. Taken together, these findings emphasize that regardless of how careful genotyping assays are designed and evaluated before being commercially marketed, rare or unknown SNPs underneath primer and/or probe regions can impact

  9. CYP2D7 Sequence Variation Interferes with TaqMan CYP2D6 (*) 15 and (*) 35 Genotyping.

    PubMed

    Riffel, Amanda K; Dehghani, Mehdi; Hartshorne, Toinette; Floyd, Kristen C; Leeder, J Steven; Rosenblatt, Kevin P; Gaedigk, Andrea

    2015-01-01

    TaqMan™ genotyping assays are widely used to genotype CYP2D6, which encodes a major drug metabolizing enzyme. Assay design for CYP2D6 can be challenging owing to the presence of two pseudogenes, CYP2D7 and CYP2D8, structural and copy number variation and numerous single nucleotide polymorphisms (SNPs) some of which reflect the wild-type sequence of the CYP2D7 pseudogene. The aim of this study was to identify the mechanism causing false-positive CYP2D6 (*) 15 calls and remediate those by redesigning and validating alternative TaqMan genotype assays. Among 13,866 DNA samples genotyped by the CompanionDx® lab on the OpenArray platform, 70 samples were identified as heterozygotes for 137Tins, the key SNP of CYP2D6 (*) 15. However, only 15 samples were confirmed when tested with the Luminex xTAG CYP2D6 Kit and sequencing of CYP2D6-specific long range (XL)-PCR products. Genotype and gene resequencing of CYP2D6 and CYP2D7-specific XL-PCR products revealed a CC>GT dinucleotide SNP in exon 1 of CYP2D7 that reverts the sequence to CYP2D6 and allows a TaqMan assay PCR primer to bind. Because CYP2D7 also carries a Tins, a false-positive mutation signal is generated. This CYP2D7 SNP was also responsible for generating false-positive signals for rs769258 (CYP2D6 (*) 35) which is also located in exon 1. Although alternative CYP2D6 (*) 15 and (*) 35 assays resolved the issue, we discovered a novel CYP2D6 (*) 15 subvariant in one sample that carries additional SNPs preventing detection with the alternate assay. The frequency of CYP2D6 (*) 15 was 0.1% in this ethnically diverse U.S. population sample. In addition, we also discovered linkage between the CYP2D7 CC>GT dinucleotide SNP and the 77G>A (rs28371696) SNP of CYP2D6 (*) 43. The frequency of this tentatively functional allele was 0.2%. Taken together, these findings emphasize that regardless of how careful genotyping assays are designed and evaluated before being commercially marketed, rare or unknown SNPs underneath primer

  10. Water dynamics in salt solutions studied with ultrafast two-dimensional infrared (2D IR) vibrational echo spectroscopy.

    PubMed

    Fayer, Michael D; Moilanen, David E; Wong, Daryl; Rosenfeld, Daniel E; Fenn, Emily E; Park, Sungnam

    2009-09-15

    with another pulse, the local oscillator. Heterodyne detection provides phase and amplitude information, which are both necessary to perform the two Fourier transforms that take the data from the time domain to a two-dimensional frequency domain spectrum. The time dependence of a series of 2D IR vibrational echo spectra provides direct information on system dynamics. Here, we use two types of 2D IR vibrational echo experiments to examine the influence that charged species have on water hydrogen-bond dynamics. Solutions of NaBr and NaBF(4) are studied. The NaBr solutions are studied as a function of the concentration using vibrational echo measurements of spectral diffusion and polarization-selective IR pump-probe measurements of orientational relaxation. Both types of measurements show the slowing of hydrogen-bond network structural evolution with an increasing salt concentration. NaBF(4) is studied using vibrational echo chemical-exchange spectroscopy. In these experiments, it is possible to directly observe the chemical exchange of water molecules switching their hydrogen-bond partners between BF(4)(-) and other water molecules. The results demonstrate that water interacting with ions has slower hydrogen-bond dynamics than pure water, but the slowing is a factor of 3 or 4 rather than orders of magnitude. PMID:19378969

  11. A plastic scintillator-based 2D thermal neutron mapping system for use in BNCT studies.

    PubMed

    Ghal-Eh, N; Green, S

    2016-06-01

    In this study, a scintillator-based measurement instrument is proposed which is capable of measuring a two-dimensional map of thermal neutrons within a phantom based on the detection of 2.22MeV gamma rays generated via nth+H→D+γ reaction. The proposed instrument locates around a small rectangular water phantom (14cm×15cm×20cm) used in Birmingham BNCT facility. The whole system has been simulated using MCNPX 2.6. The results confirm that the thermal flux peaks somewhere between 2cm and 4cm distance from the system entrance which is in agreement with previous studies. PMID:26986813

  12. Study of the height and density distributions of the 2-D granular system under vertical vibration

    NASA Astrophysics Data System (ADS)

    Pak, Hyuk Kyu; Kim, Kipom; Jun, Yonggun

    1998-03-01

    Melecular dynamic simulations and experiments are used to investigate the pattern formation of the granular materials in a vertically vibrated rigid container. The height and density distributions of the peak of the patterns in two dimensional system are measured using the simulation. The height distribution agrees with the experimental observation. At the peak of height of the pattern the density is observed minimum. From the information of the vertical velocities of the particles, the momentum flux distributions are studied also.

  13. Impacts of Large-Scale Circulation on Convection: A 2-D Cloud Resolving Model Study

    NASA Technical Reports Server (NTRS)

    Li, X; Sui, C.-H.; Lau, K.-M.

    1999-01-01

    Studies of impacts of large-scale circulation on convection, and the roles of convection in heat and water balances over tropical region are fundamentally important for understanding global climate changes. Heat and water budgets over warm pool (SST=29.5 C) and cold pool (SST=26 C) were analyzed based on simulations of the two-dimensional cloud resolving model. Here the sensitivity of heat and water budgets to different sizes of warm and cold pools is examined.

  14. Interactions in two-component liposomes studied by 2D correlation spectroscopy

    NASA Astrophysics Data System (ADS)

    Murawska, Agnieszka; Cieślik-Boczula, Katarzyna; Czarnik-Matusewicz, Bogusława

    2010-06-01

    The effect of dipping amphiphilic ICPANs (1-Alkylaminium, N-[2-[3-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]-1-oxopropoxy]ethyl]-N,N-dimethyl-, bromide) homologues, characterized by varying alkyl chain length ( n = 8, 10, 12, and 16), into large multilamellar vesicles (MLVs) of dipalmitoylphosphatidylcholine (DPPC) was studied. Attenuated total reflectance infrared (ATR-IR) spectroscopy combined with 31P-NMR enabled observing a cut-off effect for the longest homologue. By employing two-dimensional correlation spectroscopy (2DCOS) for monitoring spectral changes induced by the heating process, detailed information about structural changes was obtained. They confirmed the substantial reorganization in the structure of the interfacial region in the ICPAN-C16/DPPC vesicles compared with the shorter homologues, where mainly the alkyl chains experience significant trans-to-gauche reorganization. Absorbance changes around 1400 cm -1 assigned to the symmetric deformation mode δsym ( +N(CH 3) 3) are a good marker of changes in vesicle shape and are sensitive to the percentage of DPPC molecules directly interacting with the surface of the ATR crystal. This study clearly demonstrates the potential of 2DCOS in investigating interactions in two-component liposomes.

  15. Study of the electrical conductivity at finite temperature in 2D Si- MOSFETs

    SciTech Connect

    Limouny, L. Kaaouachi, A. El Tata, O.; Daoudi, E.; Errai, M.; Dlimi, S.; Idrissi, H. El; Zatni, A.

    2014-01-27

    We investigate the low temperature density dependent conductivity of two dimensional electron systems in zero magnetic field for sample Si-15 MOSFETs. The first purpose of this paper is to establish that the knee of the conductivity σ{sub 0} (σ{sub 0} is the T = 0.3 conductivity obtained by linear extrapolation of the curves of σ (T) for different values of electron density, n{sub s}) as a function of the carrier densities n{sub s} for T = 0.3 K, observed by Lai et al. and Limouny et al. in previous work for two different samples, is independent of temperature. The second aim is the determination of the critical density, n{sub c}, of the metal-insulator transition. Many methods are used in this investigation of n{sub c} which have been already used for other samples. The motivation behind this last study is the observation of many values of n{sub c} that have been obtained from different methods and that are slightly different. We will use in this study three methods with the intention to infer which one is more appropriate to obtain n{sub c}.

  16. An experimental study of flow separation over a flat plate with 2D transverse grooves

    NASA Astrophysics Data System (ADS)

    Jones, Emily Michelle

    Nature has long been an inspiration for research in engineering. In particular, the biological surfaces of aquatic swimmers have been studied for their potential as drag reducing surfaces. The hydrodynamic benefit of riblets, or grooves embedded parallel to the flow, which appear on many aquatic biological surfaces, have been well documented and implemented in practical engineering applications. However the skin of dolphins is embedded with grooves that run perpendicular to the flow of water over their bodies. It is theorized that the transverse grooves present on dolphin skin trap vortices between them, creating a partial slip condition over the surface and inducing turbulence augmentation in the boundary layer, thus controlling boundary layer separation over the dolphin's skin. Similarly, sharks are covered with scales that are flexible at the base and capable of bristling, forming grooves running transverse to the flow. It is theorized that the scales bristle when encountering a reversing flow, thereby trapping vortices between the scales and, similarly, delaying boundary layer separation. In an attempt to test this hypothesis and study these affects, a spinning cylinder was used in a water tunnel to induce separation over a flat plate with 2 mm, rectangular transverse grooves and sinusoidal grooves of similar scaling. The results were compared to tripped, turbulent boundary layer separation occurring over a flat plate without grooves using time-resolved particle image velocimetry. The strength of the adverse pressure gradient was varied, and the observed delay in flow separation and other affects upon the boundary layer are discussed.

  17. A study on symmetrization of 2D ACAR positron annihilation data

    NASA Astrophysics Data System (ADS)

    Smedskjaer, L. C.; Legnini, D. G.

    1990-07-01

    The important problem of symmetrization of two-dimensional angular correlation positron annihilation data is discussed in detail. Interest in this problem is motivated by the potential for a substantial improvement of the data quality. The artefacts present in our Anger cameras have been studied experimentally, and form the basis for a quantitative discussion of the symmetrization operation. The main conclusion is that symmetrization of the two-dimensional angular correlation spectra is allowed, if the symmetry center can be defined. It is argued that the center can be defined if the instrumental artefacts are small. Finally, it is shown that it is unlikely that the instrumental artefacts interfere constructively during the symmetrization operation.

  18. Interlayer tunneling studies of highly imbalanced bilayer 2D electron systems at νT= 1

    NASA Astrophysics Data System (ADS)

    Champagne, A. R.; Eisenstein, J. P.; Pfeiffer, L. N.; West, K. W.

    2007-03-01

    When the separation between two parallel 2-dimensional electron systems (2DES) becomes comparable to the average distance between electrons within a single layer, the system can support a quantum Hall state with total filling factor νT=1. This state can be described as a Bose condensate of excitons. Previous studies [1] have shown that close to the νT=1 phase boundary, a small imbalance in the number of electrons in each layer can strengthen the condensate. We report on interlayer tunneling measurements of the effect of large imbalances as a function of the interlayer spacing. We explore the possibility of competing order between the excitonic state and the (1/3, 2/3) fractional states in the individual layers. This work was supported by the NSF and the DOE. [1] I. B. Spielman, et al., Phys. Rev. B 70, 081303 (2004).

  19. Confined liquid crystaline 5CB in 2D Thermodynamic Space - Preliminary Dielectric Relaxation Study

    NASA Astrophysics Data System (ADS)

    Pawlus, S.; Osinska, J.; Rzoska, S. J.; Kralj, S.; Cordoyiannis, G.

    Results of preliminary broadband dielectric spectroscopy studies in a wide range of temperatures and pressures range for a mixture of rod-like liquid crystalline 4-cyano-4-pentylalkylbiphenyl (5CB) and hydrophilic silica spheres (Aerosil 300) are shown. Pretransitional anomaly, observed previously in the bulk 5CB, has been found. Temperature dynamics of the mixture was investigated with via the DC conductivity σ, coupled to the reorientational relaxation. The derivative based analysis of electric conductivity showed a clear non-Arrhenius dynamics and indicated the anomalous increase of the fragility strength coefficient on approaching the isotropic-nematic transition. Pressure investigations of the solidification from the nematic phase showed the increase of the transition temperature on pressuring but with unusual increasing of dT NS /dP coefficient.

  20. Hydrogeological and geophysical study for deeper groundwater resource in quartzitic hard rock ridge region from 2D resistivity data

    NASA Astrophysics Data System (ADS)

    Kumar, Dewashish; Rao, V. Ananda; Sarma, V. S.

    2014-04-01

    Electrical resistivity method is a versatile and economical technique for groundwater prospecting in different geological settings due to wide spectrum of resistivity compared to other geophysical parameters. Exploration and exploitation of groundwater, a vital and precious resource, is a challenging task in hard rock, which exhibits inherent heterogeneity. In the present study, two-dimensional Electrical Resistivity Tomography (2D-ERT) technique using two different arrays, viz., pole-dipole and pole-pole, were deployed to look into high signal strength data in a tectonically disturbed hard rock ridge region for groundwater. Four selected sites were investigated. 2D subsurface resistivity tomography data were collected using Syscal Pro Switch-10 channel system and covered a 2 km long profile in a tough terrain. The hydrogeological interpretation based on resistivity models reveal the water horizons trap within the clayey sand and weathered/fractured quartzite formations. Aquifer resistivity lies between ˜3-35 and 100-200 Ωm. The results of the resistivity models decipher potential aquifer lying between 40 and 88 m depth, nevertheless, it corroborates with the static water level measurements in the area of study. The advantage of using pole-pole in conjunction with the pole-dipole array is well appreciated and proved worth which gives clear insight of the aquifer extent, variability and their dimension from shallow to deeper strata from the hydrogeological perspective in the present geological context.

  1. [Novel methods for studies of testicular development and spermatogenesis: From 2D to 3D culture].

    PubMed

    Zhang, Lian-dong; Li, He-cheng; Zhang, Tong-dian; Wang, Zi-ming

    2016-03-01

    The two-dimensional model of cell culture is an important method in the study of testicular development and spermatogenesis but can not effectively mimic and regulate the testicular microenvironment and the whole process of spermatogenesis due to the lack of relevant cell factors and the disruption of a three-dimensional spatial structure. In the past 20 years, the development and optimization of the in vitro model such as testis organotypic culture and in vivo model such as testis transplantation achieved a transformation from two- to three-dimension. The maintenance and optimization of the testicular niche structure could mimic the testicular microenvironment and cell types including Leydig, Sertoli and germ cells, which showed similar biological behaviors to those in vivo. Besides, the cell suspension or tissue fragment floats in the gas-liquid interface so that the development of somatic and germ cells is well maintained in vitro whilst the feedback linkage between grafted testis tissue and hypothalamus-pituitary of the host rebuilt in the in vitro model provides an endocrinological basis for spermatogenesis, which serves as an effective methodology to better understand the organogenesis and development of the testis as well as testicular function regulation, advancing the concept of treatment of male infertility. Al- though each of the methods may have its limitations, the progress in the processing, freezing, thawing, and transplantation of cells and tissues will surely promote their clinical application and present their value in translational medicine. PMID:27172668

  2. Experimental study on nonmonotonicity of capillary desaturation curves in a 2-D pore-network

    SciTech Connect

    Rodriquez de Castro, Antonio; Shokri, Nima; Karadimitriou, Nikolaos; Oostrom, Martinus; Joekar-Niasar, Vahid

    2015-10-28

    Immiscible displacement in a porous medium is important in many applications such as soil remediation and enhanced oil recovery. When gravitational forces are negligible, two-phase immiscible displacement at the pore level is controlled by capillary and viscous forces whose relative importance is quantified through the dimensionless capillary number Ca and the viscosity ratio M between liquid phases. Depending on the values of Ca and M, capillary fingering, viscous fingering, or stable displacement may be observed resulting in a variety of patterns affecting the phase entrapment. The Capillary Desaturation Curve (CDC), which represents the relationship between the residual oils saturation and Ca, is an important relation to describe the phase entrapment at a given Ca. In the present study, we investigate the CDC as influenced by the viscosity ratio. A comprehensive series of experiments using a high-resolution microscope and state-of-the-art micromodels were conducted. The CDCs were calculated and the effects of Ca and M on phase entrapments were quantified. The results show that CDCs are not necessarily monotonic for all M.

  3. High field and 2D-nmr studies with the aporphine alkaloid glaucine.

    PubMed

    Kerr, K M; Kook, A M; Davis, P J

    1986-01-01

    The aporphine alkaloid glaucine (1) was examined by comparison of the high field (600 MHz) 1H-nmr spectra of 1 vs. racemic 6a,7,7-trideutereoglaucine (4,5), by computer-simulated 1H-nmr spectra at 600 MHz, by using decoupled proton spectra, and two-dimensional COSY and HETCOR experiments with 1 at 500 and 360 MHz, respectively, and using high field (90 MHZ) 13C-nmr of S-(+)-glaucine (1). Emphasis was placed on the resolution of the chemical shifts and coupling constants for the H-4 alpha, H-4 beta, H-5 alpha, H-5 beta, H-6 alpha, H-7 alpha, and H-7 beta alicyclic protons of the molecule, which were previously unassigned. The complete assignment of the alicyclic protons of 1 by 1H-nmr was required for the structural elucidation of deuterated analogs of glaucine, which will be used in microbial transformation studies to determine the stereochemical course of aporphine dehydrogenation by the fungi Fusarium solani (ATCC 12823) and Aspergillus flavipes (ATCC 1030). PMID:3783155

  4. Cannibalism Affects Core Metabolic Processes in Helicoverpa armigera Larvae-A 2D NMR Metabolomics Study.

    PubMed

    Vergara, Fredd; Shino, Amiu; Kikuchi, Jun

    2016-01-01

    Cannibalism is known in many insect species, yet its impact on insect metabolism has not been investigated in detail. This study assessed the effects of cannibalism on the metabolism of fourth-instar larvae of the non-predatory insect Helicoverpa armigera (Lepidotera: Noctuidea). Two groups of larvae were analyzed: one group fed with fourth-instar larvae of H. armigera (cannibal), the other group fed with an artificial plant diet. Water-soluble small organic compounds present in the larvae were analyzed using two-dimensional nuclear magnetic resonance (NMR) and principal component analysis (PCA). Cannibalism negatively affected larval growth. PCA of NMR spectra showed that the metabolic profiles of cannibal and herbivore larvae were statistically different with monomeric sugars, fatty acid- and amino acid-related metabolites as the most variable compounds. Quantitation of ¹H-(13)C HSQC (Heteronuclear Single Quantum Coherence) signals revealed that the concentrations of glucose, glucono-1,5-lactone, glycerol phosphate, glutamine, glycine, leucine, isoleucine, lysine, ornithine, proline, threonine and valine were higher in the herbivore larvae. PMID:27598144

  5. Experimental study on nonmonotonicity of Capillary Desaturation Curves in a 2-D pore network

    NASA Astrophysics Data System (ADS)

    Rodríguez de Castro, Antonio; Shokri, Nima; Karadimitriou, Nikolaos; Oostrom, Mart; Joekar-Niasar, Vahid

    2015-10-01

    Immiscible displacement in porous media is important in many applications such as soil remediation and enhanced oil recovery. When gravitational forces are negligible, two-phase immiscible displacement at the pore level is controlled by capillary and viscous forces whose relative importance is quantified through the dimensionless capillary number Ca and the viscosity ratio M between liquid phases. Depending on the values of Ca and M, capillary fingering, viscous fingering, or stable displacement may be observed resulting in a variety of patterns affecting the phase entrapment. The Capillary Desaturation Curve (CDC), which represents the relationship between the residual oil saturation and Ca, is an important relation to describe the phase entrapment at a given Ca. In the present study, we investigated the CDC as influenced by the viscosity ratio. To do so, we have conducted a comprehensive series of experiments using a high-resolution microscope and state-of-art micromodels to investigate the dynamics and patterns of phase entrapment at different Ca and M. By postprocessing of the experimental high-resolution images, we calculated the CDC and quantified the effects of the Ca and M on the phase entrapment and number of blobs trapped in the micromodel and their size distributions during immiscible two-phase flow. Our results show that CDCs are not necessarily monotonic for all M, and the physical mechanisms causing this nonmonotonic behavior are discussed.

  6. Sea level rise and storm surge effects in a coastal heterogeneous aquifer: a 2D modelling study in northern Germany

    NASA Astrophysics Data System (ADS)

    Yang, Jie; Graf, Thomas; Ptak, Thomas

    2015-03-01

    Climate change will affect coastal groundwater resources due to the mean sea level rise (MSLR) and an increase in storm intensity and frequency. Increasing saltwater intrusion from the subsurface as well as intrusion into aquifers from land-surface storm surges can be expected. We numerically investigate the impacts of MSLR and storm surge events in a 2D cross-sectional aquifer at the North-German coast using the coupled surface-subsurface approach of the HydroGeoSphere model. Aquifer heterogeneity is considered to investigate the influence of heterogeneity on the migration of salt plumes in the aquifer. A 1 m MSLR causes the saltwater/freshwater interface to migrate up to 1250 m landward, and the salinized area of the aquifer to expand up to 2050 m landward. Results from a storm surge simulation show that salt plume fingers develop below the flooded land surface, however, the fate of the salt plumes is highly dependent on the hydraulic conductivity of the subsurface.

  7. Study on the human perception of incipient and overall slippages using a 2D FE fingertip model.

    PubMed

    Zhongkui Wang; Chathuranga, Damith Suresh; Hirai, Shinichi

    2015-08-01

    Slippage on the fingertips is an important phenomenon that occurs constantly in our daily life. However, the mechanism behind the slippage, especially incipient slippage, which appears prior to overall slippage, has not been fully understood. In this paper, a 2D finite element (FE) model of the human fingertip was presented to study how the human fingertip perceives slippages. The 2D geometries of the fingertip were generated based on magnetic resonance (MR) images. The fingertip model consisted of four layers: epidermis, dermis, subcutaneous tissue, and distal phalanx. The microstructures of the intermediate and limiting ridges in between the epidermis and dermis layers were manually constructed to locate four types of mechanoreceptors. Simulations of pushing and sliding motions were implemented, and mechanical measures of the acceleration and strain energy density (SED) were investigated at the locations of the mechanoreceptors. We found that both incipient and overall slippages could be clearly detected using the acceleration signal captured by the FA-I and SA-I receptors. The SED measurement does not provide useful information for the slippage detection. PMID:26737602

  8. Single dose, CYP2D6 genotype-stratified pharmacokinetic study of atomoxetine in children with ADHD.

    PubMed

    Brown, J T; Abdel-Rahman, S M; van Haandel, L; Gaedigk, A; Lin, Y S; Leeder, J S

    2016-06-01

    The effect of CYP2D6 genotype on the dose-exposure relationship for atomoxetine has not been well characterized in children. Children 6-17 years of age diagnosed with attention-deficit hyperactivity disorder (ADHD) were stratified by CYP2D6 genotype into groups with 0 (poor metabolizers [PMs], n = 4), 0.5 (intermediate metabolizers [IMs], n = 3), one (extensive metabolizer [EM]1, n = 8) or two (EM2, n = 8) functional alleles and administered a single 0.5 mg/kg oral dose of atomoxetine (ATX). Plasma and urine samples were collected for 24 (IM, EM1, and EM2) or 72 hours (PMs). Dose-corrected ATX systemic exposure (area under the curve [AUC]0-∞ ) varied 29.6-fold across the study cohort, ranging from 4.4 ± 2.7 μM*h in EM2s to 5.8 ± 1.7 μM*h, 16.3 ± 2.9 μM*h, and 50.2 ± 7.3 μM*h in EM1s, IMs, and PMs, respectively (P < 0.0001). Simulated steady state profiles at the maximum US Food and Drug Administration (FDA)-recommended dose suggest that most patients are unlikely to attain adequate ATX exposures. These data support the need for individualized dosing strategies for more effective use of the medication. PMID:26660002

  9. Towards the Identification of the Keeper Erosion Cause(s): Numerical Simulations of the Plasma and Neutral Gas Using the Global Cathode Model OrCa2D-II

    NASA Technical Reports Server (NTRS)

    Mikellides, Ioannis G.; Katz, Ira; Goebel, Dan M.; Jameson, Kristina K.

    2006-01-01

    Numerical simulations with the time-dependent Orificed Cathode (OrCa2D-II) computer code show that classical enhancements of the plasma resistivity can not account for the elevated electron temperatures and steep plasma potential gradients measured in the plume of a 25-27.5 A discharge hollow cathode. The cathode, which employs a 0.11-in diameter orifice, was operated at 5.5 sccm without an applied magnetic field using two different anode geometries. It is found that anomalous resistivity based on electron-driven instabilities improves the comparison between theory and experiment. It is also estimated that other effects such as the Hall-effect from the self-induced magnetic field, not presently included in OrCa2D-II, may contribute to the constriction of the current density streamlines thus explaining the higher plasma densities observed along the centerline.

  10. Discovery, Characterization, and Functional Study of a Novel MEF2D CAG Repeat in Duck (Anas platyrhynchos).

    PubMed

    Wang, Yushi; Wang, Jiwen; Liu, Hehe; Zhang, Rongping; Zhang, Tao; Gan, Xiang; Huang, Huilan; Chen, Da; Li, Liang

    2016-08-01

    Myocyte enhancer transcription factor 2D (MEF2D) is an important transcription factor for promoting the growth and development of muscle. CAG repeats have been found in the coding sequence (CDS) of avian MEF2D; however, their functions remain unknown and require further investigation. Here, we examined the characteristics and functional role of MEF2D CAG repeat in duck. The full-length CDS of duck MEF2D was cloned for the first time, and a novel CAG repeat was identified and located in exon 9. Sequence analysis indicated that the protein domains of duck MEF2D are highly conserved relative to other vertebrates, whereas MEF2D CAG repeats with variable repeat numbers are specific to avian species. Furthermore, sequencing has revealed polymorphisms in MEF2D CAG repeat at both DNA and mRNA levels. Four MEF2D CAG repeat genotypes and 10 MEF2D cDNA variants with different CAG repeat numbers were detected in two duck populations. A t-test showed that the expanded CAG repeat generated significantly longer transcription products (p < 0.05). Association analysis demonstrated positive correlations between the expansion of the CAG repeat and five muscle-related traits. By using protein structure prediction, we suggested that the polymorphisms of the CAG repeat affect protein structures within protein domains. Taken together, these findings reveal that duck MEF2D CAG repeat is a potential functional element with polymorphisms and may cause differences in MEF2D function between duck and other vertebrate species. PMID:27064738

  11. Numerical study on 3D composite morphing actuators

    NASA Astrophysics Data System (ADS)

    Oishi, Kazuma; Saito, Makoto; Anandan, Nishita; Kadooka, Kevin; Taya, Minoru

    2015-04-01

    There are a number of actuators using the deformation of electroactive polymer (EAP), where fewer papers seem to have focused on the performance of 3D morphing actuators based on the analytical approach, due mainly to their complexity. The present paper introduces a numerical analysis approach on the large scale deformation and motion of a 3D half dome shaped actuator composed of thin soft membrane (passive material) and EAP strip actuators (EAP active coupon with electrodes on both surfaces), where the locations of the active EAP strips is a key parameter. Simulia/Abaqus Static and Implicit analysis code, whose main feature is the high precision contact analysis capability among structures, are used focusing on the whole process of the membrane to touch and wrap around the object. The unidirectional properties of the EAP coupon actuator are used as input data set for the material properties for the simulation and the verification of our numerical model, where the verification is made as compared to the existing 2D solution. The numerical results can demonstrate the whole deformation process of the membrane to wrap around not only smooth shaped objects like a sphere or an egg, but also irregularly shaped objects. A parametric study reveals the proper placement of the EAP coupon actuators, with the modification of the dome shape to induce the relevant large scale deformation. The numerical simulation for the 3D soft actuators shown in this paper could be applied to a wider range of soft 3D morphing actuators.

  12. 2D kinematical study in local luminous compact blue galaxies. Starburst origin in UCM2325+2318

    NASA Astrophysics Data System (ADS)

    Castillo-Morales, A.; Pérez-Gallego, J.; Gallego, J.; Guzmán, R.; Castander, F.; Garland, C.; Gruel, N.; Pisano, D. J.; Muñoz-Mateos, J. C.; Ocaña, F.; Zamorano, J.

    2013-05-01

    Luminous Compact Blue Galaxies (LCBGs) are small, but vigorously star forming galaxies. Their presence at different redshifts denotes their cosmological relevance and implies that local starburst galaxies, when properly selected, are unique laboratories for studying the complex ecosystem of the star formation process over time. We have selected a representative sample of 22 LCBGs from the SDSS and UCM databases which, although small, provides an excellent reference for comparison with current and future surveys of similar starbursts at high-z. We are carrying out a 2D optical spectroscopic study of this LCBG sample, including spatially resolved maps of kinematics, extinction, SFR and metallicity. This will help us to answer questions regarding the nature of these objects. In this poster we show our results on the kinematical study (Pérez-Gallego et al. 2011) which allows us to classify these galaxies into three different classes: rotating disk (RD) 48%, perturbed rotation (PR) 28% and complex kinematics (CK) 24%. We find 5% of objects show evidence of a recent major merger, 10% of a minor merger, and 45% of a companion. This argues in favor of ongoing interactions with close companions as a mechanism for the enhanced star formation activity in these galaxies. We find only 5% of objects with clear evidence of AGN activity, and 27% with kinematics consistent with SN-driven galactic winds. Therefore, a different mechanism may be responsible for quenching the star formation in LCBGs. The detailed analysis of the physical properties for each galaxy in the sample is on progress and we show in this poster the results on UCM2325+2318 as a prototype LCBG. Between the possible mechanisms to explain the starburst activity in this galaxy, our 2D spectroscopic data support the scenario of an on-going interaction with the possibility for clump B to be the dwarf satellite galaxy (Castillo-Morales et al. 2011, Pérez-Gallego et al. 2010).

  13. Conformational studies of [Nphe5]SFTI-1 by means of 2D NMR spectroscopy in conjunction with molecular dynamics calculations

    NASA Astrophysics Data System (ADS)

    Brzozowski, K.; Stawikowski, M.; Ślusarz, R.; Sikorska, E.; Lesner, A.; Łęgowska, A.; Rolka, K.

    2015-11-01

    Trypsin inhibitor SFTI-1 is the smallest and the most potent among BBI inhibitors. It is also an interesting object for SAR studies since it is cyclic 14 amino acid molecule which additionally contains disulfide bridge. We showed that elimination of head-to-tail cycliztion did not influence its activity. Moreover peptoid monomers of Nlys and Nphe introduced in the substrate specificity P1 position of monocyclic SFTI-1 preserved trypsin and chymotripsin inhibitory activity respectively and made P1-P1‧ bond proteolytically stable. These findings motivated us to perform conformational analysis of [Nphe5]SFTI-1 by means of 2D NMR spectroscopy and molecular dynamics calculations. Obtained structure occurred to be in a good agreement with published structures for wild-type SFTI-1, its monocyclic analog with disulfide bridge only as well as one containing Nlys peptoid monomer in P1 position.

  14. Artifacts in time-resolved NUS: A case study of NOE build-up curves from 2D NOESY

    NASA Astrophysics Data System (ADS)

    Dass, Rupashree; Kasprzak, Paweł; Koźmiński, Wiktor; Kazimierczuk, Krzysztof

    2016-04-01

    Multidimensional NMR spectroscopy requires time-consuming sampling of indirect dimensions and so is usually used to study stable samples. However, dynamically changing compounds or their mixtures commonly occur in problems of natural science. Monitoring them requires the use multidimensional NMR in a time-resolved manner - in other words, a series of quick spectra must be acquired at different points in time. Among the many solutions that have been proposed to achieve this goal, time-resolved non-uniform sampling (TR-NUS) is one of the simplest. In a TR-NUS experiment, the signal is sampled using a shuffled random schedule and then divided into overlapping subsets. These subsets are then processed using one of the NUS reconstruction methods, for example compressed sensing (CS). The resulting stack of spectra forms a temporal "pseudo-dimension" that shows the changes caused by the process occurring in the sample. CS enables the use of small subsets of data, which minimizes the averaging of the effects studied. Yet, even within these limited timeframes, the sample undergoes certain changes. In this paper we discuss the effect of varying signal amplitude in a TR-NUS experiment. Our theoretical calculations show that the variations within the subsets lead to t1 -noise, which is dependent on the rate of change of the signal amplitude. We verify these predictions experimentally. As a model case we choose a novel 2D TR-NOESY experiment in which mixing time is varied in parallel with shuffled NUS in the indirect dimension. The experiment, performed on a sample of strychnine, provides a near-continuous NOE build-up curve, whose shape closely reflects the t1 -noise level. 2D TR-NOESY reduces the measurement time compared to the conventional approach and makes it possible to verify the theoretical predictions about signal variations during TR-NUS.

  15. Artifacts in time-resolved NUS: A case study of NOE build-up curves from 2D NOESY.

    PubMed

    Dass, Rupashree; Kasprzak, Paweł; Koźmiński, Wiktor; Kazimierczuk, Krzysztof

    2016-04-01

    Multidimensional NMR spectroscopy requires time-consuming sampling of indirect dimensions and so is usually used to study stable samples. However, dynamically changing compounds or their mixtures commonly occur in problems of natural science. Monitoring them requires the use multidimensional NMR in a time-resolved manner - in other words, a series of quick spectra must be acquired at different points in time. Among the many solutions that have been proposed to achieve this goal, time-resolved non-uniform sampling (TR-NUS) is one of the simplest. In a TR-NUS experiment, the signal is sampled using a shuffled random schedule and then divided into overlapping subsets. These subsets are then processed using one of the NUS reconstruction methods, for example compressed sensing (CS). The resulting stack of spectra forms a temporal "pseudo-dimension" that shows the changes caused by the process occurring in the sample. CS enables the use of small subsets of data, which minimizes the averaging of the effects studied. Yet, even within these limited timeframes, the sample undergoes certain changes. In this paper we discuss the effect of varying signal amplitude in a TR-NUS experiment. Our theoretical calculations show that the variations within the subsets lead to t1-noise, which is dependent on the rate of change of the signal amplitude. We verify these predictions experimentally. As a model case we choose a novel 2D TR-NOESY experiment in which mixing time is varied in parallel with shuffled NUS in the indirect dimension. The experiment, performed on a sample of strychnine, provides a near-continuous NOE build-up curve, whose shape closely reflects the t1-noise level. 2D TR-NOESY reduces the measurement time compared to the conventional approach and makes it possible to verify the theoretical predictions about signal variations during TR-NUS. PMID:26896866

  16. 2D numerical modelling of the gas temperature in a high-temperature high-power strontium atom laser excited by nanosecond pulsed longitudinal discharge in a He-SrBr2 mixture

    NASA Astrophysics Data System (ADS)

    Chernogorova, T. P.; Temelkov, K. A.; Koleva, N. K.; Vuchkov, N. K.

    2014-05-01

    Assuming axial symmetry and a uniform power input, a 2D model (r, z) is developed numerically for determination of the gas temperature in the case of a nanosecond pulsed longitudinal discharge in He-SrBr2 formed in a newly-designed large-volume high-temperature discharge tube with additional incompact ZrO2 insulation in the discharge-free zone, in order to find the optimal thermal mode for achievement of maximal output laser parameters. The model determines the gas temperature of a nanosecond pulsed longitudinal discharge in helium with small additives of strontium and bromine.

  17. Multicomponent, 3-D, and High-Resolution 2-D Seismic Characterization of Gas Hydrate Study Sites in the Gulf of Mexico

    NASA Astrophysics Data System (ADS)

    Haines, S. S.; Hart, P. E.; Ruppel, C. D.; Collett, T. S.; Shedd, W.; Lee, M. W.; Miller, J.

    2012-12-01

    High saturations of gas hydrates have been identified within coarse-grained sediments in the Green Canyon 955 and Walker Ridge 313 lease blocks of the deepwater northern Gulf of Mexico. The thickness, lateral extent, and hydrate saturations in these deposits are constrained by geological and geophysical data and state-of-the-art logging-while-drilling information obtained in multiple boreholes at each site during a 2009 expedition. Presently lacking are multicomponent seismic data that can provide a thorough understanding of the in-situ compressional and shear seismic properties of the hydrate-bearing sediments. Such data may represent an important tool for future characterization of gas hydrate resources. To address this data gap, the U.S. Geological Survey, the U.S. Department of Energy, and the Bureau of Ocean Energy Management will collaborate on a 20-day research expedition to acquire wide-angle ocean bottom seismometer and high-resolution vertical incidence 2-D seismic data at the study sites. In preparation for this mid-2013 expedition, we have analyzed existing industry 3-D seismic data, along with numerically modeled multicomponent data. The 3-D seismic data allow us to identify and rank specific survey targets and can be combined with the numerical modeling results to determine optimal survey line orientation and acquisition parameters. Together, these data also provide a more thorough understanding of the gas hydrate systems at these two sites.

  18. Studying Protein-Protein Binding through T-Jump Induced Dissociation: Transient 2D IR Spectroscopy of Insulin Dimer.

    PubMed

    Zhang, Xin-Xing; Jones, Kevin C; Fitzpatrick, Ann; Peng, Chunte Sam; Feng, Chi-Jui; Baiz, Carlos R; Tokmakoff, Andrei

    2016-06-16

    Insulin homodimer associates through the coupled folding and binding of two partially disordered monomers. We aim to understand this dynamics by observing insulin dimer dissociation initiated with a nanosecond temperature jump using transient two-dimensional infrared spectroscopy (2D IR) of amide I vibrations. With the help of equilibrium FTIR and 2D IR spectra, and through a systematic study of the dependence of dissociation kinetics on temperature and insulin concentration, we are able to decompose and analyze the spectral evolution associated with different secondary structures. We find that the dissociation under all conditions is characterized by two processes whose influence on the kinetics varies with temperature: the unfolding of the β sheet at the dimer interface observed as exponential kinetics between 250 and 1000 μs and nonexponential kinetics between 5 and 150 μs that we attribute to monomer disordering. Microscopic reversibility arguments lead us to conclude that dimer association requires significant conformational changes within the monomer in concert with the folding of the interfacial β sheet. While our data indicates a more complex kinetics, we apply a two-state model to the β-sheet unfolding kinetics to extract thermodynamic parameters and kinetic rate constants. The association rate constant, ka (23 °C) = 8.8 × 10(5) M(-1) s(-1) (pH 0, 20% EtOD), is approximately 3 orders of magnitude slower than the calculated diffusion limited association rate, which is explained by the significant destabilizing effect of ethanol on the dimer state and the highly positive charge of the monomers at this pH. PMID:27203447

  19. Numerical study of rowing hydrofoil performance at low Reynolds numbers

    NASA Astrophysics Data System (ADS)

    Chung, M.-H.

    2008-04-01

    In this paper, the hydrodynamic performance of a 2-D flat-plate hydrofoil in rowing motion is numerically studied by a Cartesian grid method with the cut-cell approach. Adaptive mesh refinement is used to save on the number of mesh cells without harming spatial resolution in critical regions. The rowing kinematics of the hydrofoil is the same for all simulations in this work. The design parameters studied are the reduced frequency of the rowing motion, the heave amplitude, and the time lags of the feathered-to-broadside rotation and the broadside-to-feathered rotation. Results show that larger thrust and efficiency can be attained if the feathered-to-broadside rotation is started right after the beginning of the power stroke and the broadside-to-feathered rotation is finished right before the end of the power stroke. Finally, both the thrust and the efficiency increase with Reynolds number.

  20. 2D numerical simulation of impinging jet to the flat surface by k - ω - overline{{v2 }} - f turbulence model

    NASA Astrophysics Data System (ADS)

    Khalaji, E.; Nazari, M. R.; Seifi, Z.

    2016-01-01

    In this article, the effects of dependent parameters such as inlet Reynolds number (4000 ≤ Re ≤ 20,000), nozzle-plate distance (4 ≤ H/D ≤ 10), plate diameter (18 < D/B < 40 based on other approaches), inlet flow type (fully developed, uniform and pulsed) and thermal boundary condition (constant heat flux and temperature) in confined and unconfined turbulent impinging jet are investigated considering constant inlet fluid (air). The obtained results are compared with other experimental and numerical results found in the literature. This investigation indicates that the k - ω - overline{{v2 }} - f model acquires appropriate performance in terms of thermal and dynamical fluid analysis compared to other turbulence models and experimental results.

  1. 2-D numerical simulations of groundwater flow, heat transfer and 4He transport — implications for the He terrestrial budget and the mantle helium heat imbalance

    NASA Astrophysics Data System (ADS)

    Castro, Maria Clara; Patriarche, Delphine; Goblet, Patrick

    2005-09-01

    Because helium and heat production results from a common source, a continental 4He crustal flux of 4.65 * 10 - 14 mol m - 2 s - 1 has been estimated based on heat flow considerations. In addition, because the observed mantle He / heat flux ratio at the proximity of mid-ocean ridges (6.6 * 10 - 14 mol J - 1 ) is significantly lower than the radiogenic production ratio (1.5 * 10 - 12 mol J - 1 ), the presence of a terrestrial helium-heat imbalance was suggested. The latter could be explained by the presence of a layered mantle in which removal of He is impeded from the lower mantle [R.K. O'Nions, E.R. Oxburgh, Heat and helium in the Earth, Nature 306 (1983) 429-431; E.R. Oxburgh, R.K. O'Nions, Helium loss, tectonics, and the terrestrial heat budget, Science 237 (1987) 1583-1588]. van Keken et al. [P.E. van Keken, C.J. Ballentine, D. Porcelli, A dynamical investigation of the heat and helium imbalance, Earth Planet, Sci. Lett. 188 (2001) 421-434] have recently claimed that the helium-heat imbalance remains a robust observation. Such conclusions, however, were reached under the assumption that a steady-state regime was in place for both tracers and that their transport properties are similar at least in the upper portion of the crust. Here, through 2-D simulations of groundwater flow, heat transfer and 4He transport carried out simultaneously in the Carrizo aquifer and surrounding formations in southwest Texas, we assess the legitimacy of earlier assumptions. Specifically, we show that the driving transport mechanisms for He and heat are of a fundamentally different nature for a high range of permeabilities ( k ≤ 10 - 16 m 2) found in metamorphic and volcanic rocks at all depths in the crust. The assumption that transport properties for these two tracers are similar in the crust is thus unsound. We also show that total 4He / heat flux ratios lower than radiogenic production ratios do not reflect a He deficit in the crust or mantle original reservoir. Instead, they

  2. Loss of Heterozygosity at the CYP2D6 Locus in Breast Cancer: Implications for Germline Pharmacogenetic Studies

    PubMed Central

    Goetz, Matthew P.; Sun, James X.; Suman, Vera J.; Silva, Grace O.; Perou, Charles M.; Nakamura, Yusuke; Cox, Nancy J.; Stephens, Philip J.; Miller, Vincent A.; Ross, Jeffrey S.; Chen, David; Safgren, Stephanie L.; Kuffel, Mary J.; Ames, Matthew M.; Kalari, Krishna R.; Gomez, Henry L.; Gonzalez-Angulo, Ana M.; Burgues, Octavio; Brauch, Hiltrud B.; Ingle, James N.; Ratain, Mark J.; Yelensky, Roman

    2015-01-01

    Background: Controversy exists regarding the impact of CYP2D6 genotype on tamoxifen responsiveness. We examined loss of heterozygosity (LOH) at the CYP2D6 locus and determined its impact on genotyping error when tumor tissue is used as a DNA source. Methods: Genomic tumor data from the adjuvant and metastatic settings (The Cancer Genome Atlas [TCGA] and Foundation Medicine [FM]) were analyzed to characterize the impact of CYP2D6 copy number alterations (CNAs) and LOH on Hardy Weinberg equilibrium (HWE). Additionally, we analyzed CYP2D6 *4 genotype from formalin-fixed paraffin-embedded (FFPE) tumor blocks containing nonmalignant tissue and buccal (germline) samples from patients on the North Central Cancer Treatment Group (NCCTG) 89-30-52 tamoxifen trial. All statistical tests were two-sided. Results: In TCGA samples (n =627), the CYP2D6 LOH rate was similar in estrogen receptor (ER)–positive (41.2%) and ER-negative (35.2%) but lower in HER2-positive tumors (15.1%) (P < .001). In FM ER+ samples (n = 290), similar LOH rates were observed (40.8%). In 190 NCCTG samples, the agreement between CYP2D6 genotypes derived from FFPE tumors and FFPE tumors containing nonmalignant tissue was moderate (weighted Kappa = 0.74; 95% CI = 0.63 to 0.84). Comparing CYP2D6 genotypes derived from buccal cells to FFPE tumor DNA, CYP2D6*4 genotype was discordant in six of 31(19.4%). In contrast, there was no disagreement between CYP2D6 genotypes derived from buccal cells with FFPE tumors containing nonmalignant tissue. Conclusions: LOH at the CYP2D6 locus is common in breast cancer, resulting in potential misclassification of germline CYP2D6 genotypes. Tumor DNA should not be used to determine germline CYP2D6 genotype without sensitive techniques to detect low frequency alleles and quality control procedures appropriate for somatic DNA. PMID:25490892

  3. Numerical Studies of Collisionless Current Layers

    NASA Technical Reports Server (NTRS)

    Quest, Kevin B.

    1993-01-01

    The purpose of this proposal was to investigate collisionless current layers using a variety of analytic and numerical tools. The first year of the contract was dedicated to analytical studies, to the porting and adaption of codes being used in this study, and to the numerical simulation of collisionless current layers. The second year entailed the development of multi-dimensional hybrid algorithms as well as the re-examination of the problem of integro-differential equations that occur in the linear stage of plasma instabilities.

  4. 2D SEDFLUX 1.0C:. an advanced process-response numerical model for the fill of marine sedimentary basins

    NASA Astrophysics Data System (ADS)

    Syvitski, James P. M.; Hutton, Eric W. H.

    2001-07-01

    Numerical simulators of the dynamics of strata formation of continental margins fuse information from the atmosphere, ocean and regional geology. Such models can provide information for areas and times for which actual measurements are not available, or for when purely statistical estimates are not adequate by themselves. SEDFLUX is such a basin-fill model, written in ANSI-standard C, able to simulate the delivery of sediment and their accumulation over time scales of tens of thousands of years. SEDFLUX includes the effects of sea-level fluctuations, river floods, ocean storms, and other relevant environmental factors (climate trends, random catastrophic events), at a time step (daily to yearly) that is sensitive to short-term variations of the seafloor. SEDFLUX combines individual process-response models into one fully interactive model, delivering a multi-sized sediment load onto and across a continental margin, including sediment redistribution by (1) river mouth dynamics, (2) buoyant surface plumes, (3) hyperpycnal flows, (4) ocean storms, (5) slope instabilities, (6) turbidity currents, and (7) debris flows. The model allows for the deposit to compact, to undergo tectonic processes (faults, uplift) and isostatic subsidence from the sediment load. The modeled architecture has a typical vertical resolution of 1-25 cm, and a typical horizontal resolution of between 1 and 100 m.

  5. A comparative study for 2D and 3D computer-aided diagnosis methods for solitary pulmonary nodules.

    PubMed

    Yeh, Chinson; Wang, Jen-Feng; Wu, Ming-Ting; Yen, Chen-Wen; Nagurka, Mark L; Lin, Chen-Liang

    2008-06-01

    Many computer-aided diagnosis (CAD) methods, including 2D and 3D approaches, have been proposed for solitary pulmonary nodules (SPNs). However, the detection and diagnosis of SPNs remain challenging in many clinical circumstances. One goal of this work is to investigate the relative diagnostic accuracy of 2D and 3D methods. An additional goal is to develop a two-stage approach that combines the simplicity of 2D and the accuracy of 3D methods. The experimental results show statistically significant differences between the diagnostic accuracy of 2D and 3D methods. The results also show that with a very minor drop in diagnostic performance the two-stage approach can significantly reduce the number of nodules needed to be processed by the 3D method, streamlining the computational demand. PMID:18313899

  6. A Comparative Study of 2D PCA Face Recognition Method with Other Statistically Based Face Recognition Methods

    NASA Astrophysics Data System (ADS)

    Senthilkumar, R.; Gnanamurthy, R. K.

    2015-07-01

    In this paper, two-dimensional principal component analysis (2D PCA) is compared with other algorithms like 1D PCA, Fisher discriminant analysis (FDA), independent component analysis (ICA) and Kernel PCA (KPCA) which are used for image representation and face recognition. As opposed to PCA, 2D PCA is based on 2D image matrices rather than 1D vectors, so the image matrix does not need to be transformed into a vector prior to feature extraction. Instead, an image covariance matrix is constructed directly using the original image matrices and its Eigen vectors are derived for image feature extraction. To test 2D PCA and evaluate its performance, a series of experiments are performed on three face image databases: ORL, Senthil, and Yale face databases. The recognition rate across all trials higher using 2D PCA than PCA, FDA, ICA and KPCA. The experimental results also indicated that the extraction of image features is computationally more efficient using 2D PCA than PCA.

  7. Performance of 2-D ultrasound shear wave elastography in liver fibrosis detection using magnetic resonance elastography as the reference standard: A pilot study

    PubMed Central

    Song, Pengfei; Mellema, Daniel C.; Sheedy, Shannon P.; Meixner, Duane D.; Karshen, Ryan M.; Urban, Matthew W.; Manduca, Armando; Sanchez, William; Callstrom, Matthew R.; Greenleaf, James F.; Chen, Shigao

    2015-01-01

    Objective To investigate the correlation between 2-D ultrasound shear wave elastography (SWE) and magnetic resonance elastography (MRE) in liver stiffness measurement and the diagnostic performance of 2-D SWE for liver fibrosis when imaging from different intercostal spaces and using MRE as the reference standard. Methods 2-D SWE was performed on 47 patients (22 females and 25 males, age 19–77) using the GE LOGIQ E9 scanner. Each of the 47 patients had same day MRE obtained for clinical purposes. The study was HIPAA-compliant and approved by the institutional review board. Informed consent was obtained from each subject. 2-D SWE measurements were acquired from the 9th, 8th, and 7th intercostal spaces. Correlation with MRE was calculated at each intercostal space and multiple intercostal spaces combined. The performance of 2-D SWE in diagnosing liver fibrosis was evaluated with receiver operating characteristic (ROC) curve analysis using MRE as the standard. Results The highest correlation between 2-D SWE and MRE was from the 8th and 7th intercostal spaces (r = 0.68 – 0.76). The range of the areas under the ROC curve for separating normal or inflamed livers from fibrotic livers using MRE as the clinical reference were 0.84 – 0.92 when using 8th and 7th intercostal spaces individually, and 0.89 –0.9 when combined. Conclusion The results suggest that 2-D SWE and MRE are well correlated when SWE is performed at the 8th and 7th intercostal spaces. The 9th intercostal space is less reliable for diagnosing fibrosis using 2-D SWE. Combining measurements from multiple intercostal spaces does not significantly improve 2-D SWE performance for the detection of fibrosis. PMID:26782164

  8. Molecular docking studies and 2D analyses of DPP-4 inhibitors as candidates in the treatment of diabetes.

    PubMed

    Pantaleão, Simone Queiroz; Maltarollo, Vinicius Gonçalves; Araujo, Sheila Cruz; Gertrudes, Jadson Castro; Honorio, Kathia Maria

    2015-11-01

    Dipeptidyl peptidase-4 (DPP-4) is an important biological target related to the treatment of diabetes as DPP-4 inhibitors can lead to an increase in the insulin levels and a prolonged activity of glucagon-like peptide-1 (GLP-1) and gastric inhibitory polypeptide (GIP), being effective in glycemic control. Thus, this study analyses the main molecular interactions between DPP-4 and a series of bioactive ligands. The methodology used here employed molecular modeling methods, such as HQSAR (Hologram Quantitative Structure-Activity) analyses and molecular docking, with the aim of understanding the main structural features of the compound series that are essential for the biological activity. Analyses of the main interactions in the active site of DPP-4, in particular, the contribution of the hydroxyl coordination between Tyr547 and Ser630 by the water molecule, which is described in the literature as important for the coordinated interactions in the active site, were performed. Significant correlation coefficients of the best 2D model (r(2) = 0.942 and q(2) = 0.836) were obtained, indicating the predictive power of this model for untested compounds. Therefore, the final model constructed in this study, along with the information from the contribution maps, could be useful in the design of novel DPP-4 ligands with improved activity. PMID:26399297

  9. Surfaces of nanomaterials for sustainable energy applications: thin-film 2D-ACAR and PALS studies

    NASA Astrophysics Data System (ADS)

    Barbiellini, B.; Chai, L.; Al-Sawai, W.; Eijt, S. W. H.; Mijnarends, P. E.; Schut, H.; Gao, Y.; Houtepen, A. J.; Ravelli, L.; Egger, W.; van Huis, M. A.; Bansil, A.

    2013-03-01

    Positron (e+) annihilation spectroscopy is one of only a few techniques to probe the surfaces of nanoparticles. We investigated thin films of PbSe colloidal semiconductor nanocrystals (NCs) in the range 2-10 nm as prospective highly efficient absorbers for solar cells. We compare and contrast our findings with previous studies on CdSe NCs. Evidence obtained from our e+ lifetime spectroscopy study using the PLEPS spectrometer shows that 90-95% of the implanted positrons are effectively trapped and confined at the surfaces of these NCs. The remaining 5-10% of the e+ annihilate in the relatively large oleic acid ligands, in fair agreement with the estimated positron stopping power of the PbSe nanoparticle ``core'' relative to the ligand ``shell.'' 2D-ACAR measurements on the same set of films using the low-energy e+ beam POSH showed that the e+ wavefunction at the surfaces of the PbSe NCs is more localized than for the case of CdSe NCs. Comparison with calculated e+ - e- momentum densities indicates a Pb deficiency at the surfaces of the PbSe NCs, which correlates with e+ lifetime and the NCs morphology. Work supported in part by the US Department of Energy.

  10. LOCA hydroloads calculations with multidimensional nonlinear fluid/structure interaction. Volume 2: STEALTH 2D/WHAMSE 2D single-phse fluid and elastic structure studies. Final report. [PWR

    SciTech Connect

    Chang, F.H.; Santee, G.E. Jr.; Mortensen, G.A.; Brockett, G.F.; Gross, M.B.; Silling, S.A.; Belytschko, T.

    1981-03-01

    This report, the second in a series of reports for RP-1065, describes the second step in the stepwise approach for developing the three-dimensional, nonlinear, fluid/structure interaction methodology to assess the hydroloads on a large PWR during the subcooled portions of a hypothetical LOCA. The second step in the methodology considers enhancements and special modifications to the 2D STEALTH-HYDRO computer program and the 2D WHAMSE computer program. The 2D STEALTH-HYDRO enhancements consist of a fluid-fluid coupling control-volume model and an orifice control-volume model. The enhancements to 2D WHAMSE include elimination of the implicit integration routines, material models, and structural elements not required for the hydroloads application. In addition the logic for coupling the 2D STEALTH-HYDRO computer program to the 2D WHAMSE computer program is discussed.

  11. Impact of Nanosize on Supercapacitance: Study of 1D Nanorods and 2D Thin-Films of Nickel Oxide.

    PubMed

    Patil, Ranjit A; Chang, Cheng-Ping; Devan, Rupesh S; Liou, Yung; Ma, Yuan-Ron

    2016-04-20

    We synthesized unique one-dimensional (1D) nanorods and two-dimensional (2D) thin-films of NiO on indium-tin-oxide thin-films using a hot-filament metal-oxide vapor deposition technique. The 1D nanorods have an average width and length of ∼100 and ∼500 nm, respectively, and the densely packed 2D thin-films have an average thickness of ∼500 nm. The 1D nanorods perform as parallel units for charge storing. However, the 2D thin-films act as one single unit for charge storing. The 2D thin-films possess a high specific capacitance of ∼746 F/g compared to 1D nanorods (∼230 F/g) using galvanostatic charge-discharge measurements at a current density of 3 A/g. Because the 1D NiO nanorods provide more plentiful surface areas than those of the 2D thin-films, they are fully active at the first few cycles. However, the capacitance retention of the 1D nanorods decays faster than that of the 2D thin-films. Also, the 1D NiO nanorods suffer from instability due to the fast electrochemical dissolution and high nanocontact resistance. Electrochemical impedance spectroscopy verifies that the low dimensionality of the 1D NiO nanorods induces the unavoidable effects that lead them to have poor supercapacitive performances. On the other hand, the slow electrochemical dissolution and small contact resistance in the 2D NiO thin-films favor to achieve high specific capacitance and great stability. PMID:27028491

  12. Tropical Convective Responses to Microphysical and Radiative Processes: A Sensitivity Study With a 2D Cloud Resolving Model

    NASA Technical Reports Server (NTRS)

    Li, Xiao-Fan; Sui, C.-H.; Lau, K.-M.; Tao, W.-K.

    2004-01-01

    Prognostic cloud schemes are increasingly used in weather and climate models in order to better treat cloud-radiation processes. Simplifications are often made in such schemes for computational efficiency, like the scheme being used in the National Centers for Environment Prediction models that excludes some microphysical processes and precipitation-radiation interaction. In this study, sensitivity tests with a 2D cloud resolving model are carried out to examine effects of the excluded microphysical processes and precipitation-radiation interaction on tropical thermodynamics and cloud properties. The model is integrated for 10 days with the imposed vertical velocity derived from the Tropical Ocean Global Atmosphere Coupled Ocean-Atmosphere Response Experiment. The experiment excluding the depositional growth of snow from cloud ice shows anomalous growth of cloud ice and more than 20% increase of fractional cloud cover, indicating that the lack of the depositional snow growth causes unrealistically large mixing ratio of cloud ice. The experiment excluding the precipitation-radiation interaction displays a significant cooling and drying bias. The analysis of heat and moisture budgets shows that the simulation without the interaction produces more stable upper troposphere and more unstable mid and lower troposphere than does the simulation with the interaction. Thus, the suppressed growth of ice clouds in upper troposphere and stronger radiative cooling in mid and lower troposphere are responsible for the cooling bias, and less evaporation of rain associated with the large-scale subsidence induces the drying in mid and lower troposphere.

  13. Effects of Clostridium difficile Toxin A on the proteome of colonocytes studied by differential 2D electrophoresis.

    PubMed

    Zeiser, Johannes J; Klodmann, Jennifer; Braun, Hans-Peter; Gerhard, Ralf; Just, Ingo; Pich, Andreas

    2011-12-21

    Clostridium difficile is a spore-forming anaerobic pathogen, commonly associated with severe diarrhea or life-threatening pseudomembraneous colitis. Its main virulence factors are the single-chain, multi-domain toxin A (TcdA) and B (TcdB). Their glucosyltransferase domain selectively inactivates Rho proteins leading to a reorganization of the cytoskeleton. To study exclusively glucosyltransferase-dependent molecular effects of TcdA, human colonic cells (Caco-2) were treated with recombinant wild type TcdA and the glucosyltransferase deficient variant of the toxin, TcdA(gd) for 24h. Changes in the protein pattern of the colonic cells were investigated by 2-D DIGE and LCMS/MS methodology combined with detailed proteome mapping. gdTcdA did not induce any detectable significant changes in the protein pattern. Comparing TcdA-treated cells with a control group revealed seven spots of higher and two of lower intensity (p<0.05). Three proteins are involved in the assembly of the cytoskeleton (β-actin, ezrin, and DPYL2) and four are involved in metabolism and/or oxidative stress response (ubiquitin, DHE3, MCCB, FABPL) and two in regulatory processes (FUBP1, AL1A1). These findings correlate well to known effects of TcdA like the reorganization of the cytoskeleton and stress the importance of Rho protein glucosylation for the pathogenic effects of TcdA. PMID:21890007

  14. Study of proton conductivity of a 2D flexible MOF and a 1D coordination polymer at higher temperature.

    PubMed

    Sanda, Suresh; Biswas, Soumava; Konar, Sanjit

    2015-02-16

    We report the proton conduction properties of a 2D flexible MOF and a 1D coordination polymer having the molecular formulas {[Zn(C10H2O8)0.5(C10S2N2H8)]·5H2O]}n (1) and {[Zn(C10H2O8)0.5(C10S2N2H8)]·2H2O]}n (2), respectively. Compounds 1 and 2 show high conductivity values of 2.55 × 10(-7) and 4.39 × 10(-4) S cm(-1) at 80 °C and 95% RH. The conductivity value of compound 1 is in the range of those for previously reported flexible MOFs, and compound 2 shows the highest proton conductivity among the carboxylate-based 1D CPs. The dimensionality and the internal hydrogen bonding connectivity play a vital role in the resultant conductivity. Variable-temperature experiments of both compounds at high humidity reveal that the conductivity values increase with increasing temperature, whereas the variable humidity studies signify the influence of relative humidity on high-temperature proton conductivity. The time-dependent measurements for both compounds demonstrate their ability to retain conductivity up to 10 h. PMID:25594401

  15. Bifurcation structure of the special class of nonstationary regimes emerging in the 2D inertially coupled, unit-cell model: Analytical study

    NASA Astrophysics Data System (ADS)

    Vorotnikov, K.; Starosvetsky, Y.

    2016-09-01

    Present work is devoted to the analytical investigation of the bifurcation structure of special class of nonstationary low-energy regimes emerging in the locally resonant unit-cell model. System under consideration comprises an outer mass with internal rotator and subject to the 2D, nonlinear local potential. These regimes are characterized by the slow, purely rotational motion of the rotator synchronized with the periodic energy beats between the axial and the lateral vibrations of the outer element. Thus the angular speed of the rotator and the beating frequency of the outer element satisfy the 1:2 resonance condition. In the present study these regimes are referred to as regimes of synchronous nonlinear beats (RSNB). Using the regular muti-scale analysis in the limit of low energy excitation we derive the slow-flow model. To showcase the evolution of RSNBs we used the special Poincaré map technique applied on the slow-flow model. Results of the Poincaré sections unveiled some interesting local bifurcations undergone by these regimes. Further analysis of the slow-flow model enabled us to describe the RSNBs analytically as well as exposed their entire bifurcation structure. The bifurcation analysis has shown the coexistence of several branches of RSNBs corresponding to the regimes of weak and strong, two-dimensional, recurrent energy channeling. We substantiate the results of the analytical study with numerical simulations of the full model and find them to be in the very good agreement.

  16. 2D numerical simulation of impinging jet onto the concave surface by k - w - overline{{v2 }} - f turbulence model

    NASA Astrophysics Data System (ADS)

    Seifi, Zeinab; Nazari, Mohammad Reza; Khalaji, Erfan

    2016-03-01

    In the present article, the characteristics of turbulent jet impinging onto a concave surface is studied using k - w - overline{{v2 }} - f turbulence model. Dependent parameters such as inlet Reynolds number (2960 < Re < 12,000), nozzle-plate distance (4 < H/B < 10), concavity (D/B = 30, 60) of confined and unconfined impinging jet are scrutinized to find out whether this approach would bring any privileges compared to other investigations or not. The obtained results indicate better performance in low nozzle-plate distance in comparison with those mentioned in other literatures. Furthermore, the average Nusselt number of confined impinging jet overtakes unconfined one (similar circumstances) while this trend will decline as relative concavity increases. Moreover, local heat transfer of stagnation area and wall jet goes up and down through nozzle-plate distance enhancement respectively. Finally, the effects of sinusoidal pulsed inlet profile on heat transfer of unconfined impinging jet indicate direct affiliation of amplitude and neutral impact of frequency on Nusselt number distribution.

  17. Study on antibacterial alginate-stabilized copper nanoparticles by FT-IR and 2D-IR correlation spectroscopy

    PubMed Central

    Díaz-Visurraga, Judith; Daza, Carla; Pozo, Claudio; Becerra, Abraham; von Plessing, Carlos; García, Apolinaria

    2012-01-01

    Background The objective of this study was to clarify the intermolecular interaction between antibacterial copper nanoparticles (Cu NPs) and sodium alginate (NaAlg) by Fourier transform infrared spectroscopy (FT-IR) and to process the spectra applying two-dimensional infrared (2D-IR) correlation analysis. To our knowledge, the addition of NaAlg as a stabilizer of copper nanoparticles has not been previously reported. It is expected that the obtained results will provide valuable additional information on: (1) the influence of reducing agent ratio on the formation of copper nanoparticles in order to design functional nanomaterials with increased antibacterial activity, and (2) structural changes related to the incorporation of Cu NPs into the polymer matrix. Methods Cu NPs were prepared by microwave heating using ascorbic acid as reducing agent and NaAlg as stabilizing agent. The characterization of synthesized Cu NPs by ultraviolet visible spectroscopy, transmission electron microscopy (TEM), electron diffraction analysis, X-ray diffraction (XRD), and semiquantitative analysis of the weight percentage composition indicated that the average particle sizes of Cu NPs are about 3–10 nm, they are spherical in shape, and consist of zerovalent Cu and Cu2O. Also, crystallite size and relative particle size of stabilized Cu NPs were calculated by XRD using Scherrer’s formula and FT from the X-ray diffraction data. Thermogravimetric analysis, differential thermal analysis, differential scanning calorimetry (DSC), FT-IR, second-derivative spectra, and 2D-IR correlation analysis were applied to studying the stabilization mechanism of Cu NPs by NaAlg molecules. The minimum inhibitory concentration (MIC) and minimum bactericidal concentration (MBC) of stabilized Cu NPs against five bacterial strains (Staphylococccus aureus ATCC 6538P, Escherichia coli ATCC 25922 and O157: H7, and Salmonella enterica serovar Typhimurium ATCC 13311 and 14028) were evaluated with macrodilution

  18. Revisiting Geschwind's hypothesis on brain lateralisation: a functional MRI study of digit ratio (2D:4D) and sex interaction effects on spatial working memory.

    PubMed

    Kalmady, Sunil Vasu; Agarwal, Sri Mahavir; Shivakumar, Venkataram; Jose, Dania; Venkatasubramanian, Ganesan; Reddy, Y C Janardhan

    2013-01-01

    The Geschwind-Behan-Galaburda (GBG) hypothesis links cerebral lateralisation with prenatal testosterone exposure. Digit ratio measures in adults have been established as potential markers of foetal sex hormonal milieu. The aim of the study was to evaluate the sex-dependent interaction of digit ratio measures and cerebral lateralization as well as their neurohemodynamic correlates using functional MRI (fMRI). Digit ratio measures-ratio of index finger (2D) length to ring finger (4D) length (2D:4D) and difference between 2D:4D of two hands, i.e., right minus left (DR-L)-were calculated using high resolution digital images in 70 right-handed participants (42 men) based on reliable and valid method. fMRI was acquired during the performance of a spatial working memory task in a subset of 25 individuals (14 men), and analysed using Statistical Parametric Mapping 8 (SPM8) and the Laterality Index toolbox for SPM8. Men had significantly less bilateral 2D:4D than women. There was a significant negative correlation between right 2D:4D and 2-Back task accuracy (2BACC) in women. A significant sex-by-right 2D:4D interaction was observed in left parahippocampal gyrus activation. Additionally, sex-by-DR-L interaction was observed in left IPL activation. DR-L showed a significant positive correlation with the whole brain Laterality Index (LI), and LI, in turn, demonstrated a significant negative correlation with 2BACC. Our study observations suggest several novel sex-differential relationships between 2D:4D measures and fMRI activation during spatial working memory task performance. Given the pre-existing background data supporting digit ratio measures as putative indicator of prenatal sex hormonal milieu, our study findings add support to the Geschwind-Behan-Galaburda (GBG) hypothesis. PMID:23458090

  19. A Numerical Study of Boson Star Binaries

    NASA Astrophysics Data System (ADS)

    Mundim, Bruno C.

    2010-02-01

    This thesis describes a numerical study of binary boson stars within the context of an approximation to general relativity. The approximation we adopt places certain restrictions on the dynamical variables of general relativity (conformal flatness of the 3-metric), and on the time-slicing of the spacetime (maximal slicing). The resulting modeling problem requires the solution of a coupled nonlinear system of 4 hyperbolic, and 5 elliptic partial differential equations (PDEs) in three space dimensions and time. We approximately solve this system as an initial-boundary value problem, using finite difference techniques and well known, computationally efficient numerical algorithms such as the multigrid method in the case of the elliptic equations. Careful attention is paid to the issue of code validation, and a key part of the thesis is the demonstration that, as the basic scale of finite difference discretization is reduced, our numerical code generates results that converge to a solution of the continuum system of PDEs as desired. The thesis concludes with a discussion of results from some initial explorations of the orbital dynamics of boson star binaries. In particular, we describe calculations in which motion of such a binary is followed for more than two orbital periods, which is a significant advance over previous studies. We also present results from computations in which the boson stars merge, and where there is evidence for black hole formation.

  20. Numerical and Experimental Study of Levee Breach

    NASA Astrophysics Data System (ADS)

    Elalfy, E. Y.; LaRocque, L.; Riahi-Nezhad, C. K.; Chaudhry, H.

    2014-12-01

    Levees are constructed along rivers and channels for flood protection. Failure of these levees can cause loss of life and property damage. A better understanding of the flow field from a levee breach allows the decision maker to assess risks and to prepare emergency plans. For this purpose, a two-dimensional numerical model is developed to simulate the levee breach. The model solves the shallow-water equations using the MacCormack explicit, finite- difference two-step, predictor-corrector scheme. The scheme is second-order accurate in time and space. The artificial viscosity technique is used to smooth the high-frequency oscillations in the computed results. The numerical results compare satisfactorily with the experimental results. A parametric study is carried-out to investigate the effect of main channel width, breach width on the computed flow field.

  1. Numerical study of flow turning phenomenon

    NASA Astrophysics Data System (ADS)

    Baum, J. D.; Levine, J. N.

    1986-01-01

    A research project is currently being conducted that is to provide an understanding of the physical mechanisms by which energy is exchanged between the mean and acoustic flowfields in resonant combustion chambers, giving particular attention to solid rocket motors. The present paper is concerned with progress which has been made toward the understanding of the 'flow turning' phenomenon. This term is used to describe the loss of acoustic energy by the acoustic field in the combustor resulting from the inflow of combustion products through the lateral boundary of a combustion chamber containing longitudinal acoustic waves. Attention is given to the modeling of flow turning, acoustic refraction, the numerical solution, numerical results, acoustic wave propagation with no mean flow, and a flow turning study. The discussed research verifies the existence of the flow turning loss phenomenon.

  2. A Numerical Study of Feathering Instability

    NASA Astrophysics Data System (ADS)

    Lee, Wing-Kit; Wang, Hsiang-Hsu

    2016-06-01

    The stability of a spiral shock of self-gravitating, magnetized interstellar medium is studied by performing two-dimensional numerical simulations of a local patch of tight-winding spiral arm. As previously suggested by the linear studies, two types of instabilities are identified, namely, wiggle instability and feathering instability. The former instability occurs in the hydrodynamics limit and results in short wavelength perturbations. On the other hand, the feathering instability requires both self-gravitating and magnetic fields and results in wider structures.

  3. Experimental and Numerical Studies of Oceanic Overflow

    NASA Astrophysics Data System (ADS)

    Gibson, Thomas; Hohman, Fred; Morrison, Theresa; Reckinger, Shanon; Reckinger, Scott

    2014-11-01

    Oceanic overflows occur when dense water flows down a continental slope into less dense ambient water. The resulting density driven plumes occur naturally in various regions of the global ocean and affect the large-scale circulation. General circulation models currently rely on parameterizations for representing dense overflows due to resolution restrictions. The work presented here involves a direct qualitative and quantitative comparison between physical laboratory experiments and lab-scale numerical simulations. Laboratory experiments are conducted using a rotating square tank customized for idealized overflow and a high-resolution camera mounted on the table in the rotating reference frame for data collection. Corresponding numerical simulations are performed using the MIT general circulation model (MITgcm) run in the non-hydrostatic configuration. Resolution and numerical parameter studies are presented to ensure accuracy of the simulation. Laboratory and computational experiments are compared across a wide range of physical parameters, including Coriolis parameter, inflow density anomaly, and dense inflow volumetric flow rate. The results are analyzed using various calculated metrics, such as the plume velocity. Funding for this project is provided by the National Science Foundation.

  4. Study on molecular structure and hydration mechanism of Domyoji-ko starch by IR and NIR hetero 2D analysis

    NASA Astrophysics Data System (ADS)

    Katayama, Norihisa; Kondo, Miyuki; Miyazawa, Mitsuhiro

    2010-06-01

    The hydration structure of starch molecule in Domyoji-ko, which is made from gluey rice, was investigated by hetero 2D correlation analysis of IR and NIR spectroscopy. The feature near 1020 cm -1 in the IR spectra of Domyoji-ko is changed by rehydration process, indicating that the molecular structure of amylopectin in the starch has been varied by the hydration without heating. The intensity of a band at 4770 cm -1 in NIR spectra is decreasing with the increasing of either the heating time with water or rehydration time without heating. These results suggest that the hydration of Domyoji-ko has proceeded in similar mechanisms on these processes. The generalized hetero 2D IR-NIR correlation analysis for rehydration of Domyoji-ko has supported the assignments for NIR bands concerning the gelatinization of starch.

  5. Study of colloidal quantum dot surfaces using an innovative thin-film positron 2D-ACAR method

    NASA Astrophysics Data System (ADS)

    Barbiellini, B.; Bansil, A.; Eijt, S. W. H.; Schut, H.; Mijnarends, P. E.; Denison, A. B.

    2006-03-01

    Despite a wealth of information, many fundamental questions regarding the nature of the surface of nanosized inorganic particles and its relationship with the electronic structure remain unsolved. We have investigated the electron momentum density (EMD) of colloidal CdSe quantum-dots via depth-resolved positron 2D angular correlation of annihilation (2D-ACAR) spectroscopy at the Delft intense variable-energy positron beam. This method, in combination with first-principles calculations of the EMD, shows that implanted positrons are trapped at the surface of CdSe nanocrystals. They annihilate mostly with the Se electrons and monitor changes in composition and structure of the surface while hardly sensing the ligand molecules. We thus unambiguously confirm [1] the strong surface relaxation predicted by first-principles calculations [2]. Work supported by the USDOE.[1] S.W.H. Eijt et al., Nature Materials (in press).[2] A. Puzder, et al., Phys. Rev. Lett. 92, 217401 (2004).

  6. Theoretical Study of Large-Angle Bending Transport of Microparticles by 2D Acoustic Half-Bessel Beams

    PubMed Central

    Li, Yixiang; Qiu, Chunyin; Xu, Shengjun; Ke, Manzhu; Liu, Zhengyou

    2015-01-01

    Conventional microparticle transports by light or sound are realized along a straight line. Recently, this limit has been overcome in optics as the growing up of the self-accelerating Airy beams, which are featured by many peculiar properties, e.g., bending propagation, diffraction-free and self-healing. However, the bending angles of Airy beams are rather small since they are only paraxial solutions of the two-dimensional (2D) Helmholtz equation. Here we propose a novel micromanipulation by using acoustic Half-Bessel beams, which are strict solutions of the 2D Helmholtz equation. Compared with that achieved by Airy beams, the bending angle of the particle trajectory attained here is much steeper (exceeding 90o). The large-angle bending transport of microparticles, which is robust to complex scattering environment, enables a wide range of applications from the colloidal to biological sciences. PMID:26279478

  7. Theoretical Study of Large-Angle Bending Transport of Microparticles by 2D Acoustic Half-Bessel Beams

    NASA Astrophysics Data System (ADS)

    Li, Yixiang; Qiu, Chunyin; Xu, Shengjun; Ke, Manzhu; Liu, Zhengyou

    2015-08-01

    Conventional microparticle transports by light or sound are realized along a straight line. Recently, this limit has been overcome in optics as the growing up of the self-accelerating Airy beams, which are featured by many peculiar properties, e.g., bending propagation, diffraction-free and self-healing. However, the bending angles of Airy beams are rather small since they are only paraxial solutions of the two-dimensional (2D) Helmholtz equation. Here we propose a novel micromanipulation by using acoustic Half-Bessel beams, which are strict solutions of the 2D Helmholtz equation. Compared with that achieved by Airy beams, the bending angle of the particle trajectory attained here is much steeper (exceeding 90o). The large-angle bending transport of microparticles, which is robust to complex scattering environment, enables a wide range of applications from the colloidal to biological sciences.

  8. Theoretical Study of Large-Angle Bending Transport of Microparticles by 2D Acoustic Half-Bessel Beams.

    PubMed

    Li, Yixiang; Qiu, Chunyin; Xu, Shengjun; Ke, Manzhu; Liu, Zhengyou

    2015-01-01

    Conventional microparticle transports by light or sound are realized along a straight line. Recently, this limit has been overcome in optics as the growing up of the self-accelerating Airy beams, which are featured by many peculiar properties, e.g., bending propagation, diffraction-free and self-healing. However, the bending angles of Airy beams are rather small since they are only paraxial solutions of the two-dimensional (2D) Helmholtz equation. Here we propose a novel micromanipulation by using acoustic Half-Bessel beams, which are strict solutions of the 2D Helmholtz equation. Compared with that achieved by Airy beams, the bending angle of the particle trajectory attained here is much steeper (exceeding 90(o)). The large-angle bending transport of microparticles, which is robust to complex scattering environment, enables a wide range of applications from the colloidal to biological sciences. PMID:26279478

  9. 2D ACAR momentum density study of the nature of the positron surface state on Al(100)

    SciTech Connect

    Berko, S.; Canter, K.F.; Lynn, K.G.; Mills, A.P.; Roellig, L.O.; West, R.N.

    1985-01-01

    The two-dimensional angular correlation of the 2..gamma.. annihilation radiation (2D ACAR) has been measured from an Al(100) surface bombarded by 200-eV positrons. After removing the contribution of fast para-positronium annihilation, the spectrum from positrons annihilating at the surface exhibits a nearly isotropic conical shape with a (7.1 +- 0.5) mrad FWHM. 5 refs., 6 figs.

  10. Implementation of 2D domain decomposition in the UCAN gyrokinetic PIC code for non-diffusive transport studies in tokamaks

    NASA Astrophysics Data System (ADS)

    Leboeuf, Jean-Noel; Decyk, Viktor; Newman, David; Sanchez, Raul

    2012-03-01

    The massively parallel, nonlinear, 3D, toroidal, electrostatic, gyrokinetic, PIC, Cartesian geometry UCAN code, with particle ions and adiabatic electrons, has been successfully exercised to identify non-diffusive transport characteristics in DIII-D-like tokamak discharges. The limitation in applying UCAN to larger scale discharges is the 1D domain decomposition in the toroidal (or z-) direction for massively parallel implementation using MPI which has restricted the calculations to a few hundred ion Larmor radii per minor radius. To exceed these sizes, we have implemented 2D domain decomposition in UCAN with the addition of the y-direction to the processor mix. This has been facilitated by use of relevant components in the 2D domain decomposed PLIB2 library of field and particle management routines developed for UCLA's UPIC framework of conventional PIC codes. The gyro-averaging in gyrokinetic codes has necessitated the use of replicated arrays for efficient charge accumulation and particle push. The 2D domain-decomposed UCAN2 code reproduces the original 1D domain results within roundoff. Production calculations at large system sizes have been performed with UCAN2 on 131072 processors of the Cray XE6 at NERSC.

  11. Four divalent transition metal carboxyarylphosphonate compounds: Hydrothermal synthesis, structural chemistry and generalized 2D FTIR correlation spectroscopy studies

    NASA Astrophysics Data System (ADS)

    Lei, Ran; Chai, Xiaochuan; Mei, Hongxin; Zhang, Hanhui; Chen, Yiping; Sun, Yanqiong

    2010-07-01

    Four divalent transition metal carboxyarylphosphonates, [Ni(4,4'-bipy)H 2L 1(HL 1) 2(H 2O) 2]·2H 2O 1, [Ni 2(4,4'-bipy)(L 2)(OH)(H 2O) 2]·3H 2O 2, Mn(phen) 2(H 2L 1) 23 and Mn(phen)(HL 2) 4 (H 3L 1= p-H 2O 3PCH 2-C 6H 4-COOH, H 3L 2= m-H 2O 3PCH 2-C 6H 4-COOH, 4,4'-bipy=4,4'-bipyridine, phen=1,10-phenanthroline) were synthesized under hydrothermal conditions. 1 features 1D linear chains built from Ni(II) ions bridging 4,4'-bipy. In 2, neighboring Ni 4 cluster units are connected by pairs of H 3L 2 ligands to form 1D double-crankshaft chains, which are interconnected by pairs of 4,4'-bipy into 2D sheets. 3 exhibits 2D supramolecular layers via the R 22(8) ringed hydrogen bonding units. 4 has 1D ladderlike chains, in which the 4-membered rings are cross-linked by the organic moieties of the H 3L 2 ligands. Additionally, 2D FTIR correlation analysis is applied with thermal and magnetic perturbation to clarify the structural changes of functional groups from H 3L 1 and H 3L 2 ligands in the compounds more efficiently.

  12. 2D Electrides as Promising Anode Materials for Na-Ion Batteries from First-Principles Study.

    PubMed

    Hu, Junping; Xu, Bo; Yang, Shengyuan A; Guan, Shan; Ouyang, Chuying; Yao, Yugui

    2015-11-01

    Searching for suitable anodes with good performance is a key challenge for rechargeable Na-ion batteries (NIBs). Using the first-principles method, we predict that 2D nitrogen electride materials can be served as anode materials for NIBs. Particularly, we show that Ca2N meets almost all the requirements of a good NIB anode. Each formula unit of a monolayer Ca2N sheet can absorb up to four Na atoms, corresponding to a theoretical specific capacity of 1138 mAh·g(-1). The metallic character for both pristine Ca2N and its Na intercalated state NaxCa2N ensures good electronic conduction. Na diffusion along the 2D monolayer plane can be very fast even at room temperature, with a Na migration energy barrier as small as 0.084 eV. These properties are key to the excellent rate performance of an anode material. The average open-circuit voltage is calculated to be 0.18 V vs Na/Na(+) for the chemical stoichiometry of Na2Ca2N and 0.09 V for Na4Ca2N. The relatively low average open-circuit voltage is beneficial to the overall voltage of the cell. In addition, the 2D monolayers have very small lattice change upon Na intercalation, which ensures a good cycling stability. All these results demonstrate that the Ca2N monolayer could be an excellent anode material for NIBs. PMID:26461467

  13. Numerical Study of Tip Vortex Flows

    NASA Technical Reports Server (NTRS)

    Dacles-Mariani, Jennifer; Hafez, Mohamed

    1998-01-01

    This paper presents an overview and summary of the many different research work related to tip vortex flows and wake/trailing vortices as applied to practical engineering problems. As a literature survey paper, it outlines relevant analytical, theoretical, experimental and computational study found in literature. It also discusses in brief some of the fundamental aspects of the physics and its complexities. An appendix is also included. The topics included in this paper are: 1) Analytical Vortices; 2) Experimental Studies; 3) Computational Studies; 4) Wake Vortex Control and Management; 5) Wake Modeling; 6) High-Lift Systems; 7) Issues in Numerical Studies; 8) Instabilities; 9) Related Topics; 10) Visualization Tools for Vertical Flows; 11) Further Work Needed; 12) Acknowledgements; 13) References; and 14) Appendix.

  14. Numerical Studies of Doped Iron Pnictides

    NASA Astrophysics Data System (ADS)

    Bishop, Christopher; Liang, Shuhua; Moreo, Adriana; Dagotto, Elbio

    The phase diagram of electron-doped pnictides is studied varying the temperature, electronic density, and isotropic disorder strength and dilution via numerical studies of a three-orbital spin-fermion model with lattice degrees of freedom. Doping introduces disorder but in theoretical studies the effect of the randomly located dopants is difficult to address. Numerically the effects of electronic doping, regulated by a chemical potential, and impurity disorder at randomly selected sites can be independently controlled. It was found that the reduction with doping of the Neel and the structural transition temperatures, and the stabilization of a nematic state, is mainly controlled by the magnetic dilution due to the disorder. Fermi surface changes due to doping affect only slightly both critical temperatures. Our findings are compatible with neutron scattering and STM results, unveiling a patchy network of locally magnetically ordered anisotropic clusters, despite the isotropic disorder. The fragile tendency to nematicity intrinsic of translational invariant electronic systems needs to be supplemented by disorder and dilution to stabilize the robust nematic phase experimentally found in electron-doped 122 pnictides. National Science Foundation Grant No. DMR-1404375.

  15. A Numerical Climate Observing Network Design Study

    NASA Technical Reports Server (NTRS)

    Stammer, Detlef

    2003-01-01

    This project was concerned with three related questions of an optimal design of a climate observing system: 1. The spatial sampling characteristics required from an ARGO system. 2. The degree to which surface observations from ARGO can be used to calibrate and test satellite remote sensing observations of sea surface salinity (SSS) as it is anticipated now. 3. The more general design of an climate observing system as it is required in the near future for CLIVAR in the Atlantic. An important question in implementing an observing system is that of the sampling density required to observe climate-related variations in the ocean. For that purpose this project was concerned with the sampling requirements for the ARGO float system, but investigated also other elements of a climate observing system. As part of this project we studied the horizontal and vertical sampling characteristics of a global ARGO system which is required to make it fully complementary to altimeter data with the goal to capture climate related variations on large spatial scales (less thanAttachment: 1000 km). We addressed this question in the framework of a numerical model study in the North Atlantic with an 1/6 horizontal resolution. The advantage of a numerical design study is the knowledge of the full model state. Sampled by a synthetic float array, model results will therefore allow to test and improve existing deployment strategies with the goal to make the system as optimal and cost-efficient as possible. Attachment: "Optimal observations for variational data assimilation".

  16. CYP2D6 function moderates the pharmacokinetics and pharmacodynamics of 3,4-methylene-dioxymethamphetamine in a controlled study in healthy individuals.

    PubMed

    Schmid, Yasmin; Vizeli, Patrick; Hysek, Cédric M; Prestin, Katharina; Meyer Zu Schwabedissen, Henriette E; Liechti, Matthias E

    2016-08-01

    The role of genetic polymorphisms in cytochrome (CYP) 2D6 involved in the metabolism of 3,4-methylene-dioxymethamphetamine (MDMA, ecstasy) is unclear. Effects of genetic variants in CYP2D6 on the pharmacokinetics and pharmacodynamic effects of MDMA were characterized in 139 healthy individuals (70 men, 69 women) in a pooled analysis of eight double-blind, placebo-controlled crossover studies. In CYP2D6 poor metabolizers, the maximum concentrations (Cmax) of MDMA and its active metabolite 3,4-methylene-dioxyamphetamine were +15 and +50% higher, respectively, compared with extensive metabolizers and the Cmax of the inactive metabolite 4-hydroxy-3-methoxymethamphetamine was 50-70% lower. Blood pressure and subjective drug effects increased more rapidly after MDMA administration in poor metabolizers than in extensive metabolizers. In conclusion, the disposition of MDMA and its effects in humans are altered by polymorphic CYP2D6 activity, but the effects are small because of the autoinhibition of CYP2D6. PMID:27253829

  17. 2D heterodyne-detected sum frequency generation study on the ultrafast vibrational dynamics of H{sub 2}O and HOD water at charged interfaces

    SciTech Connect

    Inoue, Ken-ichi; Singh, Prashant C.; Nihonyanagi, Satoshi; Tahara, Tahei; Yamaguchi, Shoichi

    2015-06-07

    Two-dimensional heterodyne-detected vibrational sum-frequency generation (2D HD-VSFG) spectroscopy is applied to study the ultrafast vibrational dynamics of water at positively charged aqueous interfaces, and 2D HD-VSFG spectra of cetyltrimethylammonium bromide (CTAB)/water interfaces in the whole hydrogen-bonded OH stretch region (3000 cm{sup −1} ≤ ω{sub pump} ≤ 3600 cm{sup −1}) are measured. 2D HD-VSFG spectrum of the CTAB/isotopically diluted water (HOD-D{sub 2}O) interface exhibits a diagonally elongated bleaching lobe immediately after excitation, which becomes round with a time constant of ∼0.3 ps due to spectral diffusion. In contrast, 2D HD-VSFG spectrum of the CTAB/H{sub 2}O interface at 0.0 ps clearly shows two diagonal peaks and their cross peaks in the bleaching region, corresponding to the double peaks observed at 3230 cm{sup −1} and 3420 cm{sup −1} in the steady-state HD-VSFG spectrum. Horizontal slices of the 2D spectrum show that the relative intensity of the two peaks of the bleaching at the CTAB/H{sub 2}O interface gradually change with the change of the pump frequency. We simulate the pump-frequency dependence of the bleaching feature using a model that takes account of the Fermi resonance and inhomogeneity of the OH stretch vibration, and the simulated spectra reproduce the essential features of the 2D HD-VSFG spectra of the CTAB/H{sub 2}O interface. The present study demonstrates that heterodyne detection of the time-resolved VSFG is critically important for studying the ultrafast dynamics of water interfaces and for unveiling the underlying mechanism.

  18. Computational Studies of Condensed Matter Systems: Manganese Vanadium Oxide and 2D attractive Hubbard model with spin-dependent disorder

    NASA Astrophysics Data System (ADS)

    Nanguneri, Ravindra

    -dependent disorder. Further, the finite temperature phase diagram for the 2D attractive fermion Hubbard model with spin-dependent disorder is also considered within BdG mean field theory. Three types of disorder are studied. In the first, only one species is coupled to a random site energy; in the second, the two species both move in random site energy landscapes which are of the same amplitude, but different realizations; and finally, in the third, the disorder is in the hopping rather than the site energy. For all three cases we find that, unlike the case of spin-symmetric randomness, where the energy gap and average order parameter do not vanish as the disorder strength increases, a critical disorder strength exists separating distinct phases. In fact, the energy gap and the average order parameter vanish at distinct transitions, Vcgap and Vc op, allowing for a gapless superconducting (gSC) phase. The gSC phase becomes smaller with increasing temperature, until it vanishes at a temperature T*.

  19. Numerical study of a magnesium hydride tank

    NASA Astrophysics Data System (ADS)

    Delhomme, Baptiste; de Rango, Patricia; Marty, Philippe

    2012-11-01

    Hydrogen storage in metal hydride tanks (MHT) is a very promising solution. Several experimental tanks, studied by different teams, have already proved the feasibility and the interesting performances of this solution. However, in much cases, an optimization of tank geometry is still needed in order to perform fast hydrogen loading. The development of efficient numerical tools is a key issue for MHT design and optimization. We propose a simple model representing a metal hydride tank exchanging its heat of reaction with a thermal fluid flow. In this model, the radial and axial discretisations have been decoupled by using Matlab® one-dimensional tools. Calculations are compared to experimental results obtained in a previous study. A good agreement is found for the loading case. The discharging case shows some discrepancies, which are discussed in this paper.

  20. Numerical aerodynamic simulation facility feasibility study

    NASA Technical Reports Server (NTRS)

    1979-01-01

    There were three major issues examined in the feasibility study. First, the ability of the proposed system architecture to support the anticipated workload was evaluated. Second, the throughput of the computational engine (the flow model processor) was studied using real application programs. Third, the availability reliability, and maintainability of the system were modeled. The evaluations were based on the baseline systems. The results show that the implementation of the Numerical Aerodynamic Simulation Facility, in the form considered, would indeed be a feasible project with an acceptable level of risk. The technology required (both hardware and software) either already exists or, in the case of a few parts, is expected to be announced this year. Facets of the work described include the hardware configuration, software, user language, and fault tolerance.

  1. Four divalent transition metal carboxyarylphosphonate compounds: Hydrothermal synthesis, structural chemistry and generalized 2D FTIR correlation spectroscopy studies

    SciTech Connect

    Lei Ran; Chai Xiaochuan; Mei Hongxin; Zhang Hanhui; Chen Yiping; Sun Yanqiong

    2010-07-15

    Four divalent transition metal carboxyarylphosphonates, [Ni(4,4'-bipy)H{sub 2}L{sup 1}(HL{sup 1}){sub 2}(H{sub 2}O){sub 2}].2H{sub 2}O 1, [Ni{sub 2}(4,4'-bipy)(L{sup 2})(OH)(H{sub 2}O){sub 2}].3H{sub 2}O 2, Mn(phen){sub 2}(H{sub 2}L{sup 1}){sub 2}3 and Mn(phen)(HL{sup 2}) 4 (H{sub 3}L{sup 1}=p-H{sub 2}O{sub 3}PCH{sub 2}-C{sub 6}H{sub 4}-COOH, H{sub 3}L{sup 2}=m-H{sub 2}O{sub 3}PCH{sub 2}-C{sub 6}H{sub 4}-COOH, 4,4'-bipy=4,4'-bipyridine, phen=1,10-phenanthroline) were synthesized under hydrothermal conditions. 1 features 1D linear chains built from Ni(II) ions bridging 4,4'-bipy. In 2, neighboring Ni{sub 4} cluster units are connected by pairs of H{sub 3}L{sup 2} ligands to form 1D double-crankshaft chains, which are interconnected by pairs of 4,4'-bipy into 2D sheets. 3 exhibits 2D supramolecular layers via the R{sub 2}{sup 2}(8) ringed hydrogen bonding units. 4 has 1D ladderlike chains, in which the 4-membered rings are cross-linked by the organic moieties of the H{sub 3}L{sup 2} ligands. Additionally, 2D FTIR correlation analysis is applied with thermal and magnetic perturbation to clarify the structural changes of functional groups from H{sub 3}L{sup 1} and H{sub 3}L{sup 2} ligands in the compounds more efficiently. - Graphical abstract: A series of divalent transition metal carboxyarylphosphonate compounds were synthesized under hydrothermal conditions. The figure displays 2D sheet structure with large windows in compound 2.

  2. Comparison of 2D and 3D navigation techniques for percutaneous screw insertion into the scaphoid: results of an experimental cadaver study.

    PubMed

    Catala-Lehnen, Philip; Nüchtern, Jakob V; Briem, Daniel; Klink, Thorsten; Rueger, Johannes M; Lehmann, Wolfgang

    2011-01-01

    Navigation in hand surgery is still in the process of development. Initial studies have demonstrated the feasibility of 2D and 3D navigation for the palmar approach in scaphoid fractures, but a comparison of the possibilities of 2D and 3D navigation for the dorsal approach is still lacking. The aim of the present work was to test navigation for the dorsal approach in the scaphoid using cadaver bones. After development of a special radiolucent resting splint for the dorsal approach, we performed 2D- and 3D-navigated scaphoid osteosynthesis in 12 fresh-frozen cadaver forearms using a headless compression screw (Synthes). The operation time, radiation time, number of trials for screw insertion, and screw positions were analyzed. In six 2D-navigated screw osteosyntheses, we found two false positions with an average radiation time of 5 ± 2 seconds. Using 3D navigation, we detected one false position. A false position indicates divergence from the ideal line of the axis of the scaphoid but without penetration of the cortex. The initial scan clearly increased overall radiation time in the 3D-navigated group, and for both navigation procedures operating time was longer than in our clinical experience without navigation. Nonetheless, 2D and 3D navigation for non-dislocated scaphoid fractures is feasible, and navigation might reduce the risk of choosing an incorrect screw length, thereby possibly avoiding injury to the subtending cortex. The 3D navigation is more difficult to interpret than 2D fluoroscopic navigation but shows greater precision. Overall, navigation is costly, and the moderate advantages it offers for osteosynthesis of scaphoid fractures must be considered critically in comparisons with conventional operating techniques. PMID:21991920

  3. 2D dynamical arrest transition in a mixed nanoparticle-phospholipid layer studied in real and momentum spaces.

    PubMed

    Orsi, Davide; Guzmán, Eduardo; Liggieri, Libero; Ravera, Francesca; Ruta, Beatrice; Chushkin, Yuriy; Rimoldi, Tiziano; Cristofolini, Luigi

    2015-01-01

    We investigate the interfacial dynamics of a 2D self-organized mixed layer made of silica nanoparticles interacting with phospholipid (DPPC) monolayers at the air/water interface. This system has biological relevance, allowing investigation of toxicological effects of nanoparticles on model membranes and lung surfactants. It might also provide bio-inspired technological solutions, exploiting the self-organization of DPPC to produce a non-trivial 2D structuration of nanoparticles. The characterization of interfacial dynamics yields information on the effects of NPs on the mechanical properties, important to improve performances of systems such as colloidosomes, foams, creams. For this, we combine micro-tracking in real-space with measurement in momentum-space via x-ray photon-correlation spectroscopy and Digital Fourier Microscopy. Using these complementary techniques, we extend the spatial range of investigation beyond the limits of each one. We find a dynamical transition from Brownian diffusion to an arrested state driven by compression, characterized by intermittent rearrangements, compatible with a repulsive glass phase. The rearrangement and relaxation of the monolayer structure results dramatically hindered by the presence of NPs, which is relevant to explain some the mechanical features observed for the dynamic surface pressure response of these systems and which can be relevant for the respiratory physiology and for future drug-delivery composite systems. PMID:26658474

  4. Case study: Beauty and the Beast 3D: benefits of 3D viewing for 2D to 3D conversion

    NASA Astrophysics Data System (ADS)

    Handy Turner, Tara

    2010-02-01

    From the earliest stages of the Beauty and the Beast 3D conversion project, the advantages of accurate desk-side 3D viewing was evident. While designing and testing the 2D to 3D conversion process, the engineering team at Walt Disney Animation Studios proposed a 3D viewing configuration that not only allowed artists to "compose" stereoscopic 3D but also improved efficiency by allowing artists to instantly detect which image features were essential to the stereoscopic appeal of a shot and which features had minimal or even negative impact. At a time when few commercial 3D monitors were available and few software packages provided 3D desk-side output, the team designed their own prototype devices and collaborated with vendors to create a "3D composing" workstation. This paper outlines the display technologies explored, final choices made for Beauty and the Beast 3D, wish-lists for future development and a few rules of thumb for composing compelling 2D to 3D conversions.

  5. 2D dynamical arrest transition in a mixed nanoparticle-phospholipid layer studied in real and momentum spaces

    PubMed Central

    Orsi, Davide; Guzmán, Eduardo; Liggieri, Libero; Ravera, Francesca; Ruta, Beatrice; Chushkin, Yuriy; Rimoldi, Tiziano; Cristofolini, Luigi

    2015-01-01

    We investigate the interfacial dynamics of a 2D self-organized mixed layer made of silica nanoparticles interacting with phospholipid (DPPC) monolayers at the air/water interface. This system has biological relevance, allowing investigation of toxicological effects of nanoparticles on model membranes and lung surfactants. It might also provide bio-inspired technological solutions, exploiting the self-organization of DPPC to produce a non-trivial 2D structuration of nanoparticles. The characterization of interfacial dynamics yields information on the effects of NPs on the mechanical properties, important to improve performances of systems such as colloidosomes, foams, creams. For this, we combine micro-tracking in real-space with measurement in momentum-space via x-ray photon-correlation spectroscopy and Digital Fourier Microscopy. Using these complementary techniques, we extend the spatial range of investigation beyond the limits of each one. We find a dynamical transition from Brownian diffusion to an arrested state driven by compression, characterized by intermittent rearrangements, compatible with a repulsive glass phase. The rearrangement and relaxation of the monolayer structure results dramatically hindered by the presence of NPs, which is relevant to explain some the mechanical features observed for the dynamic surface pressure response of these systems and which can be relevant for the respiratory physiology and for future drug-delivery composite systems. PMID:26658474

  6. 2D dynamical arrest transition in a mixed nanoparticle-phospholipid layer studied in real and momentum spaces

    NASA Astrophysics Data System (ADS)

    Orsi, Davide; Guzmán, Eduardo; Liggieri, Libero; Ravera, Francesca; Ruta, Beatrice; Chushkin, Yuriy; Rimoldi, Tiziano; Cristofolini, Luigi

    2015-12-01

    We investigate the interfacial dynamics of a 2D self-organized mixed layer made of silica nanoparticles interacting with phospholipid (DPPC) monolayers at the air/water interface. This system has biological relevance, allowing investigation of toxicological effects of nanoparticles on model membranes and lung surfactants. It might also provide bio-inspired technological solutions, exploiting the self-organization of DPPC to produce a non-trivial 2D structuration of nanoparticles. The characterization of interfacial dynamics yields information on the effects of NPs on the mechanical properties, important to improve performances of systems such as colloidosomes, foams, creams. For this, we combine micro-tracking in real-space with measurement in momentum-space via x-ray photon-correlation spectroscopy and Digital Fourier Microscopy. Using these complementary techniques, we extend the spatial range of investigation beyond the limits of each one. We find a dynamical transition from Brownian diffusion to an arrested state driven by compression, characterized by intermittent rearrangements, compatible with a repulsive glass phase. The rearrangement and relaxation of the monolayer structure results dramatically hindered by the presence of NPs, which is relevant to explain some the mechanical features observed for the dynamic surface pressure response of these systems and which can be relevant for the respiratory physiology and for future drug-delivery composite systems.

  7. Aniso2D

    Energy Science and Technology Software Center (ESTSC)

    2005-07-01

    Aniso2d is a two-dimensional seismic forward modeling code. The earth is parameterized by an X-Z plane in which the seismic properties Can have monoclinic with x-z plane symmetry. The program uses a user define time-domain wavelet to produce synthetic seismograms anrwhere within the two-dimensional media.

  8. A new inversion method for (T2, D) 2D NMR logging and fluid typing

    NASA Astrophysics Data System (ADS)

    Tan, Maojin; Zou, Youlong; Zhou, Cancan

    2013-02-01

    One-dimensional nuclear magnetic resonance (1D NMR) logging technology has some significant limitations in fluid typing. However, not only can two-dimensional nuclear magnetic resonance (2D NMR) provide some accurate porosity parameters, but it can also identify fluids more accurately than 1D NMR. In this paper, based on the relaxation mechanism of (T2, D) 2D NMR in a gradient magnetic field, a hybrid inversion method that combines least-squares-based QR decomposition (LSQR) and truncated singular value decomposition (TSVD) is examined in the 2D NMR inversion of various fluid models. The forward modeling and inversion tests are performed in detail with different acquisition parameters, such as magnetic field gradients (G) and echo spacing (TE) groups. The simulated results are discussed and described in detail, the influence of the above-mentioned observation parameters on the inversion accuracy is investigated and analyzed, and the observation parameters in multi-TE activation are optimized. Furthermore, the hybrid inversion can be applied to quantitatively determine the fluid saturation. To study the effects of noise level on the hybrid method and inversion results, the numerical simulation experiments are performed using different signal-to-noise-ratios (SNRs), and the effect of different SNRs on fluid typing using three fluid models are discussed and analyzed in detail.

  9. Simulation Study of the Robust Closed-Loop Control of a 2D High-Lift Configuration

    NASA Astrophysics Data System (ADS)

    Günther, B.; Carnarius, A.; Thiele, F.; Becker, R.; King, R.

    The investigation focuses on the closed-loop separation control of a two dimensional high-lift configuration in a numerical simulation study. The lift is to be controlled by adjusting the non-dimensional intensity of the harmonic excitation near the leading edge of the single slotted flap. Since control laws based on a high-dimensional discretisation or low-dimensional description of the Navier-Stokes equations are not applicable in real-time, this investigation presents a fast and efficient controller synthesis methodology employing robust methods. This offers real-time capability for future experimental implementations. In spite of the nonlinear and infinite-dimensional Navier-Stokes equations, it is surprising to observe that the dynamic behaviour appears very simple. This input-output behaviour in the vicinity of set points can be empirically approximated by stable linear black-box models of second order. Based on these, a simple robust controller is synthesised that autonomously adjusts the excitation such that a desired lift is obtained.

  10. NUMERICAL STUDY OF THE VISHNIAC INSTABILITY IN SUPERNOVA REMNANTS

    SciTech Connect

    Michaut, C.; Cavet, C.; Bouquet, S. E.; Roy, F.; Nguyen, H. C.

    2012-11-10

    The Vishniac instability is thought to explain the complex structure of radiative supernova remnants in their Pressure-Driven Thin Shell (PDTS) phase after a blast wave (BW) has propagated from a central explosion. In this paper, the propagation of the BW and the evolution of the PDTS stage are studied numerically with the two-dimensional (2D) code HYDRO-MUSCL for a finite-thickness shell expanding in the interstellar medium (ISM). Special attention is paid to the adiabatic index, {gamma}, and three distinct values are taken for the cavity ({gamma}{sub 1}), the shell ({gamma}{sub 2}), and the ISM ({gamma}{sub 3}) with the condition {gamma}{sub 2} < {gamma}{sub 1}, {gamma}{sub 3}. This low value of {gamma}{sub 2} accounts for the high density in the shell achieved by a strong radiative cooling. Once the spherical background flow is obtained, the evolution of a 2D-axisymmetric perturbation is computed from the linear to the nonlinear regime. The overstable mechanism, previously demonstrated theoretically by E. T. Vishniac in 1983, is recovered numerically in the linear stage and is expected to produce and enhance anisotropies and clumps on the shock front, leading to the disruption of the shell in the nonlinear phase. The period of the increasing oscillations and the growth rate of the instability are derived from several points of view (the position of the perturbed shock front, mass fluxes along the shell, and density maps), and the most unstable mode differing from the value given by Vishniac is computed. In addition, the influence of several parameters (the Mach number, amplitude and wavelength of the perturbation, and adiabatic index) is examined and for wavelengths that are large enough compared to the shell thickness, the same conclusion arises: in the late stage of the evolution of the radiative supernova remnant, the instability is dampened and the angular initial deformation of the shock front is smoothed while the mass density becomes uniform with the

  11. Realistic and efficient 2D crack simulation

    NASA Astrophysics Data System (ADS)

    Yadegar, Jacob; Liu, Xiaoqing; Singh, Abhishek

    2010-04-01

    Although numerical algorithms for 2D crack simulation have been studied in Modeling and Simulation (M&S) and computer graphics for decades, realism and computational efficiency are still major challenges. In this paper, we introduce a high-fidelity, scalable, adaptive and efficient/runtime 2D crack/fracture simulation system by applying the mathematically elegant Peano-Cesaro triangular meshing/remeshing technique to model the generation of shards/fragments. The recursive fractal sweep associated with the Peano-Cesaro triangulation provides efficient local multi-resolution refinement to any level-of-detail. The generated binary decomposition tree also provides efficient neighbor retrieval mechanism used for mesh element splitting and merging with minimal memory requirements essential for realistic 2D fragment formation. Upon load impact/contact/penetration, a number of factors including impact angle, impact energy, and material properties are all taken into account to produce the criteria of crack initialization, propagation, and termination leading to realistic fractal-like rubble/fragments formation. The aforementioned parameters are used as variables of probabilistic models of cracks/shards formation, making the proposed solution highly adaptive by allowing machine learning mechanisms learn the optimal values for the variables/parameters based on prior benchmark data generated by off-line physics based simulation solutions that produce accurate fractures/shards though at highly non-real time paste. Crack/fracture simulation has been conducted on various load impacts with different initial locations at various impulse scales. The simulation results demonstrate that the proposed system has the capability to realistically and efficiently simulate 2D crack phenomena (such as window shattering and shards generation) with diverse potentials in military and civil M&S applications such as training and mission planning.

  12. 2D and 3D separate and joint inversion of airborne ZTEM and ground AMT data: Synthetic model studies

    NASA Astrophysics Data System (ADS)

    Sasaki, Yutaka; Yi, Myeong-Jong; Choi, Jihyang

    2014-05-01

    The ZTEM (Z-axis Tipper Electromagnetic) method measures naturally occurring audio-frequency magnetic fields and obtains the tipper function that defines the relationship among the three components of the magnetic field. Since the anomalous tipper responses are caused by the presence of lateral resistivity variations, the ZTEM survey is most suited for detecting and delineating conductive bodies extending to considerable depths, such as graphitic dykes encountered in the exploration of unconformity type uranium deposit. Our simulations shows that inversion of ZTEM data can detect reasonably well multiple conductive dykes placed 1 km apart. One important issue regarding ZTEM inversion is the effect of the initial model, because homogeneous half-space and (1D) layered structures produce no responses. For the 2D model with multiple conductive dykes, the inversion results were useful for locating the dykes even when the initial model was not close to the true background resistivity. For general 3D structures, however, the resolution of the conductive bodies can be reduced considerably depending on the initial model. This is because the tipper magnitudes from 3D conductors are smaller due to boundary charges than the 2D responses. To alleviate this disadvantage of ZTEM surveys, we combined ZTEM and audio-frequency magnetotelluric (AMT) data. Inversion of sparse AMT data was shown to be effective in providing a good initial model for ZTEM inversion. Moreover, simultaneously inverting both data sets led to better results than the sequential approach by enabling to identify structural features that were difficult to resolve from the individual data sets.

  13. Experimental and theoretical study of rotationally inelastic diffraction of H2(D2) from methyl-terminated Si(111).

    PubMed

    Nihill, Kevin J; Hund, Zachary M; Muzas, Alberto; Díaz, Cristina; Del Cueto, Marcos; Frankcombe, Terry; Plymale, Noah T; Lewis, Nathan S; Martín, Fernando; Sibener, S J

    2016-08-28

    Fundamental details concerning the interaction between H2 and CH3-Si(111) have been elucidated by the combination of diffractive scattering experiments and electronic structure and scattering calculations. Rotationally inelastic diffraction (RID) of H2 and D2 from this model hydrocarbon-decorated semiconductor interface has been confirmed for the first time via both time-of-flight and diffraction measurements, with modest j = 0 → 2 RID intensities for H2 compared to the strong RID features observed for D2 over a large range of kinematic scattering conditions along two high-symmetry azimuthal directions. The Debye-Waller model was applied to the thermal attenuation of diffraction peaks, allowing for precise determination of the RID probabilities by accounting for incoherent motion of the CH3-Si(111) surface atoms. The probabilities of rotationally inelastic diffraction of H2 and D2 have been quantitatively evaluated as a function of beam energy and scattering angle, and have been compared with complementary electronic structure and scattering calculations to provide insight into the interaction potential between H2 (D2) and hence the surface charge density distribution. Specifically, a six-dimensional potential energy surface (PES), describing the electronic structure of the H2(D2)/CH3-Si(111) system, has been computed based on interpolation of density functional theory energies. Quantum and classical dynamics simulations have allowed for an assessment of the accuracy of the PES, and subsequently for identification of the features of the PES that serve as classical turning points. A close scrutiny of the PES reveals the highly anisotropic character of the interaction potential at these turning points. This combination of experiment and theory provides new and important details about the interaction of H2 with a hybrid organic-semiconductor interface, which can be used to further investigate energy flow in technologically relevant systems. PMID:27586939

  14. Mesh2d

    SciTech Connect

    Greg Flach, Frank Smith

    2011-12-31

    Mesh2d is a Fortran90 program designed to generate two-dimensional structured grids of the form [x(i),y(i,j)] where [x,y] are grid coordinates identified by indices (i,j). The x(i) coordinates alone can be used to specify a one-dimensional grid. Because the x-coordinates vary only with the i index, a two-dimensional grid is composed in part of straight vertical lines. However, the nominally horizontal y(i,j0) coordinates along index i are permitted to undulate or otherwise vary. Mesh2d also assigns an integer material type to each grid cell, mtyp(i,j), in a user-specified manner. The complete grid is specified through three separate input files defining the x(i), y(i,j), and mtyp(i,j) variations.

  15. Mesh2d

    Energy Science and Technology Software Center (ESTSC)

    2011-12-31

    Mesh2d is a Fortran90 program designed to generate two-dimensional structured grids of the form [x(i),y(i,j)] where [x,y] are grid coordinates identified by indices (i,j). The x(i) coordinates alone can be used to specify a one-dimensional grid. Because the x-coordinates vary only with the i index, a two-dimensional grid is composed in part of straight vertical lines. However, the nominally horizontal y(i,j0) coordinates along index i are permitted to undulate or otherwise vary. Mesh2d also assignsmore » an integer material type to each grid cell, mtyp(i,j), in a user-specified manner. The complete grid is specified through three separate input files defining the x(i), y(i,j), and mtyp(i,j) variations.« less

  16. Vertical 2D Heterostructures

    NASA Astrophysics Data System (ADS)

    Lotsch, Bettina V.

    2015-07-01

    Graphene's legacy has become an integral part of today's condensed matter science and has equipped a whole generation of scientists with an armory of concepts and techniques that open up new perspectives for the postgraphene area. In particular, the judicious combination of 2D building blocks into vertical heterostructures has recently been identified as a promising route to rationally engineer complex multilayer systems and artificial solids with intriguing properties. The present review highlights recent developments in the rapidly emerging field of 2D nanoarchitectonics from a materials chemistry perspective, with a focus on the types of heterostructures available, their assembly strategies, and their emerging properties. This overview is intended to bridge the gap between two major—yet largely disjunct—developments in 2D heterostructures, which are firmly rooted in solid-state chemistry or physics. Although the underlying types of heterostructures differ with respect to their dimensions, layer alignment, and interfacial quality, there is common ground, and future synergies between the various assembly strategies are to be expected.

  17. A numerical study of ENO and TVD schemes for shock capturing

    NASA Technical Reports Server (NTRS)

    Chang, Shih-Hung; Liou, Meng-Sing

    1988-01-01

    The numerical performance of a second-order upwind-based total variation diminishing (TVD) scheme and that of a uniform second-order essentially non-oscillatory (ENO) scheme for shock capturing are compared. The TVD scheme used is a modified version of Liou, using the flux-difference splitting (FDS) of Roe and his superbee function as the limiter. The construction of the basic ENO scheme is based on Harten, Engquist, Osher, and Chakravarthy, and the 2-D extensions are obtained by using a Strang-type of fractional-step time-splitting method. Numerical results presented include both steady and unsteady, 1-D and 2-D calculations. All the chosen test problems have exact solutions so that numerical performance can be measured by comparing the computer results to them. For 1-D calculations, the standard shock-tube problems of Sod and Lax are chosen. A very strong shock-tube problem, with the initial density ratio of 400 to 1 and pressure ratio of 500 to 1, is also used to study the behavior of the two schemes. For 2-D calculations, the shock wave reflection problems are adopted for testing. The cases presented in this report include flows with Mach numbers of 2.9, 5.0, and 10.0.

  18. A numerical study of thin flame representations

    SciTech Connect

    Rotman, D.A.; Pindera, M.Z.

    1989-08-11

    In studies of reacting flows, the flame may be viewed as a moving discontinuity endowed with certain properties; notably, it acts as a source of velocity and vorticity. Asymptotic analysis shows this to be justified provided that the flame curvature is small compared to the flame thickness. Such an approach is useful when one is interested in the hydrodynamic effects of the flame on the surrounding flowfield. In numerical models of this kind it is customary to treat the discontinuity as a collection of discrete velocity blobs. In this study, we show that the velocities associated with such a representation can be very non-smooth, particularly very near to the flame surface. As an alternative, we propose the use of a finite line source as the basic flame element. Comparisons of the two flame representations are made for several simple test cases as well as for a flame propagating through an enclosure forming the tulip shape. The results show that the use of line sources eliminates spurious fluctuations in nearfield velocities thus allowing for a more accurate calculation of flame propagation and flame-flowfield interactions. 7 refs., 15 figs.

  19. SU-E-T-639: A Study On the Response of 2D Array Detector for VMAT Delivery for a Period of Two Years

    SciTech Connect

    Kumar, Syam; George, Anu

    2014-06-15

    Purpose: To evaluate the 2D array for radiation response for a period of 2 years. Methods: 45 VMAT plans already treated and quality assured before 2 years, 1.5 years and 1 year were selected for the study. Quality assurances of the plans were done using 2D array combined with Octavius phantom. Verification plans were recalculated without changing any parameters in Eclipse 10.0 TPS using the AAA algorithm. Response of 2D array to the plans treated before 2 years, 1.5 years and 1 year where evaluated. The results were analyzed using the Gamma analysis method with the standard gamma passing criteria of 3mm distance to agreement (DTA) and 3% dose difference (DD). Results: All the plans evaluated passed the gamma analysis with a percentage greater than 95, except for three cases. Higher gamma passing criteria where observed for all the analyzed plans, when analysis done before 2 years, 1.5 years and 1 year. The standard deviation of ± 1.38, ± 1.40,± 0.97 where observed between the plans when verification plans did before 2 years, 1.5 years and 1 year respectively. Same set of plans shows a standard deviation of ± 0.70, ± 1.36, and ± 1.18, when analysis done recently. A significance difference in response of the array when analysis done recently for the verification plans treated and quality assured before 2 years.This indicates a slightly reduced response of 2D array towards radiation response as the array gets older. Conclusion: It is found that 2D array shows a reduced response against radiation detection over a period of years. An onsite calibration of the instrument is recommended before the measurements. A dose correction factor can be applied if necessary to the results if the radiation response and efficiency of the array is very poor.

  20. Numerical studies of solar chromospheric jets

    NASA Astrophysics Data System (ADS)

    Iijima, Haruhisa

    2016-03-01

    The solar chromospheric jet is one of the most characteristic structures near the solar surface. The quantitative understanding of chromospheric jets is of substantial importance for not only the partially ionized phenomena in the chromosphere but also the energy input and dissipation processes in the corona. In this dissertation, the formation and dynamics of chromospheric jets are investigated using the radiation magnetohydrodynamic simulations. We newly develop a numerical code for the radiation magnetohydrodynamic simulations of the comprehensive modeling of solar atmosphere. Because the solar chromosphere is highly nonlinear, magnetic pressure dominated, and turbulent, a robust and high-resolution numerical scheme is required. In Chapter 2, we propose a new algorithm for the simulation of magnetohydrodynamics. Through the test problems and accuracy analyses, the proposed scheme is proved to satisfy the requirements. In Chapter 3, the effect of the non-local radiation energy transport, Spitzer-type thermal conduction, latent heat of partial ionization and molecule formation, and gravity are implemented to the magnetohydrodynamic code. The numerical schemes for the radiation transport and thermal conduction is carefully chosen in a view of the efficiency and compatibility with the parallel computation. Based on the developed radiation magnetohydrodynamic code, the formation and dynamics of chromospheric jets are investigated. In Chapter 4, we investigate the dependence of chromospheric jets on the coronal temperature in the two-dimensional simulations. Various scale of chromospheric jets with the parabolic trajectory are found with the maximum height of 2–8 Mm, lifetime of 2–7 min, maximum upward velocity of 10– 50 km/s, and deceleration of 100–350 m/s2. We find that chromospheric jets are more elongated under the cool corona and shorter under the hot corona. We also find that the pressure gradient force caused by the periodic shock waves accelerates

  1. Supersymmetric Q-balls: A numerical study

    SciTech Connect

    Campanelli, L.; Ruggieri, M.

    2008-02-15

    We study numerically a class of nontopological solitons, the Q-balls, arising in a supersymmetric extension of the standard model with low-energy, gauge-mediated symmetry breaking. Taking into account the exact form of the supersymmetric potential giving rise to Q-balls, we find that there is a lower limit on the value of the charge Q in order to make them classically stable: Q > or approx. 5x10{sup 2}Q{sub cr}, where Q{sub cr} is constant depending on the parameters defining the potential and can be in the range 1 < or approx. Q{sub cr} < or approx. 10{sup 8} {sup divide} {sup 16}. If Q is the baryon number, stability with respect to the decay into protons requires Q > or approx. 10{sup 17}Q{sub cr}, while if the gravitino mass is greater then m{sub 3/2} > or approx. 61 MeV, no stable gauge-mediation supersymmetric Q-balls exist. Finally, we find that energy and radius of Q-balls can be parametrized as E{approx}{xi}{sub E}Q{sup 3/4} and R{approx}{xi}{sub R}Q{sup 1/4}, where {xi}{sub E} and {xi}{sub R} are slowly varying functions of the charge.

  2. Numerical Study of a Convective Turbulence Encounter

    NASA Technical Reports Server (NTRS)

    Proctor, Fred H.; Hamilton, David W.; Bowles, Roland L.

    2002-01-01

    A numerical simulation of a convective turbulence event is investigated and compared with observational data. The specific case was encountered during one of NASA's flight tests and was characterized by severe turbulence. The event was associated with overshooting convective turrets that contained low to moderate radar reflectivity. Model comparisons with observations are quite favorable. Turbulence hazard metrics are proposed and applied to the numerical data set. Issues such as adequate grid size are examined.

  3. Communication: Effect of accidental mode degeneracy on Raman intensity in 2D materials: Hybrid functional study of bilayer phosphorene

    NASA Astrophysics Data System (ADS)

    Sun, Yi-Yang; Zhang, Shengbai

    2016-07-01

    Bulk black phosphorus has two optical phonon modes labeled as Ag2 and B2u, respectively, that are nearly degenerate in frequency. However, density functional theory calculations using local or semi-local functionals cannot reproduce this degeneracy. Here, we propose a hybrid functional approach aided by van der Waals (vdW) force fields, which can accurately describe the lattice dynamic and electronic properties of both bulk and few-layer black phosphorus (phosphorene). Using this approach we show that in bilayer phosphorene, the two Raman modes derived from the B2u and Ag2 modes could exhibit strong resonance as a result of the accidental degeneracy so that both modes could be observed in Raman experiment. Without the mode degeneracy, however, the Raman intensity of the B2u-derived mode would be too weak to be observed. We further show that the accidental degeneracy is correlated to the applied strain, which enables Raman spectroscopy to be a powerful tool for characterizing built-in strains in 2D materials, e.g., due to the interaction with substrates, which has emerged as an important issue in vdW epitaxy.

  4. Guided ion beam and theoretical study of the reactions of Au+ with H2, D2, and HD

    NASA Astrophysics Data System (ADS)

    Li, Fengxia; Hinton, Christopher S.; Citir, Murat; Liu, Fuyi; Armentrout, P. B.

    2011-01-01

    Reactions of the late third-row transition metal cation Au+ with H2, D2, and HD are examined using guided ion beam tandem mass spectrometry. A flow tube ion source produces Au+ in its 1S (5d10) electronic ground state level. Corresponding state-specific reaction cross sections for forming AuH+ and AuD+ as a function of kinetic energy are obtained and analyzed to give a 0 K bond dissociation energy of D0(Au+-H) = 2.13 ± 0.11 eV. Quantum chemical calculations at the B3LYP/HW+/6-311+G(3p) and B3LYP/Def2TZVPP levels performed here show good agreement with the experimental bond energy. Theory also provides the electronic structures of these species and the reactive potential energy surfaces. We also compare this third-row transition metal system with previous results for analogous reactions of the first-row and second-row congeners, Cu+ and Ag+. We find that Au+ has a stronger M+-H bond, which can be explained by the lanthanide contraction and relativistic effects that alter the relative size of the valence s and d orbitals. Results from reactions with HD provide insight into the reaction mechanism and indicate that ground state Au+ reacts largely via a direct mechanism, in concordance with the behavior of the lighter group 11 metal ions, but includes more statistical behavior than these metals as well.

  5. Communication: Effect of accidental mode degeneracy on Raman intensity in 2D materials: Hybrid functional study of bilayer phosphorene.

    PubMed

    Sun, Yi-Yang; Zhang, Shengbai

    2016-07-14

    Bulk black phosphorus has two optical phonon modes labeled as Ag (2) and B2u, respectively, that are nearly degenerate in frequency. However, density functional theory calculations using local or semi-local functionals cannot reproduce this degeneracy. Here, we propose a hybrid functional approach aided by van der Waals (vdW) force fields, which can accurately describe the lattice dynamic and electronic properties of both bulk and few-layer black phosphorus (phosphorene). Using this approach we show that in bilayer phosphorene, the two Raman modes derived from the B2u and Ag (2) modes could exhibit strong resonance as a result of the accidental degeneracy so that both modes could be observed in Raman experiment. Without the mode degeneracy, however, the Raman intensity of the B2u-derived mode would be too weak to be observed. We further show that the accidental degeneracy is correlated to the applied strain, which enables Raman spectroscopy to be a powerful tool for characterizing built-in strains in 2D materials, e.g., due to the interaction with substrates, which has emerged as an important issue in vdW epitaxy. PMID:27421389

  6. Systematic Functional Study of Cytochrome P450 2D6 Promoter Polymorphisms in the Chinese Han Population

    PubMed Central

    Gong, Xueli; Liu, Yichen; Zhang, Xiaoqing; Wei, Zhiyun; Huo, Ran; Shen, Lu; He, Lin; Qin, Shengying

    2013-01-01

    The promoter polymorphisms of drug-metabolizing genes can lead to interindividual differences in gene expression, which may result in adverse drug effects and therapeutic failure. Based on the database of CYP2D6 gene polymorphisms in the Chinese Han population established by our group, we functionally characterized the single nucleotide polymorphisms (SNPs) of the promoter region and corresponding haplotypes in this population. Using site-directed mutagenesis, all the five SNPs identified and ten haplotypes with a frequency equal to or greater than 0.01 in the population were constructed on a luciferase reporter system. Dual luciferase reporter systems were used to analyze regulatory activity. The activity produced by Haplo3(−2183G>A, −1775A>G, −1589G>C, −1431C>T, −1000G>A, −678A>G), Haplo8(−2065G>A, −2058T>G, −1775A>G, −1589G>C, −1235G>A, −678A>G) and MU3(−498C>A) was 0.7−, 0.7−, 1.2− times respectively compared with the wild type in human hepatoma cell lines(p<0.05). These findings might be useful for optimizing pharmacotherapy and the design of personalized medicine. PMID:23469064

  7. Pre-stack depth migration for improved imaging under seafloor canyons: 2D case study of Browse Basin, Australia*

    NASA Astrophysics Data System (ADS)

    Debenham, Helen 124Westlake, Shane

    2014-06-01

    In the Browse Basin, as in many areas of the world, complex seafloor topography can cause problems with seismic imaging. This is related to complex ray paths, and sharp lateral changes in velocity. This paper compares ways in which 2D Kirchhoff imaging can be improved below seafloor canyons, using both time and depth domain processing. In the time domain, to improve on standard pre-stack time migration (PSTM) we apply removable seafloor static time shifts in order to reduce the push down effect under seafloor canyons before migration. This allows for better event continuity in the seismic imaging. However this approach does not fully solve the problem, still giving sub-optimal imaging, leaving amplitude shadows and structural distortion. Only depth domain processing with a migration algorithm that honours the paths of the seismic energy as well as a detailed velocity model can provide improved imaging under these seafloor canyons, and give confidence in the structural components of the exploration targets in this area. We therefore performed depth velocity model building followed by pre-stack depth migration (PSDM), the result of which provided a step change improvement in the imaging, and provided new insights into the area.

  8. Design and performance of a cryogenic scanning tunneling microscope in high magnetic field for 2D layered materials study

    NASA Astrophysics Data System (ADS)

    Chuang, Tien-Ming; Chung, Pei-Fang; Guan, Syu-You; Yu, Shan-An; Liu, Che-An; Hsu, Chia-Sheng; Su, Chih-Chuan; Sankar, Raman; Chou, Fang-Cheng

    2015-03-01

    We will describe the design and performance of a cryogenic scanning tunneling microscope (STM) system in a high magnetic field. A Pan-type STM is mounted on a homemade low vibration 4He pot refrigerator, which can be operated in continuous flow mode at T ~ 1.6K and in a magnetic field of up to 9 Tesla. A cleavage device at T =4.2K stage is used to cleave the 2D layered materials before inserting into STM as well as functioning as the radiation shield. The liquid helium boil rate of 4.6 liters per day is achieved due to our careful design, which allows the measurement at base temperature up to 10 days. We will demonstrate its capability of measuring atomically registered energy resolved spectroscopic maps in both real space and momentum space by our recent results on Rashba BiTeI. This work is supported by Ministry of Science and Technology, Taiwan and Kenda Foundation, Taiwan.

  9. A study on correlation between 2D and 3D gamma evaluation metrics in patient-specific quality assurance for VMAT.

    PubMed

    Rajasekaran, Dhanabalan; Jeevanandam, Prakash; Sukumar, Prabakar; Ranganathan, Arulpandiyan; Johnjothi, Samdevakumar; Nagarajan, Vivekanandan

    2014-01-01

    In this study, we investigated the correlation between 2-dimensional (2D) and 3D gamma analysis using the new PTW OCTAVIUS 4D system for various parameters. For this study, we selected 150 clinically approved volumetric-modulated arc therapy (VMAT) plans of head and neck (50), thoracic (esophagus) (50), and pelvic (cervix) (50) sites. Individual verification plans were created and delivered to the OCTAVIUS 4D phantom. Measured and calculated dose distributions were compared using the 2D and 3D gamma analysis by global (maximum), local and selected (isocenter) dose methods. The average gamma passing rate for 2D global gamma analysis in coronal and sagittal plane was 94.81% ± 2.12% and 95.19% ± 1.76%, respectively, for commonly used 3-mm/3% criteria with 10% low-dose threshold. Correspondingly, for the same criteria, the average gamma passing rate for 3D planar global gamma analysis was 95.90% ± 1.57% and 95.61% ± 1.65%. The volumetric 3D gamma passing rate for 3-mm/3% (10% low-dose threshold) global gamma was 96.49% ± 1.49%. Applying stringent gamma criteria resulted in higher differences between 2D planar and 3D planar gamma analysis across all the global, local, and selected dose gamma evaluation methods. The average gamma passing rate for volumetric 3D gamma analysis was 1.49%, 1.36%, and 2.16% higher when compared with 2D planar analyses (coronal and sagittal combined average) for 3mm/3% global, local, and selected dose gamma analysis, respectively. On the basis of the wide range of analysis and correlation study, we conclude that there is no assured correlation or notable pattern that could provide relation between planar 2D and volumetric 3D gamma analysis. Owing to higher passing rates, higher action limits can be set while performing 3D quality assurance. Site-wise action limits may be considered for patient-specific QA in VMAT. PMID:24910246

  10. Proteomic expression of microfungal ripening starter Geotrichum candidum submitted to cold stress is strain-dependent: studies using 2d-dige technology and samespots software analysis.

    PubMed

    Missous, Ghalia; Thammavongs, Bouachanh; Dieuleveux, Virginie; Houssin, Maryline; Henry, Joël; Panoff, Jean-Michel

    2012-01-01

    Geotrichum candidum is a micro-fungus widely used as a ripening starter in cheese making. In anthropogenic environments such as dairy industries, this microorganism is subjected to many environmental and technological stresses including low temperature exposure. Our aim was to study the proteomic response of G. candidum to cold stress using a comparative proteomic approach by two-dimensional Differential In Gel Electrophoresis (2D DIGE). This technique consists on the labeling of proteins by specific fluorescent dyes (CyDyes). The results, obtained with G. candidum cells subjected to cold temperature, show significant proteomic patterns differences compared with the standard conditions. Furthermore, this biochemical response seems strain specific. 2D DIGE technology combined with SameSpots™ software analysis support these results through an important statistical validity. The comparative studies in a single gel, using two different fluorescent CyDyes (Cy3 and Cy5), lead to proteins differentiation. Selected spots were treated and analyzed by mass spectrometry. PMID:22987240

  11. Numerical study of a microscopic artificial swimmer

    NASA Astrophysics Data System (ADS)

    Gauger, Erik; Stark, Holger

    2006-08-01

    We present a detailed numerical study of a microscopic artificial swimmer realized recently by Dreyfus in experiments [Dreyfus , Nature 437, 862 (2005)]. It consists of an elastic filament composed of superparamagnetic particles that are linked together by DNA strands. Attached to a load particle, the resulting swimmer is actuated by an oscillating external magnetic field so that it performs a nonreciprocal motion in order to move forward. We model the superparamagnetic filament by a bead-spring configuration that resists bending like a rigid rod and whose beads experience friction with the surrounding fluid and hydrodynamic interactions with each other. We show that, aside from finite-size effects, its dynamics is governed by the dimensionless sperm number, the magnitude of the magnetic field, and the angular amplitude of the field’s oscillating direction. Then we study the mean velocity and the efficiency of the swimmer as a function of these parameters and the size of the load particle. In particular, we clarify that the real velocity of the swimmer is influenced by two main factors, namely the shape of the beating filament (determined by the sperm number and the magnetic-field strength) and the oscillation frequency. Furthermore, the load size influences the performance of the swimmer and has to be chosen as a compromise between the largest swimming velocity and the best efficiency. Finally, we demonstrate that the direction of the swimming velocity changes in a symmetry-breaking transition when the angular amplitude of the field’s oscillating direction is increased, in agreement with experiments.

  12. Numerical studies of solar chromospheric jets

    NASA Astrophysics Data System (ADS)

    Iijima, Haruhisa

    2016-03-01

    The solar chromospheric jet is one of the most characteristic structures near the solar surface. The quantitative understanding of chromospheric jets is of substantial importance for not only the partially ionized phenomena in the chromosphere but also the energy input and dissipation processes in the corona. In this dissertation, the formation and dynamics of chromospheric jets are investigated using the radiation magnetohydrodynamic simulations. We newly develop a numerical code for the radiation magnetohydrodynamic simulations of the comprehensive modeling of solar atmosphere. Because the solar chromosphere is highly nonlinear, magnetic pressure dominated, and turbulent, a robust and high-resolution numerical scheme is required. In Chapter 2, we propose a new algorithm for the simulation of magnetohydrodynamics. Through the test problems and accuracy analyses, the proposed scheme is proved to satisfy the requirements. In Chapter 3, the effect of the non-local radiation energy transport, Spitzer-type thermal conduction, latent heat of partial ionization and molecule formation, and gravity are implemented to the magnetohydrodynamic code. The numerical schemes for the radiation transport and thermal conduction is carefully chosen in a view of the efficiency and compatibility with the parallel computation. Based on the developed radiation magnetohydrodynamic code, the formation and dynamics of chromospheric jets are investigated. In Chapter 4, we investigate the dependence of chromospheric jets on the coronal temperature in the two-dimensional simulations. Various scale of chromospheric jets with the parabolic trajectory are found with the maximum height of 2-8 Mm, lifetime of 2-7 min, maximum upward velocity of 10-50 km/s, and deceleration of 100-350 m/s2. We find that chromospheric jets are more elongated under the cool corona and shorter under the hot corona. We also find that the pressure gradient force caused by the periodic shock waves accelerates some of the

  13. Mathematical modeling of electrocardiograms: a numerical study.

    PubMed

    Boulakia, Muriel; Cazeau, Serge; Fernández, Miguel A; Gerbeau, Jean-Frédéric; Zemzemi, Nejib

    2010-03-01

    This paper deals with the numerical simulation of electrocardiograms (ECG). Our aim is to devise a mathematical model, based on partial differential equations, which is able to provide realistic 12-lead ECGs. The main ingredients of this model are classical: the bidomain equations coupled to a phenomenological ionic model in the heart, and a generalized Laplace equation in the torso. The obtention of realistic ECGs relies on other important features--including heart-torso transmission conditions, anisotropy, cell heterogeneity and His bundle modeling--that are discussed in detail. The numerical implementation is based on state-of-the-art numerical methods: domain decomposition techniques and second order semi-implicit time marching schemes, offering a good compromise between accuracy, stability and efficiency. The numerical ECGs obtained with this approach show correct amplitudes, shapes and polarities, in all the 12 standard leads. The relevance of every modeling choice is carefully discussed and the numerical ECG sensitivity to the model parameters investigated. PMID:20033779

  14. Re-entrainment around a low-rise industrial building: 2D versus 3D wind tunnel study

    NASA Astrophysics Data System (ADS)

    Law, Adrian W. K.; Choi, Edmund C. C.; Britter, Rex E.

    We investigate the re-entrainment of pollutants around a low-rise industrial building under opposing cross winds through experimental means in a wind tunnel. Two scaled models of an industrial building for electrowinning metal extraction were tested. The first model was a two-dimensional simplified segment of the building with a scale ratio of 1:40, while the second was a 1:100 three-dimensional model of the full building. Particle image velocimetry was adopted to provide the planar velocity measurements that illustrated the flow distribution around the building. Flame ionization detection with propane tracer gas was used to measure the concentration distribution. The results of the 2D model show that the exhaust plume interacted with the opposing wind in two different stages, namely ground attachment and bent-over. The ground attachment stage occurred under low wind speeds, whereby the exhaust plume exhibited Coanda attachment with the ground surface before being lifted off by the cross wind and circulated to the leeward wake cavity. Upon further increase in the wind speed, the bent-over stage occurred with the exhaust plume being detached from the ground and deflected upward over the roof, before entrained by the wake. The re-entrainment ratio decreased with the increase in wind speed within the range of wind speeds tested, indicating that the range did not include the critical wind speed. Results from the 3D model painted a somewhat different picture and pointed to the significance of the end conditions. The maximum re-entrainment always occurred near the two ends of the building, where the pollutants mostly flowed around the ends rather than over the roof. The re-entrainment ratio was consistently higher at the two ends compared to the central sections. Finally, a building re-entrainment index, ( KR) ∞, is proposed to characterize the re-entrainment performance of a specific building geometry.

  15. Numerical studies of supersonic/hypersonic combustion

    SciTech Connect

    Yoon, W.S.; Chung, T.J. )

    1992-01-01

    This paper is concerned with the development of direct numerical simulations of turbulence interacting with shock waves and chemical reactions using unstructured adaptive finite element h-p methods. Reliable methods for resolving the complicated time and length scales involved in turbulence interacting with shock waves and chemical reactions are not yet available. Direct numerical simulations are here developed via Taylor-Galerkin finite element implicit scheme, with mesh refinements and spectral orders optimized such that errors are reduced where gradients of variables are large. 31 refs.

  16. A preliminary study on using the radiochromic film for 2D beam profile QC/QA at the THOR BNCT facility.

    PubMed

    Hsiao, Ming-Chen; Chen, Wei-Lin; Tsai, Pi-En; Huang, Chun-Kai; Liu, Yuan-Hao; Liu, Hong-Ming; Jiang, Shiang-Huei

    2011-12-01

    The GAFCHROMIC(®) EBT2 dosimetry film has been studied as a rapid QC/QA tool for 2D dose profile mapping in the BNCT beam at THOR. The pixel values of the EBT2 film image were converted to the 2D dose profile using a dose calibration curve obtained by 6-MV X-ray. The reproducibility of the 2D dose profile measured using the EBT2 film in the PMMA phantom was preliminarily found to be acceptable with uncertainties within about ±2 to ±3.5%. It is found that the EBT2 measured dose profile consisted of both gamma-ray components and neutron contributions. Therefore, the dose profile measured using the EBT2 film is significantly different from the neutron flux profile measured using the indirect neutron radiography method. Further study of the influence of neutrons to the response of the EBT2 film is indispensible for the absolute dose profile determination in a BNCT beam. PMID:21570854

  17. Reduced dimensionality (3,2)D NMR experiments and their automated analysis: implications to high-throughput structural studies on proteins.

    PubMed

    Reddy, Jithender G; Kumar, Dinesh; Hosur, Ramakrishna V

    2015-02-01

    Protein NMR spectroscopy has expanded dramatically over the last decade into a powerful tool for the study of their structure, dynamics, and interactions. The primary requirement for all such investigations is sequence-specific resonance assignment. The demand now is to obtain this information as rapidly as possible and in all types of protein systems, stable/unstable, soluble/insoluble, small/big, structured/unstructured, and so on. In this context, we introduce here two reduced dimensionality experiments – (3,2)D-hNCOcanH and (3,2)D-hNcoCAnH – which enhance the previously described 2D NMR-based assignment methods quite significantly. Both the experiments can be recorded in just about 2-3 h each and hence would be of immense value for high-throughput structural proteomics and drug discovery research. The applicability of the method has been demonstrated using alpha-helical bovine apo calbindin-D9k P43M mutant (75 aa) protein. Automated assignment of this data using AUTOBA has been presented, which enhances the utility of these experiments. The backbone resonance assignments so derived are utilized to estimate secondary structures and the backbone fold using Web-based algorithms. Taken together, we believe that the method and the protocol proposed here can be used for routine high-throughput structural studies of proteins. PMID:25178811

  18. Study on aggregation and electric properties in the micro-region of functionalized dithieno[2, 3-b: 3', 2'-d]thiophene (DTT) oligomers

    NASA Astrophysics Data System (ADS)

    Jiang, Xiaohong; Huang, Xiaowei; Zhang, Jiajia; Lu, Zhijuan; Wang, Hua; Du, Zuliang

    2016-07-01

    Three kinds of 2,5,-diphenyl-dithienol[2, 3-b: 3', 2'-d]thiophene (DP-DTT), 2,5,-distyryl-dithienol[2, 3-b: 3', 2'-d]thiophene (DEP-DTT) and 2,5,-thienyl-dithienol[2, 3-b: 3', 2'-d]thiophene (DET-DTT) micro-region structure and electronic properties were studied. Thin films of these functionalized DTT oligomers were prepared in a one-step drop-casting deposition onto highly oriented pyrolytic graphite substrates. The surface structure of these films was characterized by atomic force microscopy (AFM). Conducting probe atomic force microscope (C-AFM) and Kelvin probe force microscope (KFM) were both used to characterize the electronic transport behavior and surface potential distribution. The substituents of DTT oligomers can greatly affect their aggregation and the hopping conductance mechanism was used to explain the Au-DTTs-HOPG junctions. KFM investigation revealed that these oligomers with different substituents have different highest occupied molecular orbital energy levels. The corresponding theoretical analysis reveals similar result to KFM characterization. The I-V results indicated that the aggregates of molecules were the dominating factor to their micro-region electrical transport.

  19. Numerical study of mixing in hypervelocity flows

    SciTech Connect

    Krishnamurthy, R.; Woods, D.M.; Chandra, S.

    1996-12-31

    Results are reported from an analysis of data obtained with a combustor model tested in the new pulse facility at California Institute of Technology. Data analysis was performed using the numerical code GASP. Comparisons were drawn between the predictions of the algebraic Baldwin-Lomax and the two equation k-{epsilon} turbulence models. It is concluded that the use of the simpler Baldwin-Lomax model is sufficient as it saves computational resources and yields adequate predictions, for the conditions considered here.

  20. A numerical study of confined turbulent jets

    NASA Technical Reports Server (NTRS)

    Zhu, J.; Shih, T.-H.

    1993-01-01

    A numerical investigation is reported of turbulent incompressible jets confined in two ducts, one cylindrical and the other conical with a 5 degree divergence. In each case, three Craya-Curtet numbers are considered which correspond, respectively, to flow situations with no moderate and strong recirculation. Turbulence closure is achieved by using the k-epsilon model and a recently proposed realizable Reynolds stress algebraic equation model that relates the Reynolds stresses explicitly to the quadratic terms of the mean velocity gradients and ensures the positiveness of each component of the turbulent kinetic energy. Calculations are carried out with a finite-volume procedure using boundary-fitted curvilinear coordinates. A second-order accurate, bounded convection scheme and sufficiently fine grids are used to prevent the solutions from being contaminated by numerical diffusion. The calculated results are compared extensively with the available experimental data. It is shown that the numerical methods presented are capable of capturing the essential flow features observed in the experiments and that the realizable Reynolds stress algebraic equation model performs much better than the k-epsilon model for this class of flows of great practical importance.

  1. Morphologic Analysis of the Temporomandibular Joint Between Patients With Facial Asymmetry and Asymptomatic Subjects by 2D and 3D Evaluation: A Preliminary Study.

    PubMed

    Zhang, Yuan-Li; Song, Jin-Lin; Xu, Xian-Chao; Zheng, Lei-Lei; Wang, Qing-Yuan; Fan, Yu-Bo; Liu, Zhan

    2016-03-01

    Signs and symptoms of temporomandibular joint (TMJ) dysfunction are commonly found in patients with facial asymmetry. Previous studies on the TMJ position have been limited to 2-dimensional (2D) radiographs, computed tomography (CT), or cone-beam computed tomography (CBCT). The purpose of this study was to compare the differences of TMJ position by using 2D CBCT and 3D model measurement methods. In addition, the differences of TMJ positions between patients with facial asymmetry and asymptomatic subjects were investigated.We prospectively recruited 5 patients (cases, mean age, 24.8 ± 2.9 years) diagnosed with facial asymmetry and 5 asymptomatic subjects (controls, mean age, 26 ± 1.2 years). The TMJ spaces, condylar and ramus angles were assessed by using 2D and 3D methods. The 3D models of mandible, maxilla, and teeth were reconstructed with the 3D image software. The variables in each group were assessed by t-test and the level of significance was 0.05.There was a significant difference in the horizontal condylar angle (HCA), coronal condylar angle (CCA), sagittal ramus angle (SRA), medial joint space (MJS), lateral joint space (LJS), superior joint space (SJS), and anterior joint space (AJS) measured in the 2D CBCT and in the 3D models (P < 0.05). The case group had significantly smaller SJS compared to the controls on both nondeviation side (P = 0.009) and deviation side (P = 0.004). In the case group, the nondeviation SRA was significantly larger than the deviation side (P = 0.009). There was no significant difference in the coronal condylar width (CCW) in either group. In addition, the anterior disc displacement (ADD) was more likely to occur on the deviated side in the case group.In conclusion, the 3D measurement method is more accurate and effective for clinicians to investigate the morphology of TMJ than the 2D method. PMID:27043669

  2. 2D Turbulence with Complicated Boundaries

    NASA Astrophysics Data System (ADS)

    Roullet, G.; McWilliams, J. C.

    2014-12-01

    We examine the consequences of lateral viscous boundary layers on the 2D turbulence that arises in domains with complicated boundaries (headlands, bays etc). The study is carried out numerically with LES. The numerics are carefully designed to ensure all global conservation laws, proper boundary conditions and a minimal range of dissipation scales. The turbulence dramatically differs from the classical bi-periodic case. Boundary layer separations lead to creation of many small vortices and act as a continuing energy source exciting the inverse cascade of energy throughout the domain. The detachments are very intermittent in time. In free decay, the final state depends on the effective numerical resolution: laminar with a single dominant vortex for low Re and turbulent with many vortices for large enough Re. After very long time, the turbulent end-state exhibits a striking tendency for the emergence of shielded vortices which then interact almost elastically. In the forced case, the boundary layers allow the turbulence to reach a statistical steady state without any artificial hypo-viscosity or other large-scale dissipation. Implications are discussed for the oceanic mesoscale and submesoscale turbulence.

  3. Numerical Study of Multigrid Methods with Various Smoothers for the Elliptical Grid Generation Equations

    NASA Technical Reports Server (NTRS)

    Golik, W. L.

    1996-01-01

    A robust solver for the elliptic grid generation equations is sought via a numerical study. The system of PDEs is discretized with finite differences, and multigrid methods are applied to the resulting nonlinear algebraic equations. Multigrid iterations are compared with respect to the robustness and efficiency. Different smoothers are tried to improve the convergence of iterations. The methods are applied to four 2D grid generation problems over a wide range of grid distortions. The results of the study help to select smoothing schemes and the overall multigrid procedures for elliptic grid generation.

  4. Self-Navigation with Compressed Sensing for 2D Translational Motion Correction in Free-Breathing Coronary MRI: A Feasibility Study

    PubMed Central

    Bonanno, Gabriele; Puy, Gilles; Wiaux, Yves; van Heeswijk, Ruud B.; Piccini, Davide; Stuber, Matthias

    2014-01-01

    Purpose Respiratory motion correction remains a challenge in coronary magnetic resonance imaging (MRI) and current techniques, such as navigator gating, suffer from sub-optimal scan efficiency and ease-of-use. To overcome these limitations, an image-based self-navigation technique is proposed that uses “sub-images” and compressed sensing (CS) to obtain translational motion correction in 2D. The method was preliminarily implemented as a 2D technique and tested for feasibility for targeted coronary imaging. Methods During a 2D segmented radial k-space data acquisition, heavily undersampled sub-images were reconstructed from the readouts collected during each cardiac cycle. These sub-images may then be used for respiratory self-navigation. Alternatively, a CS reconstruction may be used to create these sub-images, so as to partially compensate for the heavy undersampling. Both approaches were quantitatively assessed using simulations and in vivo studies, and the resulting self-navigation strategies were then compared to conventional navigator gating. Results Sub-images reconstructed using CS showed a lower artifact level than sub-images reconstructed without CS. As a result, the final image quality was significantly better when using CS-assisted self-navigation as opposed to the non-CS approach. Moreover, while both self-navigation techniques led to a 69% scan time reduction (as compared to navigator gating), there was no significant difference in image quality between the CS-assisted self-navigation technique and conventional navigator gating, despite the significant decrease in scan time. Conclusions CS-assisted self-navigation using 2D translational motion correction demonstrated feasibility of producing coronary MRA data with image quality comparable to that obtained with conventional navigator gating, and does so without the use of additional acquisitions or motion modeling, while still allowing for 100% scan efficiency and an improved ease-of-use. In

  5. Numerical study of combustion processes in afterburners

    NASA Technical Reports Server (NTRS)

    Zhou, Xiaoqing; Zhang, Xiaochun

    1986-01-01

    Mathematical models and numerical methods are presented for computer modeling of aeroengine afterburners. A computer code GEMCHIP is described briefly. The algorithms SIMPLER, for gas flow predictions, and DROPLET, for droplet flow calculations, are incorporated in this code. The block correction technique is adopted to facilitate convergence. The method of handling irregular shapes of combustors and flameholders is described. The predicted results for a low-bypass-ratio turbofan afterburner in the cases of gaseous combustion and multiphase spray combustion are provided and analyzed, and engineering guides for afterburner optimization are presented.

  6. Baby universes in 2d quantum gravity

    NASA Astrophysics Data System (ADS)

    Ambjørn, Jan; Jain, Sanjay; Thorleifsson, Gudmar

    1993-06-01

    We investigate the fractal structure of 2d quantum gravity, both for pure gravity and for gravity coupled to multiple gaussian fields and for gravity coupled to Ising spins. The roughness of the surfaces is described in terms of baby universes and using numerical simulations we measure their distribution which is related to the string susceptibility exponent γstring.

  7. Numerical Study of Orbits around Europa

    NASA Astrophysics Data System (ADS)

    Mourao, Decio; Carvalho, Jean Paulo; Vilhena de Moraes, Rodolpho; Cardoso dos Santos, Josué; Campos de Carvalho Costa, Luis Fernando

    NASA's Galileo spacecraft probe recently discovered what appears to be a body of liquid water locked inside the icy shell of Jupiter’s moon Europa. The improved likelihood of life on Europa motivated new mission proposals. In this work we used numerical simulations to compare several possible orbits of satellites near the surface of Europa. We spread a set of particles around the satellite with different initially conditions, from 50 to 500km altitude and inclinations higher than 35 degrees, and we monitored the evolution of the test particles during the numerical integrations. We consider the effect of the oblateness of Europa by considering the C22,J2 and J4 parameters and Jupiter gravitational perturbation. These perturbations were first accounted for separately in order to better understand the importance of each effect, and then considered jointly. All particles collide with the Europa surface in a few days. The oblateness of Jupiter alone causes particles with high inclination to collide with the surface of Europa, while the oblateness of Europa affects low orbits decreasing the lifetime of most of the particles. We identified a stable region of orbits with initial altitudes around 300 km of altitude and 90 degrees of inclination. Particles in this region survived more than 200 days. In most of the simulations pericenter initial values near 90 or 270 degrees favor a higher lifetime for the particles, even when considering Europa oblateness.

  8. Annotated Bibliography of EDGE2D Use

    SciTech Connect

    J.D. Strachan and G. Corrigan

    2005-06-24

    This annotated bibliography is intended to help EDGE2D users, and particularly new users, find existing published literature that has used EDGE2D. Our idea is that a person can find existing studies which may relate to his intended use, as well as gain ideas about other possible applications by scanning the attached tables.

  9. Numerical and Experimental Study of Transport Phenomena in Directional Solidification of Succinonitrile

    NASA Technical Reports Server (NTRS)

    de Groh, Henry C., III; Yao, Minwu

    1994-01-01

    A numerical and experimental study of the growth of succinonitrile (SCN) using a horizontal Bridginan furnace and transparent glass ampoule was conducted. Two experiments were considered: one in which the temperature profile was fixed relative to the ampoule (no-growth case); and a second in which the thermal profile was translated at a constant rate (steady growth case). Measured temperature profiles on the outer surface of the ampoule were used as thermal boundary conditions for the modelling. The apparent heat capacity formulation combined with the variable viscositymeth was used to model the phase change in SeN. Both 2-D and 3-D models were studied and numerical solutions obtained using the commercial finite element code, FIDAP1. Comparison of the numerical results to experimental data showed excellent agreement. The complex 3-D shallow-cavity flow in the melt, differences between 2-D and 3-D models, effects of natural convection on the thermal gradient and shape of the solid/liquid interface, and the sensitivity of simulations to specific assumptions, are also discussed.

  10. Association of genetic variants in INS (rs689), INSR (rs1799816) and PP1G.G (rs1799999) with type 2 diabetes (T2D): a case-control study in three ethnic groups from North-West India.

    PubMed

    Sokhi, Jasmine; Sikka, Ruhi; Raina, Priyanka; Kaur, Ramandeep; Matharoo, Kawaljit; Arora, Punit; Bhanwer, Ajs

    2016-02-01

    Genetic contributions towards Type 2 diabetes (T2D) have been assessed through association studies across different world populations with inconsistencies. The majority of the T2D susceptibility loci are common across different races or populations but show ethnicity-specific differences. The pathogenesis of T2D involves genetic variants in the candidate genes. The interactions between the genes involved in insulin signaling and secretory pathways are believed to play an important role in determining an individual's susceptibility towards T2D. Therefore, the present study was initiated to examine the differences, if any, in the contribution of polymorphisms towards T2D susceptibility in the background of different ethnic specifications. The present case-control study included a total of 1216 T2D cases and healthy controls from three ethnic groups (Jat Sikhs, Banias and Brahmins) of North-West India. Polymorphisms were selected on the basis of information available in the literature for INS (rs689), INSR (rs1799816) and PP1G.G (rs1799999) in context to T2D. The genotyping was done using PCR-RFLP method. Statistical analysis was done using SPSS 16.0. The analyses revealed that INS (rs689) polymorphism conferred risk towards T2D susceptibility in all the three ethnic groups whereas INSR (rs1799816) polymorphism conferred risk towards T2D in Brahmins only and PP1G.G (rs1799999) polymorphism indicated T2D risk in Jat Sikhs only. Furthermore, interaction analyses indicated the cumulative role of three genetic variants in modulating T2D susceptibility in the three ethnic groups. In conclusion, our results substantiated the evidences for the role of ethnicity in differential susceptibility to T2D in the background of same genetic variants. PMID:26251103

  11. Theoretical study of N (4S, 2D)+CH3 (2A2″) reaction mechanisms revisited: The importance of spin-forbidden and roaming dynamics processes

    NASA Astrophysics Data System (ADS)

    Chiba, Sachie; Yoshida, Fuka; Takayanagi, Toshiyuki

    2014-03-01

    Extensive electronic structure calculations have been performed to understand the reaction mechanisms of the N(4S, 2D) + CH3 reaction using ab initio multi-configurational methods. We have located a total of seven structures for the minimum on the seam of singlet/triplet potential energy crossing. According to our computational results, we conclude that triplet/singlet spin-forbidden processes are playing an essential role in this reaction in high contrast with previous theoretical studies. In addition, it is likely that singlet HCN + H2 products are formed through so-called ‘roaming' dynamics.

  12. Study of Positronium in Low-k Dielectric Films by means of 2D-Angular Correlation Experiments at a High-Intensity Slow-Positron Beam

    SciTech Connect

    Gessmann, T; Petkov, M P; Weber, M H; Lynn, K G; Rodbell, K P; Asoka-Kumar, P; Stoeffl, W; Howell, R H

    2001-06-20

    Depth-resolved measurements of the two-dimensional angular correlation of annihilation radiation (2D-ACAR) were performed at the high-intensity slow-positron beam of Lawrence Livermore National Laboratory. We studied the formation of positronium in thin films of methyl-silsesquioxane (MSSQ) spin-on glass containing open-volume defects in the size of voids. Samples with different average void sizes were investigated and positronium formation could be found in all cases. The width of the angular correlation related to the annihilation of parapositronium increased with the void size indicating the annihilation of non-thermalized parapositronium.

  13. Theoretical study of the thermodynamic stability and electronic structure of thin films of 3 C, 2 H, and 2 D silicon carbides

    NASA Astrophysics Data System (ADS)

    Kuzubov, A. A.; Eliseeva, N. S.; Krasnov, P. O.; Tomilin, F. N.; Fedorov, A. S.; Tolstaya, A. V.

    2014-08-01

    Silicon carbide is among the most common materials used in semiconductor engineering. Silicon carbide thin films are attractive from the standpoint of designing devices based on heterojunctions. This is due to a characteristic feature of this compound, such as polytypism, leading to the difference in the physical properties and also hampering the preparation of high-quality material samples. In this work, the thermodynamic stability and electronic structure of thin films based on the polytypes 3 C, 2 H, and 2 D with a thickness of a few nanometers have been studied.

  14. Numerical Studies of Impurities in Fusion Plasmas

    DOE R&D Accomplishments Database

    Hulse, R. A.

    1982-09-01

    The coupled partial differential equations used to describe the behavior of impurity ions in magnetically confined controlled fusion plasmas require numerical solution for cases of practical interest. Computer codes developed for impurity modeling at the Princeton Plasma Physics Laboratory are used as examples of the types of codes employed for this purpose. These codes solve for the impurity ionization state densities and associated radiation rates using atomic physics appropriate for these low-density, high-temperature plasmas. The simpler codes solve local equations in zero spatial dimensions while more complex cases require codes which explicitly include transport of the impurity ions simultaneously with the atomic processes of ionization and recombination. Typical applications are discussed and computational results are presented for selected cases of interest.

  15. Numerical study of mountain system evolution along the Tarim-Altay profile

    NASA Astrophysics Data System (ADS)

    Suvorov, V. D.; Stefanov, Yu. P.; Pavlov, E. V.; Kochnev, V. A.; Melnik, E. A.; Tataurova, A. A.

    2015-10-01

    The paper reports the numerical modeling results on the Earth's crust deformation along the Tarim-Altay profile under gravity and lateral compression. Modeling was performed to study how the strength properties and block structure of the crust section influence the formation of plastic deformation zones, day surface relief and the Moho deflection. Conditions were estimated in which mountains grow under certain geological and geophysical characteristics, including mountain root formation. The deformation process was considered in a 2D elastic-plastic formulation for the vertical section of the crust and upper mantle down to a depth of 90 km.

  16. Neutron scattering study of a quasi-2D spin-1/2 dimer system Piperazinium Hexachlorodicuprate under hydrostatic pressure

    SciTech Connect

    Hong, Tao; Stock, C.; Cabrera, I.; Broholm, C.; Qiu, Y.; Leao, J. B.; Poulton, S. J.; Copley, J.R.D.

    2010-01-01

    We report inelastic neutron scattering study of a quasi-two-dimensional S=1/2 dimer system piperazinium hexachlorodicuprate under hydrostatic pressure. The spin gap {Delta} becomes softened with the increase of the hydrostatic pressure up to P = 9.0 kbar. The observed threefold degenerate triplet excitation at P = 6.0 kbar is consistent with the theoretical prediction and the bandwidth of the dispersion relation is unaffected within the experimental uncertainty. At P = 9.0 kbar the spin gap is reduced to {Delta} = 0.55 meV from {Delta} = 1.0 meV at ambient pressure.

  17. ZORNOC: a 1 1/2-D tokamak data analysis code for studying noncircular high beta plasmas

    SciTech Connect

    Zurro, B.; Wieland, R.M.; Murakami, M.; Swain, D.W.

    1980-03-01

    A new tokamak data analysis code, ZORNOC, was developed to study noncircular, high beta plasmas in the Impurity Study Experiment (ISX-B). These plasmas exhibit significant flux surface shifts and elongation in both ohmically heated and beam-heated discharges. The MHD equilibrium flux surface geometry is determined by solving the Grad-Shafranov equation based on: (1) the shape of the outermost flux surface, deduced from the magnetic loop probes; (2) a pressure profile, deduced by means of Thomson scattering data (electrons), charge exchange data (ions), and a Fokker-Planck model (fast ions); and (3) a safety factor profile, determined from the experimental data using a simple model (Z/sub eff/ = const) that is self-consistently altered while the plasma equilibrium is iterated. For beam-heated discharches the beam deposition profile is determined by means of a Monte Carlo scheme and the slowing down of the fast ions by means of an analytical solution of the Fokker-Planck equation. The code also carries out an electron power balance and calculates various confinement parameters. The code is described and examples of its operation are given.

  18. Numerical Studies of Boundary-Layer Receptivity

    NASA Technical Reports Server (NTRS)

    Reed, Helen L.

    1995-01-01

    Direct numerical simulations (DNS) of the acoustic receptivity process on a semi-infinite flat plate with a modified-super-elliptic (MSE) leading edge are performed. The incompressible Navier-Stokes equations are solved in stream-function/vorticity form in a general curvilinear coordinate system. The steady basic-state solution is found by solving the governing equations using an alternating direction implicit (ADI) procedure which takes advantage of the parallelism present in line-splitting techniques. Time-harmonic oscillations of the farfield velocity are applied as unsteady boundary conditions to the unsteady disturbance equations. An efficient time-harmonic scheme is used to produce the disturbance solutions. Buffer-zone techniques have been applied to eliminate wave reflection from the outflow boundary. The spatial evolution of Tollmien-Schlichting (T-S) waves is analyzed and compared with experiment and theory. The effects of nose-radius, frequency, Reynolds number, angle of attack, and amplitude of the acoustic wave are investigated. This work is being performed in conjunction with the experiments at the Arizona State University Unsteady Wind Tunnel under the direction of Professor William Saric. The simulations are of the same configuration and parameters used in the wind-tunnel experiments.

  19. Externally fed star formation: a numerical study

    NASA Astrophysics Data System (ADS)

    Mohammadpour, Motahareh; Stahler, Steven W.

    2013-08-01

    We investigate, through a series of numerical calculations, the evolution of dense cores that are accreting external gas up to and beyond the point of star formation. Our model clouds are spherical, unmagnetized configurations with fixed outer boundaries, across which gas enters subsonically. When we start with any near-equilibrium state, we find that the cloud's internal velocity also remains subsonic for an extended period, in agreement with observations. However, the velocity becomes supersonic shortly before the star forms. Consequently, the accretion rate building up the protostar is much greater than the benchmark value c_s^3/G, where cs is the sound speed in the dense core. This accretion spike would generate a higher luminosity than those seen in even the most embedded young stars. Moreover, we find that the region of supersonic infall surrounding the protostar races out to engulf much of the cloud, again in violation of the observations, which show infall to be spatially confined. Similar problematic results have been obtained by all other hydrodynamic simulations to date, regardless of the specific infall geometry or boundary conditions adopted. Low-mass star formation is evidently a quasi-static process, in which cloud gas moves inward subsonically until the birth of the star itself. We speculate that magnetic tension in the cloud's deep interior helps restrain the infall prior to this event.

  20. Numerical study of homogeneous nanodroplet growth.

    PubMed

    Quang, Tran Si Bui; Leong, Fong Yew; Mirsaidov, Utkur M

    2015-01-15

    We investigate the axisymmetric homogeneous growth of 10-100 nm water nanodroplets on a substrate surface. The main mechanism of droplet growth is attributed to the accumulation of laterally diffusing water monomers, formed by the absorption of water vapour in the environment onto the substrate. Under assumptions of quasi-steady thermodynamic equilibrium, the nanodroplet evolves according to the augmented Young-Laplace equation. Using continuum theory, we model the dynamics of nanodroplet growth including the coupled effects of disjoining pressure, contact angle and monomer diffusion. Our numerical results show that the initial droplet growth is dominated by monomer diffusion, and the steady late growth rate of droplet radius follows a power law of 1/3, which is unaffected by the substrate disjoining pressure. Instead, the disjoining pressure modifies the growth rate of the droplet height, which then follows a power law of 1/4. We demonstrate how spatial depletion of monomers could lead to a growth arrest of the nanodroplet, as observed experimentally. This work has further implications on the growth kinetics, transport and phase transition of liquids at the nanoscale. PMID:25454424

  1. Numerical studies of 2-dimensional flows

    NASA Technical Reports Server (NTRS)

    Moretti, G.

    1985-01-01

    A formulation of the lambda scheme for the analysis of two dimensional inviscid, compressible, unsteady transonic flows is presented. The scheme uses generalized Riemann variables to determine the appropriate two point, one sided finite difference approximation for each derivative in the unsteady Euler equations. These finite differences are applied at the predictor and corrector levels with shock updating at each level. The weaker oblique shocks are captured, but strong near normal shocks are fitted into the flow using the Rankine-Hugoniot relations. This code is demonstrated with a numerical example of a duct flow problem with developing normal and oblique shock waves. The technique is implemented in a code which has been made efficient by streamlining to a minimal number of operations and by eliminating branch statements. The scheme is shown to provide an accurate analysis of the flow, including formation, motions, and interactions of shocks; the results obtained on a relatively coarse mesh are comparable to those obtained by other methods on much finer meshes.

  2. Resonant Ultrasound Studies of Quasi-2D NaxCoO2 (0.7 <= x <= 0.77)

    NASA Astrophysics Data System (ADS)

    Cagle, Timothy; Keppens, Veerle; Jin, Rongying

    2008-03-01

    Cobalt-based oxides have been shown to represent a new paradigm for a good thermoelectric material. These materials violate all of the traditional guidelines to help identify a potentially good thermoelectric material. In order to obtain a better understanding of its physical properties, we have initiated the synthesis of layered NaxCoO2, and started a study of the elastic properties of these materials using Resonant Ultrasound Spectroscopy (RUS). In this work, we discuss our results for sodium cobaltate compounds with 0.7 <= x <= 0.77. Single crystals were successfully grown in a floating-zone furnace, and the elastic constants have been measured as a function of temperature (5-300K) and in magnetic fields up to 5 Tesla. The resulting plots of elasticity vs. temperature clearly reflect a transition below 50 K, which is believed to be associated with rearrangement of the Na-atoms between the CoO2 planes.

  3. PBE-DFT theoretical study of organic photovoltaic materials based on thiophene with 1D and 2D periodic boundary conditions

    NASA Astrophysics Data System (ADS)

    Saïl, K.; Bassou, G.; Gafour, M. H.; Miloua, F.

    2015-12-01

    Conjugated organic systems such as thiophene are interesting topics in the field of organic solar cells. We theoretically investigate π-conjugated polymers constituted by n units ( n = 1-11) based on the thiophene (Tn) molecule. The computations of the geometries and electronic structures of these compounds are performed using the density functional theory (DFT) at the 6-31 G( d, p) level of theory and the Perdew-Burke-Eenzerhof (PBE) formulation of the generalized gradient approximation with periodic boundary conditions (PBCs) in one (1D) and two (2D) dimensions. Moreover, the electronic properties (HOCO, LUCO, E gap, V oc, and V bi) are determined from 1D and 2D PBC to understand the effect of the number of rings in polythiophene. The absorption properties—excitation energies ( E ex), the maximal absorption wavelength (λmax), oscillator strengths, and light harvesting—efficiency are studied using the time-dependent DFT method. Our studies show that changing the number of thiophene units can effectively modulate the electronic and optical properties. On the other hand, our work demonstrates the efficiency of theoretical calculation in the PBCs.

  4. PBE–DFT theoretical study of organic photovoltaic materials based on thiophene with 1D and 2D periodic boundary conditions

    SciTech Connect

    Saïl, K. Bassou, G.; Gafour, M. H.; Miloua, F.

    2015-12-15

    Conjugated organic systems such as thiophene are interesting topics in the field of organic solar cells. We theoretically investigate π-conjugated polymers constituted by n units (n = 1–11) based on the thiophene (Tn) molecule. The computations of the geometries and electronic structures of these compounds are performed using the density functional theory (DFT) at the 6–31 G(d, p) level of theory and the Perdew–Burke–Eenzerhof (PBE) formulation of the generalized gradient approximation with periodic boundary conditions (PBCs) in one (1D) and two (2D) dimensions. Moreover, the electronic properties (HOCO, LUCO, E{sub gap}, V{sub oc}, and V{sub bi}) are determined from 1D and 2D PBC to understand the effect of the number of rings in polythiophene. The absorption properties—excitation energies (E{sub ex}), the maximal absorption wavelength (λ{sub max}), oscillator strengths, and light harvesting—efficiency are studied using the time-dependent DFT method. Our studies show that changing the number of thiophene units can effectively modulate the electronic and optical properties. On the other hand, our work demonstrates the efficiency of theoretical calculation in the PBCs.

  5. Studying fast wave propagation and absorption at any cyclotron harmonic using a 2D finite element area coordinates wave equation solver

    SciTech Connect

    Lerche, Ernesto; Van Eester, Dirk

    2011-12-23

    Fourier analysis in the poloidal direction is a standard ingredient in present-day 2D wave equation solvers describing radio frequency waves in hot tokamak plasmas. Although a powerful and elegant technique, Fourier analysis has the disadvantage that a large number of modes is needed to describe the field pattern on a magnetic surface if a short wavelength mode exists on any - even very small - subpart of the particle trajectory. The present paper examines the potential of a method that does not suffer from this drawback: a finite element technique relying on simple linear or cubic area base functions that are defined on irregular elementary surfaces of triangular shape. The wave equation is solved in its weak Galerkin variational form and for realistic 2D tokamak geometry, accounting for the toroidal curvature but assuming the toroidal angle is ignorable, allowing to study the wave pattern for each of the independent toroidal modes excited by the antenna individually.The locally uniform full hot plasma dielectric tensor to all orders in finite Larmor radius was adopted. As the main intended application is the study of fast wave behavior (heating and current drive) at arbitrary harmonics, the wave vector complex amplitude appearing in the dielectric tensor is determined through a local dispersion root evaluation. High frequency fast wave propagation and damping is provided as an illustration in view of possible application of this type of current drive in future high density reactor-like tokamaks.

  6. [Comparative proteomics study of different processing technology for pilose antler using iTRAQ technology coupled with 2D LC-MS].

    PubMed

    Jin, Meng-ya; Dong, Ling; Luo, Yuan-ming; Yu, Li; Mo, Mei; Hou, Cheng-bo; Li, Zhi-yuan

    2015-12-01

    This study was designed to use iTRAQ technology coupled with 2D LC-MS/MS to study the comparative proteomics of different processing technology for pilose antler. 1015 proteins were identified with 2D LC combined with MOLDI TOF/TOF mass spectrometry. Comparative analysis with Protein Pilot (Version 4.5) revealed that 87 proteins were changed (P ≤ 0.05, the ratio of > 1.50 or < 0.60 as the threshold selection of difference proteins), of which 24 were up regulated and 33 were down regulated in the traditional frying process (TFP) compared with the fresh pilose antler (P ≤ 0.05). 7 significant different proteins (P ≤ 0.001), most of these significantly changed proteins were found to be involved in calcium ion binding and ATP binding associated with human healthy. Freeze drying with protective agent (FDP) (Trehalose) can improve the content of significantly different proteins (P ≤ 0.001) including Collagen alpha-1 (XII) chain (COL12A1) and Collagen alpha-1 (II) chain (COL2A1). The significant function involves in platelets activating, maintenance of spermatogonium, and disorder expression in tumor cells. The functional annotation by Hierarchical clustering and GO (gene ontology) showed that the main molecule functions of the proteins significantly changed in these processes were involved in binding (52.7%), catalytic (25.3%), structural molecule and transporter (6.6%). PMID:27169289

  7. The relationship between substructure in 2D X-ray surface brightness images and weak-lensing mass maps of galaxy clusters: a simulation study

    NASA Astrophysics Data System (ADS)

    Powell, Leila C.; Kay, Scott T.; Babul, Arif

    2009-12-01

    Recent X-ray and weak-lensing observations of galaxy clusters have revealed that the hot gas does not always directly trace the dark matter within these systems. Such configurations are extremely interesting. They offer a new vista on to the complex interplay between gravity and baryonic physics, and may even be used as indicators of the clusters' dynamical state. In this paper, we undertake a study to determine what insight can be reliably gleaned from the comparison of the X-ray and the weak-lensing mass maps of galaxy clusters. We do this by investigating the two-dimensional (2D) substructure within three high-resolution cosmological simulations of galaxy clusters. Our main results focus on non-radiative gas dynamics, but we also consider the effects of radiative cooling at high redshift. For our analysis, we use a novel approach, based on unsharp-masking, to identify substructures in 2D surface mass density and X-ray surface brightness maps. At full resolution (~15h-1 kpc), this technique is capable of identifying almost all self-bound dark matter subhaloes with M > 1012h-1Msolar. We also report a correlation between the mass of a subhalo and the area of its corresponding 2D detection; such a correlation, once calibrated, could provide a useful estimator for substructure mass. Comparing our 2D mass and X-ray substructures, we find a surprising number of cases where the matching fails: around one-third of galaxy-sized substructures have no X-ray counterpart. Some interesting cases are also found at larger masses, in particular the cores of merging clusters where the situation can be complex. Finally, we degrade our mass maps to what is currently achievable with weak-lensing observations (~100h-1kpc at z = 0.2). While the completeness mass limit increases by around an order of magnitude, a mass-area correlation remains. Our paper clearly demonstrates that the next generation of lensing surveys should start to reveal a wealth of information on cluster substructure.

  8. 2D-1H proton magnetic resonance spectroscopic imaging study on brain metabolite alterations in patients with diabetic hypertension.

    PubMed

    Cao, Zhen; Ye, Bi-Di; Shen, Zhi-Wei; Cheng, Xiao-Fang; Yang, Zhong-Xian; Liu, Yan-Yan; Wu, Ren-Hua; Geng, Kuan; Xiao, Ye-Yu

    2015-06-01

    The aim of the present study was to investigate the possible metabolic alterations in the frontal cortex and parietal white matter in patients with diabetic hypertension (DHT) using proton magnetic resonance (MR) spectroscopic imaging. A total of 33 DHT patients and 30 healthy control subjects aged between 45 and 75 were included in the present study. All subjects were right‑handed. The spectroscopy data were collected using a GE Healthcare 1.5T MR scanner. The multi‑voxels were located in the semioval center (repetition time/echo time=1,500 ms/35 ms). The area of interest was 8x10x2 cm in volume and contained the two sides of the frontal cortex and the parietal white matter. The spectra data were processed using SAGE software. The ratios of brain metabolite concentrations, particularly for N‑acetylaspartate (NAA)/creatine (Cr) and Choline (Cho)/Cr were calculated and analyzed. Statistical analyses were performed using SPSS 17.0. The NAA/Cr ratio of the bilateral prefrontal cortex of the DHT group was significantly lower than that of the control group (left t=‑7.854, P=0.000 and right t=‑5.787, P=0.000), The Cho/Cr ratio was also much lower than the control group (left t=2.422, P=0.024 and right t=2.920, P=0.007). NAA/Cr ratio of the left parietal white matter of the DHT group was extremely lower than that of the control group (t=‑4.199, P=0.000). Therefore, DHT may result in metabolic disorders in the frontal cortex and parietal white matter but the metabolic alterations are different in various regions of the brain. The alteration in cerebral metabolism is associated with diabetes and hypertension. The ratios of NAA/Cr and Cho/Cr are potential metabolic markers for the brain damage induced by DHT. PMID:25652580

  9. Rational design, synthesis and 2D-QSAR study of novel vasorelaxant active benzofuran-pyridine hybrids.

    PubMed

    Srour, Aladdin M; Abd El-Karim, Somaia S; Saleh, Dalia O; El-Eraky, Wafaa I; Nofal, Zeinab M

    2016-05-15

    Reaction of 3-aryl-1-(benzofuran-2-yl)-2-propen-1-ones 3a-c with malononitrile in the presence of sufficient amount of sodium alkoxide in the corresponding alcohol proceeds in a regioselective manner to afford 2-alkoxy-4-aryl-6-(benzofuran-2-yl)-3-pyridinecarbonitriles 4-37, which also obtained by treating ylidenemalononitriles 6a-q with 2-acetylbenzofuran 1 in the presence of sufficient amount of sodium alkoxide in the corresponding alcohol. The new chemical entities showed significant vasodilation properties using isolated thoracic aortic rings of rats pre-contracted with norepinephrine hydrochloride standard technique. Compounds 11, 16, 21, 24 and 30 exhibited remarkable activity compared with amiodarone hydrochloride the reference standard used in the present study. CODESSA-Pro software was employing to obtain a statistically significant QSAR model describing the bioactivity of the newly synthesized analogs (N=31, n=5, R(2)=0.846, R(2)cvOO=0.765, R(2)cvMO=0.778, F=27.540. s(2)=0.002). PMID:27048942

  10. Remediation of Chlorinated Solvent Plumes Using In-Situ Air Sparging—A 2-D Laboratory Study

    PubMed Central

    Adams, Jeffrey A.; Reddy, Krishna R.; Tekola, Lue

    2011-01-01

    In-situ air sparging has evolved as an innovative technique for soil and groundwater remediation impacted with volatile organic compounds (VOCs), including chlorinated solvents. These may exist as non-aqueous phase liquid (NAPL) or dissolved in groundwater. This study assessed: (1) how air injection rate affects the mass removal of dissolved phase contamination, (2) the effect of induced groundwater flow on mass removal and air distribution during air injection, and (3) the effect of initial contaminant concentration on mass removal. Dissolved-phase chlorinated solvents can be effectively removed through the use of air sparging; however, rapid initial rates of contaminant removal are followed by a protracted period of lower removal rates, or a tailing effect. As the air flow rate increases, the rate of contaminant removal also increases, especially during the initial stages of air injection. Increased air injection rates will increase the density of air channel formation, resulting in a larger interfacial mass transfer area through which the dissolved contaminant can partition into the vapor phase. In cases of groundwater flow, increased rates of air injection lessened observed downward contaminant migration effect. The air channel network and increased air saturation reduced relative hydraulic conductivity, resulting in reduced groundwater flow and subsequent downgradient contaminant migration. Finally, when a higher initial TCE concentration was present, a slightly higher mass removal rate was observed due to higher volatilization-induced concentration gradients and subsequent diffusive flux. Once concentrations are reduced, a similar tailing effect occurs. PMID:21776228

  11. An Ion’s Perspective on the Molecular Motions of Nano-confined Water: A 2D IR Spectroscopy Study

    PubMed Central

    Singh, Prabhat K; Kuroda, Daniel G.; Hochstrasser, Robin M.

    2013-01-01

    The vibrational population relaxation and the hydration shell dynamics of the symmetric tricyanomethanide (TCM) anion is investigated in AOT reverse micelle as a function of the water pool radius. Two-dimensional infrared spectroscopy in combination with linear absorption and ultrafast IR pump-probe spectroscopy is utilized in this study. Spectroscopic measurements show that the anion has two bands in the 2160 – 2175 cm−1 region, each with its own spectroscopic signatures. Analysis of the vibrational dynamics shows that the two vibrational bands are consistent with the anion located either at the interface or in the water pool. The sensitivity of the TCM anion to the environment allows us to unequivocally monitor the vibrational and hydration dynamics of the anion in those two different environments. TCM anion located at the interface does not show any significant variation of the vibrational dynamics with the water pool size. On the contrary, the TCM anion inside the water pool exhibits a large and non-linear variation of the vibrational lifetime and the frequency-frequency correlation time with the pool radius. Moreover for the solvated anion in water pools of 49 Å in radius (W0=30), the vibrational lifetime reaches the values observed for the anion in bulk water while the frequency-frequency correlation time shows a characteristic time higher than that observed in the bulk. In addition, for the first time a model is developed and used to explain the observed non-linear variation of the spectroscopic observables with the pool size. This model attributes the changes in the vibrational dynamics of the TCM anion in the water pool to the slow and radius dependent water dynamics present in the confined environment of a reverse micelle. PMID:23855349

  12. A 2D multiwavelength study of the ionized gas and stellar population in the giant H II region NGC 588

    NASA Astrophysics Data System (ADS)

    Monreal-Ibero, A.; Relaño, M.; Kehrig, C.; Pérez-Montero, E.; Vílchez, J. M.; Kelz, A.; Roth, M. M.; Streicher, O.

    2011-05-01

    Giant H II regions (GHIIRs) in nearby galaxies are a local sample in which we can study in detail processes in the interaction of gas, dust and newly formed stars which are analogous to those which occurred in episodes of higher intensity in which much of the current stellar population was born. Here, we present an analysis of NGC 588, a GHIIR in M33, based on optical Integral Field Spectroscopy data obtained with the Potsdam Multi-Aperture Spectrophotometer at the 3.5-m telescope of the Calar Alto Observatory, CAHA, together with Spitzer infrared images at 8 and 24 μm. The extinction distribution measured in the optical shows complex structure, with three maxima which correlate in position with those of the emission at 24 and 8 μm. Furthermore, the Hα luminosity absorbed by the dust within the H II region reproduces the structure observed in the 24-μm image, supporting the use of the 24-μm band as a valid tracer of recent star formation. A velocity difference of ˜50 km s-1 was measured between the areas of high and low surface brightness, which would be expected if NGC 588 were an evolved GHIIR. We have carefully identified the areas which contribute most to the line ratios measured in the integrated spectrum. Those line ratios which are used in diagnostic diagrams proposed by Baldwin, Phillips & Terlevich (i.e. the BPT diagrams) show a larger range of variation in the low surface brightness areas. The ranges are ˜0.5-1.2 dex for [N II]λ6584/Hα, 0.7-1.7 dex for [S II]λλ6717,6731/Hα and 0.3-0.5 dex for [O III]λ5007/Hβ, with higher values of [N II]λ6584/Hα and [S II]λλ6717,6731/Hα, and lower values of [O III]λ5007/Hβ in the areas of lower surface brightness. Ratios corresponding to large ionization parameter (U) are found between the peak of the emission in Hβ and the main ionizing source decreasing radially outwards within the region. Differences between the integrated and local values of the U tracers can be as high as ˜0.8 dex, notably when

  13. Numerical study of fluid motion in bioreactor with two mixers

    NASA Astrophysics Data System (ADS)

    Zheleva, I.; Lecheva, A.

    2015-10-01

    Numerical study of hydrodynamic laminar behavior of a viscous fluid in bioreactor with multiple mixers is provided in the present paper. The reactor is equipped with two disk impellers. The fluid motion is studied in stream function-vorticity formulation. The calculations are made by a computer program, written in MATLAB. The fluid structure is described and numerical results are graphically presented and commented.

  14. Numerical study of fluid motion in bioreactor with two mixers

    SciTech Connect

    Zheleva, I.; Lecheva, A.

    2015-10-28

    Numerical study of hydrodynamic laminar behavior of a viscous fluid in bioreactor with multiple mixers is provided in the present paper. The reactor is equipped with two disk impellers. The fluid motion is studied in stream function-vorticity formulation. The calculations are made by a computer program, written in MATLAB. The fluid structure is described and numerical results are graphically presented and commented.

  15. Numerical and experimental study of blowing jet on a high lift airfoil

    NASA Astrophysics Data System (ADS)

    Bobonea, A.; Pricop, M. V.

    2013-10-01

    Active manipulation of separated flows over airfoils at moderate and high angles of attack in order to improve efficiency or performance has been the focus of a number of numerical and experimental investigations for many years. One of the main methods used in active flow control is the usage of blowing devices with constant and pulsed blowing. Through CFD simulation over a 2D high-lift airfoil, this study is trying to highlight the impact of pulsed blowing over its aerodynamic characteristics. The available wind tunnel data from INCAS low speed facility are also beneficial for the validation of the numerical analysis. This study intends to analyze the impact of the blowing jet velocity and slot geometry on the efficiency of an active flow control.

  16. Excitons and exciton-phonon interactions in 2D MoS2 , WS2 and WSe2 studied by resonance Raman spectroscopy

    NASA Astrophysics Data System (ADS)

    Pimenta, Marcos; Del Corro, Elena; Carvalho, Bruno; Malard, Leandro; Alves, Juliana; Fantini, Cristiano; Terrones, Humberto; Elias, Ana Laura; Terrones, Mauricio

    The 2D materials exhibit a very strong exciton binding energy, and the exciton-phonon coupling plays an important role in their optical properties. Resonance Raman spectroscopy (RRS) is a very useful tool to provide information about excitons and their couplings with phonons. We will present in this work a RRS study of different samples of 2D transition metal dichalcogenides (MoS2, WS2 and WSe2) with one, two and three layers (1L, 2L, 3L) and bulk samples, using more than 30 different laser excitation lines covering the visible range. We have observed that all Raman features are enhanced by resonances with excitonic transitions. From the laser energy dependence of the Raman excitation profile (REP) we obtained the energies of the excitonic states and their dependence with the number of atomic layers.. In the case of MoS2, we observed that the electron-phonon coupling is symmetry dependent, and our results provide experimental evidence of the C exciton recently predicted theoretically. The RRS results WSe2 show that the Raman modes are enhanced by the excited excitonic states and we will present the dependence of the excited states energies on the number of layers.

  17. Analysis of B-Raf[Formula: see text] inhibitors using 2D and 3D-QSAR, molecular docking and pharmacophore studies.

    PubMed

    Aalizadeh, Reza; Pourbasheer, Eslam; Ganjali, Mohammad Reza

    2015-11-01

    In the present work, a molecular modeling study was carried out using 2D and 3D quantitative structure-activity relationships for the various series of compounds known as B-Raf[Formula: see text] inhibitors. For 2D-QSAR analysis, a linear model was developed by MLR based on GA-OLS with appropriate results [Formula: see text], which was validated by several external validation techniques. To perform a 3D-QSAR analysis, CoMFA and CoMSIA methods were used. The selected CoMFA model could provide reliable statistical values [Formula: see text] based on the training set in the biases of the selected alignment. Using the same selected alignment, a statistically reliable CoMSIA model, out of thirty-one different combinations, was also obtained [Formula: see text]. The predictive accuracy of the derived models was rigorously evaluated with the external test set of nineteen compounds based on several validation techniques. Molecular docking simulations and pharmacophore analyses were also performed to derive the true conformations of the most potent inhibitors with B-Raf[Formula: see text] kinase. PMID:26276566

  18. Study of the cyclodextrin and its complexation with 2,4-dinitrobenzoic acid through photophysical properties and 2D NMR spectroscopy

    NASA Astrophysics Data System (ADS)

    Stalin, T.; Srinivasan, K.; Sivakumar, K.

    2014-02-01

    The host-guest inclusion complex formation of 2,4-dinitrobenzoic acid (2,4-DNB) with nano-hydrophobic cavity of β-cyclodextrin (β-CD) in solution phase were studied by UV-visible spectrophotometer and electrochemical method (cyclic voltammetry, CV). The prototropic behaviors of 2,4-DNB with and without β-CD and the ground state acidity constant (pKa) of host-guest inclusion complex (2,4-DNB-β-CD) was studied. The binding constant of the inclusion complex at 303 K was calculated using Benesi-Hildebrand plot. The solid inclusion complex formation between β-CD and 2,4-DNB was confirmed by 1H NMR, 2D 1H NMR (ROESY), FT-IR, XRD and SEM analysis. A schematic representation of this inclusion process is proposed by molecular docking studies using the patch dock server.

  19. A numerical study of bifurcations in a barotropic shear flow

    NASA Technical Reports Server (NTRS)

    Huerre, P.; Keefe, L. R.; Meunier, G.; Redekopp, L. G.; Spalart, P. R.; Rogers, M. M.

    1988-01-01

    In the last few years, more and more evidence has emerged suggesting that transition to turbulence may be viewed as a succession of bifurcations to deterministic chaos. Most experimental and numerical observations have been restricted to Rayleigh-Benard convection and Taylor-Couette flow between concentric cylinders. An attempt is made to accurately describe the bifurcation sequence leading to chaos in a 2-D temporal free shear layer on the beta-plane. The beta-plane is a locally Cartesian reduction of the equations describing the dynamicss of a shallow layer of fluid on a rotating spherical planet. It is a valid model for large scale flows of interest in meteorology and oceanography.

  20. Changes in the Capillarity of the Rat Extensor Digitorum Longus Muscle 4 Weeks after Nerve Injury Studied by 2D Measurement Methods.

    PubMed

    Čebašek, Vita; Ribarič, Samo

    2016-01-01

    We have previously shown by 3D study that 2 weeks after nerve injury there was no change in the length of capillaries per muscle fibre length in rat extensor digitorum longus muscle (EDL). The primary goal of the present 2D study was to determine the capillarity of rat EDL 4 weeks after various modes of nerve injury. Additionally, we wished to calculate the same capillary/fibre parameters that were used in our 3D stereological study. EDL muscles derived from denervated (4 weeks after nerve injury), re-innervated (4 weeks after two successive nerve crushes) and age-matched controls from the beginning (CON-1) and the end (CON-2) of the experiment were analysed in two ways. Global indices of capillarity, such as capillary density (CD) and capillary/fibre (C/F) ratio, were determined by automatic analysis, local indices as the number (CAF) and the length of capillaries around individual muscle fibres (Lcap) in relation to muscle fibre size were estimated manually by tracing the muscle fibre outlines and the transversally and longitudinally cut segments of capillaries seen in 5-µm-thin muscle cross sections. Four weeks after both types of nerve injury, CD increased in comparison to the CON-2 group (p < 0.001) due to atrophied muscle fibres in denervated muscles and probably proliferation of capillaries in re-innervated ones. Higher C/F, CAF (both p < 0.001) and Lcap (p < 0.01) in re-innervated than denervated EDL confirmed this assumption. Calculated capillary/fibre parameters were comparable to our previous 3D study, which strengthens the practical value to the adapted 2D method used in this study. PMID:27023720

  1. Large Area Synthesis of 2D Materials

    NASA Astrophysics Data System (ADS)

    Vogel, Eric

    Transition metal dichalcogenides (TMDs) have generated significant interest for numerous applications including sensors, flexible electronics, heterostructures and optoelectronics due to their interesting, thickness-dependent properties. Despite recent progress, the synthesis of high-quality and highly uniform TMDs on a large scale is still a challenge. In this talk, synthesis routes for WSe2 and MoS2 that achieve monolayer thickness uniformity across large area substrates with electrical properties equivalent to geological crystals will be described. Controlled doping of 2D semiconductors is also critically required. However, methods established for conventional semiconductors, such as ion implantation, are not easily applicable to 2D materials because of their atomically thin structure. Redox-active molecular dopants will be demonstrated which provide large changes in carrier density and workfunction through the choice of dopant, treatment time, and the solution concentration. Finally, several applications of these large-area, uniform 2D materials will be described including heterostructures, biosensors and strain sensors.

  2. The double pendulum: a numerical study

    NASA Astrophysics Data System (ADS)

    Calvão, A. M.; Penna, T. J. P.

    2015-07-01

    Analysis and characterization of dynamical systems is a common task in computational physics. It frequently demands new algorithms for finding solutions and new techniques for analysing the results. Here we review some of these algorithms and techniques in the study of the double pendulum, which, despite being a very simple mechanical system, can display complex behaviour. Even though it has been studied before (Yu and Bi 1998 J. Sound Vib. 217 691736; Stachowiak and Okada 2006 Chaos, Solitons & Fractals 29 417422; Rafat, Wheatland and Bedding 2009 Am. J. Phys. 77 216-23; Levien and Tan 1993 Am. J. Phys. 61 103844), here we present a deeper discussion of the several methods and algorithms that are used in typical studies of dynamical systems. In addition, we present new results obtained through techniques commonly used in the analysis of complex systems.

  3. Improved Large-Scale Inundation Modelling by 1D-2D Coupling and Consideration of Hydrologic and Hydrodynamic Processes - a Case Study in the Amazon

    NASA Astrophysics Data System (ADS)

    Hoch, J. M.; Bierkens, M. F.; Van Beek, R.; Winsemius, H.; Haag, A.

    2015-12-01

    Understanding the dynamics of fluvial floods is paramount to accurate flood hazard and risk modeling. Currently, economic losses due to flooding constitute about one third of all damage resulting from natural hazards. Given future projections of climate change, the anticipated increase in the World's population and the associated implications, sound knowledge of flood hazard and related risk is crucial. Fluvial floods are cross-border phenomena that need to be addressed accordingly. Yet, only few studies model floods at the large-scale which is preferable to tiling the output of small-scale models. Most models cannot realistically model flood wave propagation due to a lack of either detailed channel and floodplain geometry or the absence of hydrologic processes. This study aims to develop a large-scale modeling tool that accounts for both hydrologic and hydrodynamic processes, to find and understand possible sources of errors and improvements and to assess how the added hydrodynamics affect flood wave propagation. Flood wave propagation is simulated by DELFT3D-FM (FM), a hydrodynamic model using a flexible mesh to schematize the study area. It is coupled to PCR-GLOBWB (PCR), a macro-scale hydrological model, that has its own simpler 1D routing scheme (DynRout) which has already been used for global inundation modeling and flood risk assessments (GLOFRIS; Winsemius et al., 2013). A number of model set-ups are compared and benchmarked for the simulation period 1986-1996: (0) PCR with DynRout; (1) using a FM 2D flexible mesh forced with PCR output and (2) as in (1) but discriminating between 1D channels and 2D floodplains, and, for comparison, (3) and (4) the same set-ups as (1) and (2) but forced with observed GRDC discharge values. Outputs are subsequently validated against observed GRDC data at Óbidos and flood extent maps from the Dartmouth Flood Observatory. The present research constitutes a first step into a globally applicable approach to fully couple

  4. High divergent 2D grating

    NASA Astrophysics Data System (ADS)

    Wang, Jin; Ma, Jianyong; Zhou, Changhe

    2014-11-01

    A 3×3 high divergent 2D-grating with period of 3.842μm at wavelength of 850nm under normal incidence is designed and fabricated in this paper. This high divergent 2D-grating is designed by the vector theory. The Rigorous Coupled Wave Analysis (RCWA) in association with the simulated annealing (SA) is adopted to calculate and optimize this 2D-grating.The properties of this grating are also investigated by the RCWA. The diffraction angles are more than 10 degrees in the whole wavelength band, which are bigger than the traditional 2D-grating. In addition, the small period of grating increases the difficulties of fabrication. So we fabricate the 2D-gratings by direct laser writing (DLW) instead of traditional manufacturing method. Then the method of ICP etching is used to obtain the high divergent 2D-grating.

  5. Comparative numerical study on the optimal vulcanization of rubber compounds through traditional curing and microwaves

    NASA Astrophysics Data System (ADS)

    Milani, Gabriele; Milani, Federico

    2012-12-01

    The main problem in the industrial production process of thick EPM/EPDM elements is constituted by the different temperatures which undergo internal (cooler) and external regions. Indeed, while internal layers remain essentially under-vulcanized, external coating is always over-vulcanized, resulting in an overall average tensile strength insufficient to permit the utilization of the items in several applications where it is required a certain level of performance. Possible ways to improve rubber output mechanical properties include a careful calibration of exposition time and curing temperature in traditional heating or a vulcanization through innovative techniques, such as microwaves. In the present paper, a comprehensive numerical model able to give predictions on the optimized final mechanical properties of vulcanized 2D and 3D thick rubber items is presented and applied to a meaningful example of engineering interest. A detailed comparative numerical study is finally presented in order to establish pros and cons of traditional vulcanization vs microwaves curing.

  6. Application of 2D Non-Graphene Materials and 2D Oxide Nanostructures for Biosensing Technology

    PubMed Central

    Shavanova, Kateryna; Bakakina, Yulia; Burkova, Inna; Shtepliuk, Ivan; Viter, Roman; Ubelis, Arnolds; Beni, Valerio; Starodub, Nickolaj; Yakimova, Rositsa; Khranovskyy, Volodymyr

    2016-01-01

    The discovery of graphene and its unique properties has inspired researchers to try to invent other two-dimensional (2D) materials. After considerable research effort, a distinct “beyond graphene” domain has been established, comprising the library of non-graphene 2D materials. It is significant that some 2D non-graphene materials possess solid advantages over their predecessor, such as having a direct band gap, and therefore are highly promising for a number of applications. These applications are not limited to nano- and opto-electronics, but have a strong potential in biosensing technologies, as one example. However, since most of the 2D non-graphene materials have been newly discovered, most of the research efforts are concentrated on material synthesis and the investigation of the properties of the material. Applications of 2D non-graphene materials are still at the embryonic stage, and the integration of 2D non-graphene materials into devices is scarcely reported. However, in recent years, numerous reports have blossomed about 2D material-based biosensors, evidencing the growing potential of 2D non-graphene materials for biosensing applications. This review highlights the recent progress in research on the potential of using 2D non-graphene materials and similar oxide nanostructures for different types of biosensors (optical and electrochemical). A wide range of biological targets, such as glucose, dopamine, cortisol, DNA, IgG, bisphenol, ascorbic acid, cytochrome and estradiol, has been reported to be successfully detected by biosensors with transducers made of 2D non-graphene materials. PMID:26861346

  7. Application of 2D Non-Graphene Materials and 2D Oxide Nanostructures for Biosensing Technology.

    PubMed

    Shavanova, Kateryna; Bakakina, Yulia; Burkova, Inna; Shtepliuk, Ivan; Viter, Roman; Ubelis, Arnolds; Beni, Valerio; Starodub, Nickolaj; Yakimova, Rositsa; Khranovskyy, Volodymyr

    2016-01-01

    The discovery of graphene and its unique properties has inspired researchers to try to invent other two-dimensional (2D) materials. After considerable research effort, a distinct "beyond graphene" domain has been established, comprising the library of non-graphene 2D materials. It is significant that some 2D non-graphene materials possess solid advantages over their predecessor, such as having a direct band gap, and therefore are highly promising for a number of applications. These applications are not limited to nano- and opto-electronics, but have a strong potential in biosensing technologies, as one example. However, since most of the 2D non-graphene materials have been newly discovered, most of the research efforts are concentrated on material synthesis and the investigation of the properties of the material. Applications of 2D non-graphene materials are still at the embryonic stage, and the integration of 2D non-graphene materials into devices is scarcely reported. However, in recent years, numerous reports have blossomed about 2D material-based biosensors, evidencing the growing potential of 2D non-graphene materials for biosensing applications. This review highlights the recent progress in research on the potential of using 2D non-graphene materials and similar oxide nanostructures for different types of biosensors (optical and electrochemical). A wide range of biological targets, such as glucose, dopamine, cortisol, DNA, IgG, bisphenol, ascorbic acid, cytochrome and estradiol, has been reported to be successfully detected by biosensors with transducers made of 2D non-graphene materials. PMID:26861346

  8. A Numerical Study of Nonlinear Wave Interactions

    NASA Astrophysics Data System (ADS)

    de Bakker, A.; Tissier, M.; Ruessink, G.

    2014-12-01

    Nonlinear triad interactions redistribute energy among a wave field, which transforms the shape of the incident short waves (f = 0.05 - 2 Hz) and generates energy at infragravity frequencies (f = 0.005-0.05 Hz). Recently, it has been suggested that infragravity energy may dissipate by energy transfers from infragravity frequencies to either the (former) short-wave spectral peak, or through infragravity-infragravity self-interactions that cause the infragravity waves to steepen and to eventually break. To investigate these infragravity dissipation mechanisms, we use the non-hydrostatic SWASH model. In this study, we first validate the model with the high-resolution GLOBEX laboratory data set and then explore the dependence of the energy transfers, with a focus on infragravity frequencies, on beach slope. Consistent with previous studies we find that SWASH is able to reproduce the transformation and corresponding nonlinear energy transfers of shoreward propagating waves to great detail. Bispectral analysis is used to study the coupling between wave frequencies; nonlinear energy transfers are then quantified using the Boussinesq coupling coefficient. To obtain more detailed insight we divide the nonlinear interactions in four categories based on triads including 1) infragravity frequencies only, 2) two infragravity frequencies and one short-wave frequency, 3) one infragravity frequency and two short-wave frequencies and 4) short-wave frequencies only. Preliminary results suggest that interactions are rather weak on gently beach slopes (1:80) and, in the innermost part of the surf zone, are dominated by infragravity-infragravity interactions. On steeper slopes (1:20), interactions are stronger, but entirely dominated by those involving short-wave frequencies only. The dependence of the transfers on offshore wave conditions and beach shape will be explored too. Funded by NWO.

  9. A Numerical Study of Superconducting Cavity Components

    SciTech Connect

    B.C. Yunn; J.J. Bisognano

    1990-09-10

    Computer programs which solve Maxwell's equations in three dimensions are becoming an invaluable tool in the design of RF structures for particle accelerators. In particular, the lack of cylindrical symmetry of superconducting cavities with waveguide couplers demands a 3-D analysis for a reasonable description of a number of important phenomena. A set of codes, collectively known as MAFIA, developed by Weiland and his collaborators, has been used at CEBAF to study its five-cell superconducting accelerating cavities. The magnitude of RF crosstalk between cavities is found to depend critically on the breaking of cylindrical symmetry by the fundamental power couplers. A model of the higher order mode coupler exhibits an unexpected mode which is in good agreement with measurement.

  10. Study of non-axisymmetric divertor footprints using 2-D IR and visible cameras and a 3-D heat conduction solver in NSTX

    NASA Astrophysics Data System (ADS)

    Ahn, J.-W.; Gan, K. F.; Scotti, F.; Lore, J. D.; Maingi, R.; Canik, J. M.; Gray, T. K.; McLean, A. G.; Roquemore, A. L.; Soukhanovskii, V. A.

    2013-07-01

    Toroidally non-axisymmetric divertor profiles during the 3-D field application and for ELMs are studied with simultaneous observation by a new wide angle visible camera and a high speed IR camera. A newly implemented 3-D heat conduction code, TACO, is used to obtain divertor heat flux. The wide angle camera data confirmed the previously reported result on the validity of vacuum field line tracing on the prediction of split strike point pattern by 3-D fields as well as the phase locking of ELM heat flux to the 3-D fields. TACO calculates the 2-D heat flux distribution allowing assessment of toroidal asymmetry of peak heat flux and heat flux width. The degree of asymmetry (ɛDA) is defined to quantify the asymmetric heat deposition on the divertor surface and is found to have a strong positive dependence on peak heat flux.

  11. Numerical study of insect free hovering flight

    NASA Astrophysics Data System (ADS)

    Wu, Di; Yeo, Khoon Seng; Lim, Tee Tai; Fluid lab, Mechanical Engineering, National University of Singapore Team

    2012-11-01

    In this paper we present the computational fluid dynamics study of three-dimensional flow field around a free hovering fruit fly integrated with unsteady FSI analysis and the adaptive flight control system for the first time. The FSI model being specified for fruitfly hovering is achieved by coupling a structural problem based on Newton's second law with a rigorous CFD solver concerning generalized finite difference method. In contrast to the previous hovering flight research, the wing motion employed here is not acquired from experimental data but governed by our proposed control systems. Two types of hovering control strategies i.e. stroke plane adjustment mode and paddling mode are explored, capable of generating the fixed body position and orientation characteristic of hovering flight. Hovering flight associated with multiple wing kinematics and body orientations are shown as well, indicating the means by which fruitfly actually maintains hovering may have considerable freedom and therefore might be influenced by many other factors beyond the physical and aerodynamic requirements. Additionally, both the near- and far-field flow and vortex structure agree well with the results from other researchers, demonstrating the reliability of our current model.

  12. A numerical study of aircraft empennage buffet

    NASA Astrophysics Data System (ADS)

    Findlay, David Bruce

    1999-10-01

    A method to predict tightly-coupled dynamic aeroelastic vertical tail buffet was presented. Analysis of high angle of attack vertical tail buffet was performed. A Navier-Stokes fluid dynamics method was coupled with a modal structural dynamics method. The approach was to improve upon existing methods to evaluate complex geometric arrangements with general multi-zone interfacing. The method was demonstrated through a step- wise approach beginning with a simple configuration and building up to a complete aircraft at high angle of attack with flexible tail surfaces. Results compared well with in-flight and Full-scale wind tunnel measured trends and frequency content. Comparisons with measured absolute values of buffet loads showed the computations to be under-predicting the test data. This was primarily attributed to insufficient grid resolution, in particular in the vicinity of the main vortex flow. The demanding computational requirements of full-configuration tail buffet prediction limited the fidelity. The primary contribution of the present study was the extension and demonstration of a tightly-coupled aeroelastic computational fluid dynamics/structural dynamics based analysis method for analysis of aircraft empennage buffet. The focus was on improving the development process associated with characterizing empennage buffet loads and the resulting structural response. The intent was to establish a computationally based alternative approach to the experimentally based process currently employed. The computational method was employed to provide far greater insight into the flow physics phenomena associated with specific configurations and conditions of interest.

  13. Numerical Study of Explosive Dispersal of Particles

    NASA Astrophysics Data System (ADS)

    Rollin, Bertrand; Annamalai, Subramanian; Neal, Christopher; Jackson, Thomas; Balachandar, S.

    2014-11-01

    Recent experiments have shown that when a layer of solid particles is explosively dispersed, a multiphase instability front occurs, which leads to the formation of aerodynamically stable jet-like particle structures. We aim at replicating these experimental observations using highly resolved large-scale simulations, to improve our understanding of particulate front instabilities and jetting phenomenon. We consider a cylindrical core of high pressure and density gas generated from energetic material. Throughout the length of the cylinder, an annular region of micron-sized inert spherical particles surrounds the charge. The particles are treated as point particles, the gas is treated as a continuum, and a rigorous two-way coupled compressible multiphase formulation is used. The jets are believed to have their origin during the early phase of rapid acceleration of the bed of particles. Therefore, this work focuses on capturing the early-time behavior and growth of the instabilities caused by the presence of particles. The accuracy of our predictive simulations will be studied by comparing the shock radius, particle front location, and other relevant metrics against the data extracted from experimental results. This work is supported by the U.S. DoE, National Nuclear Security Administration, Advanced Simulation and Computing Program, as a Cooperative Agreement under the Predictive Science Academic Alliance Program, under Contract No. DE-NA0002378.

  14. Numerical Studies of Properties of Confined Helium

    NASA Technical Reports Server (NTRS)

    Manousakis, Efstratios

    2003-01-01

    We carry out state of the art simulations of properties of confined liquid helium near the superfluid transition to a degree of accuracy which allows to make predictions for the outcome of fundamental physics experiments in microgravity. First we report our results for the finite-size scaling behavior of heat capacity of superfluids for cubic and parallel-plate geometry. This allows us to study the crossover from zero and two dimensions to three dimensions. Our calculated scaling functions are in good agreement with recently measured specific heat scaling functions for the above mentioned geometries. We also present our results of a quantum simulation of submonolayer of molecular hydrogen deposited on an ideal graphite substrate using path-integral quantum Monte Carlo simulation. We find that the monolayer phase diagram is rich and very similar to that of helium monolayer. We are able to uncover the main features of the complex monolayer phase diagram, such as the commensurate solid phases and the commensurate to incommensurate transition, in agreement with the experiments and to find some features which are missing from the experimental analysis.

  15. Critical Dynamics in Quenched 2D Atomic Gases

    NASA Astrophysics Data System (ADS)

    Larcher, F.; Dalfovo, F.; Proukakis, N. P.

    2016-05-01

    Non-equilibrium dynamics across phase transitions is a subject of intense investigations in diverse physical systems. One of the key issues concerns the validity of the Kibble-Zurek (KZ) scaling law for spontaneous defect creation. The KZ mechanism has been recently studied in cold atoms experiments. Interesting open questions arise in the case of 2D systems, due to the distinct nature of the Berezinskii-Kosterlitz-Thouless (BKT) transition. Our studies rely on the stochastic Gross-Pitaevskii equation. We perform systematic numerical simulations of the spontaneous emergence and subsequent dynamics of vortices in a uniform 2D Bose gas, which is quenched across the BKT phase transition in a controlled manner, focusing on dynamical scaling and KZ-type effects. By varying the transverse confinement, we also look at the extent to which such features can be seen in current experiments. Financial support from EPSRC and Provincia Autonoma di Trento.

  16. Insights into Gulf of Mexico Gas Hydrate Study Sites GC955 and WR313 from New Multicomponent and High-Resolution 2D Seismic Data

    NASA Astrophysics Data System (ADS)

    Haines, S. S.; Hart, P. E.; Collett, T. S.; Shedd, W. W.; Frye, M.

    2014-12-01

    In 2013, the U.S. Geological Survey led a seismic acquisition expedition in the Gulf of Mexico, acquiring multicomponent data and high-resolution 2D multichannel seismic (MCS) data at Green Canyon 955 (GC955) and Walker Ridge 313 (WR313). Based on previously collected logging-while-drilling (LWD) borehole data, these gas hydrate study sites are known to include high concentrations of gas hydrate within sand layers. At GC955 our new 2D data reveal at least three features that appear to be fluid-flow pathways (chimneys) responsible for gas migration and thus account for some aspects of the gas hydrate distribution observed in the LWD data. Our new data also show that the main gas hydrate target, a Pleistocene channel/levee complex, has an areal extent of approximately 5.5 square kilometers and that a volume of approximately 3 x 107 cubic meters of this body lies within the gas hydrate stability zone. Based on LWD-inferred values and reasonable assumptions for net sand, sand porosity, and gas hydrate saturation, we estimate a total equivalent gas-in-place volume of approximately 8 x 108 cubic meters for the inferred gas hydrate within the channel/levee deposits. At WR313 we are able to map the thin hydrate-bearing sand layers in considerably greater detail than that provided by previous data. We also can map the evolving and migrating channel feature that persists in this area. Together these data and the emerging results provide valuable new insights into the gas hydrate systems at these two sites.

  17. Respiratory motion compensation for simultaneous PET/MR based on a 3D-2D registration of strongly undersampled radial MR data: a simulation study

    NASA Astrophysics Data System (ADS)

    Rank, Christopher M.; Heußer, Thorsten; Flach, Barbara; Brehm, Marcus; Kachelrieß, Marc

    2015-03-01

    We propose a new method for PET/MR respiratory motion compensation, which is based on a 3D-2D registration of strongly undersampled MR data and a) runs in parallel with the PET acquisition, b) can be interlaced with clinical MR sequences, and c) requires less than one minute of the total MR acquisition time per bed position. In our simulation study, we applied a 3D encoded radial stack-of-stars sampling scheme with 160 radial spokes per slice and an acquisition time of 38 s. Gated 4D MR images were reconstructed using a 4D iterative reconstruction algorithm. Based on these images, motion vector fields were estimated using our newly-developed 3D-2D registration framework. A 4D PET volume of a patient with eight hot lesions in the lungs and upper abdomen was simulated and MoCo 4D PET images were reconstructed based on the motion vector fields derived from MR. For evaluation, average SUVmean values of the artificial lesions were determined for a 3D, a gated 4D, a MoCo 4D and a reference (with ten-fold measurement time) gated 4D reconstruction. Compared to the reference, 3D reconstructions yielded an underestimation of SUVmean values due to motion blurring. In contrast, gated 4D reconstructions showed the highest variation of SUVmean due to low statistics. MoCo 4D reconstructions were only slightly affected by these two sources of uncertainty resulting in a significant visual and quantitative improvement in terms of SUVmean values. Whereas temporal resolution was comparable to the gated 4D images, signal-to-noise ratio and contrast-to-noise ratio were close to the 3D reconstructions.

  18. 2-d Finite Element Code Postprocessor

    Energy Science and Technology Software Center (ESTSC)

    1996-07-15

    ORION is an interactive program that serves as a postprocessor for the analysis programs NIKE2D, DYNA2D, TOPAZ2D, and CHEMICAL TOPAZ2D. ORION reads binary plot files generated by the two-dimensional finite element codes currently used by the Methods Development Group at LLNL. Contour and color fringe plots of a large number of quantities may be displayed on meshes consisting of triangular and quadrilateral elements. ORION can compute strain measures, interface pressures along slide lines, reaction forcesmore » along constrained boundaries, and momentum. ORION has been applied to study the response of two-dimensional solids and structures undergoing finite deformations under a wide variety of large deformation transient dynamic and static problems and heat transfer analyses.« less

  19. Numerical study of free surface flow around large obstacles

    NASA Astrophysics Data System (ADS)

    Zhang, Yanming

    In this thesis a numerical model was developed to study three-dimensional turbulent flows around large obstacles in an open channel. With this numerical model, a series of numerical tests was carried out, and the properties of turbulent flows around a single obstacle or a cluster of obstacles were investigated. The origin of this study was to study the flow properties around fish habitat structures. Actually, the numerical model can be applied to the study of general turbulent flows under free surfaces. In the numerical model the three-dimensional Reynolds-averaged Navier-Stokes equations in conjunction with k-epsilon turbulence model were solved in a free surface fitted coordinate system. First, different forms of governing equations for turbulent flow were investigated, and a concise form of fully transformed governing equations in a general curvilinear coordinate system was derived. In the numerical solution the FAVOR (Fractional Area/Volume Obstacle Representation) technique was extended into the free surface fitted coordinate system. With this feature the problem of complex turbulent flow with a free surface and general shaped obstacles could be solved efficiently. To locate the free surface, a method based on integrating the momentum equation in the vertical direction was developed. After study and tests of several popular difference schemes, a QUICK scheme with UMIST limiter was adopted in this numerical model. Several test cases were presented to demonstrate the present numerical model. The first test case was to simulate a submerged hydraulic jump. The calculated velocity, free surface profile and turbulence properties of the flow showed a close match with the experimental data. The second test was a submerged hydraulic jump with a baffle sill. The comparison between numerical and experimental data indicated that the current numerical model could catch the general flow structures of the submerged hydraulic jumps. The last two test cases were flows around a

  20. A numerical model to study auscultation sounds under pneumothorax conditions.

    PubMed

    Ramakrishnan, Sridhar; Udpa, Satish; Udpa, Lalita

    2009-01-01

    A 2D viscoelastic finite-difference time-domain (FDTD) is used to simulate sound propagation of lung sounds in the human thorax. Specifically, the model is employed to study the effects of pneumothorax on the sounds reaching the thoracic surface. By simulating varying degrees of severity of the disease, the model assists in determining the key frequency bands that contain the most information to aid in diagnosis. The work thus lends itself for development of advanced auscultatory techniques for detection of pneumothorax using noninvasive acoustic sensors. PMID:19965081

  1. 2 D - QSAR studies on CYP26A1 inhibitory activity of 1-[benzofuran-2-yl-(4-alkyl/aryl-phenyl)-methyl]- 1 H-triazoles.

    PubMed

    Yadav, Madhu

    2011-01-01

    The Quantitative Structure Activity Relationship (QSAR) study is performed over a set of 15, 4-alkyl/aryl-substituted 1- [benzofuran-2-yl-phenylmethyl]-1 H-triazoles derivatives. This study is based on the application of physicochemical parameters in QSAR. The parameters include (MR (molar refractivity), MW (molecular weight), Pc (parachor), St (surface tension), D (density), Ir (index of refraction) and log P (partition coefficient). The parameters describing physiochemical properties are used as independent variables and the biological activity (IC(50)) is considered as dependent variable in multiple regression analysis. Different models were generated with high co-efficient of determination (R(2)). The 2D-QSAR study identified compounds capable of inhibiting the metabolic breakdown of the retinoid (trans-retinoic acid (ATRA)) involved in the activation of specific nuclear Retinoic acid receptors (RARs). This study identifies R115866 as a potential inhibitor of the cytochrome P450 (CYP) mediated metabolism with increased RA levels for retinoid actions. PMID:22347780

  2. 2D and 3D Shear-Wave Velocity Structure to >1 Km Depth from Ambient and Active Surface Waves: Three "Deep Remi" Case Studies

    NASA Astrophysics Data System (ADS)

    Louie, J. N.; Pancha, A.; Pullammanappallil, S. K.

    2014-12-01

    Refraction microtermor routinely assesses 1D and 2D velocity-depth profiles to shallow depths of approximately 100 m primarily for engineering applications. Estimation of both shallow and deep (>100 m) shear-velocity structure are key elements in the assessment of urban areas for potential earthquake ground shaking, damage, and the calibration of recorded ground motions. Three independent studies investigated the ability of the refraction microtremor technology to image deep velocity structure, to depths exceeding 1 km (Deep ReMi). In the first study, we were able to delineate basin thicknesses of up to 900 m and the deep-basin velocity structure beneath the Reno-area basin. Constraints on lateral velocity changes in 3D as well as on velocity profiles extended down to 1500 m, and show a possible fault offset. This deployment used 30 stand-alone wireless instruments mated to 4.5 Hz geophones, along each of five arrays 2.9 to 5.8 km long. Rayleigh-wave dispersion was clear at frequencies as low as 0.5 Hz using 120 sec ambient urban noise records. The results allowed construction of a 3D velocity model, vetted by agreement with gravity studies. In a second test, a 5.8 km array delimited the southern edge of the Tahoe Basin, with constraints from gravity. There, bedrock depth increased by 250 m in thickness over a distance of 1600 m, with definition of the velocity of the deeper basin sediments. The third study delineated the collapse region of an underground nuclear explosion within a thick sequence of volcanic extrusives, using a shear-wave minivibe in a radial direction, and horizontal geophones. Analysis showed the cavity extends to 620 m depth, with a width of 180 m and a height of 220 m. Our results demonstrate that deep velocity structure can be recovered using ambient noise. This technique offers the ability to define 2D and 3D structural representations essential for seismic hazard evaluation.

  3. Numerical study of dynamical mass generation in QED3

    NASA Astrophysics Data System (ADS)

    Bashir, A.; Huet, A.; Raya, A.

    2006-05-01

    We carry out a numerical study of dynamical generation of fermion masses by solving the Schwinger-Dyson equation for the fermion propagator in three-dimensional quenched Quantum Electrodynamics (QED3) in various gauges. We employ an ansatz for the three-point vertex which satisfies the Ward-Green-Takahashi identity, namely, the Ball-Chiu Vertex. We discuss the advantages of our numerical method over some earlier ones.

  4. Impact of CYP2D*6 in the adjuvant treatment of breast cancer patients with tamoxifen.

    PubMed

    Markopoulos, Christos; Kykalos, Stylianos; Mantas, Dimitrios

    2014-08-10

    Biotransformation of tamoxifen to the potent antiestrogen endoxifen is performed by cytochrome P450 (CYP) enzymes, in particular the CYP2D6 isoform. CYP2D6*4 is one of the most frequent alleles associated with loss of enzymatic activity. The incidence of CYP2D6*4 among Caucasians is estimated up to 27%, while it is present in up to 90% of all poor metabolizers within the Caucasian population. The hypothesis under question is whether the presence of one or two non-functioning (null) alleles predicts an inferior outcome in postmenopausal women with breast cancer receiving adjuvant treatment with tamoxifen. The numerous existing studies investigating the association of CYP2D6 with treatment failure in breast cancer are inconsistent and give rather conflicting results. Currently, routine CYP2D6 testing among women with breast cancer is not recommended and the significance of CYP2D6 phenotype in decision making regarding the administration of tamoxifen is unclear. The present study summarizes current literature regarding clinical studies on CYP2D6*4, particularly in terms of response to tamoxifen therapy and breast cancer outcome. PMID:25114852

  5. Impact of CYP2D*6 in the adjuvant treatment of breast cancer patients with tamoxifen

    PubMed Central

    Markopoulos, Christos; Kykalos, Stylianos; Mantas, Dimitrios

    2014-01-01

    Biotransformation of tamoxifen to the potent antiestrogen endoxifen is performed by cytochrome P450 (CYP) enzymes, in particular the CYP2D6 isoform. CYP2D6*4 is one of the most frequent alleles associated with loss of enzymatic activity. The incidence of CYP2D6*4 among Caucasians is estimated up to 27%, while it is present in up to 90% of all poor metabolizers within the Caucasian population. The hypothesis under question is whether the presence of one or two non-functioning (null) alleles predicts an inferior outcome in postmenopausal women with breast cancer receiving adjuvant treatment with tamoxifen. The numerous existing studies investigating the association of CYP2D6 with treatment failure in breast cancer are inconsistent and give rather conflicting results. Currently, routine CYP2D6 testing among women with breast cancer is not recommended and the significance of CYP2D6 phenotype in decision making regarding the administration of tamoxifen is unclear. The present study summarizes current literature regarding clinical studies on CYP2D6*4, particularly in terms of response to tamoxifen therapy and breast cancer outcome. PMID:25114852

  6. Numerical Study of Shock Propagation in Inhomogeneous Materials.

    NASA Astrophysics Data System (ADS)

    Kotelnikov, A. D.; Montgomery, D. C.

    1997-07-01

    We report computations of shock propagation in a medium of dense ``bubbles'' surrounded by a lighter fluid, with an intended application to plastic fibers in DT liquid or ice. The method is kinetic footnote A.D. Kotelnikov, and D.C. Montgomery, ``A kinetic method for computing inhomogeneous fluid behavior,'' submitted to J. Comput. Phys. , and is based on the Bhatnagar-Gross-Krook model generalized to two species. The model is generalizeable beyond the (ideal gas) equations of state presently employed: molecular interactions and dissociation can be included. The shocks generate turbulence, compressible and mixing, and it affects shock structure and propagation speed. The effect of the residual turbulence on second, following, shocks can be studied similarly. The studies are now two-dimensional (2D), and significant differences are expected in 3D because of the different decay rates of turbulence in 2D and 3D. This work was supported in part by U.S.N.R.L. Grant N000014-96-G005

  7. Consensus brain-derived protein, extraction protocol for the study of human and murine brain proteome using both 2D-DIGE and mini 2DE immunoblotting.

    PubMed

    Fernandez-Gomez, Francisco-Jose; Jumeau, Fanny; Derisbourg, Maxime; Burnouf, Sylvie; Tran, Hélène; Eddarkaoui, Sabiha; Obriot, Hélène; Dutoit-Lefevre, Virginie; Deramecourt, Vincent; Mitchell, Valérie; Lefranc, Didier; Hamdane, Malika; Blum, David; Buée, Luc; Buée-Scherrer, Valérie; Sergeant, Nicolas

    2014-01-01

    Two-dimensional gel electrophoresis (2DE) is a powerful tool to uncover proteome modifications potentially related to different physiological or pathological conditions. Basically, this technique is based on the separation of proteins according to their isoelectric point in a first step, and secondly according to their molecular weights by SDS polyacrylamide gel electrophoresis (SDS-PAGE). In this report an optimized sample preparation protocol for little amount of human post-mortem and mouse brain tissue is described. This method enables to perform both two-dimensional fluorescence difference gel electrophoresis (2D-DIGE) and mini 2DE immunoblotting. The combination of these approaches allows one to not only find new proteins and/or protein modifications in their expression thanks to its compatibility with mass spectrometry detection, but also a new insight into markers validation. Thus, mini-2DE coupled to western blotting permits to identify and validate post-translational modifications, proteins catabolism and provides a qualitative comparison among different conditions and/or treatments. Herein, we provide a method to study components of protein aggregates found in AD and Lewy body dementia such as the amyloid-beta peptide and the alpha-synuclein. Our method can thus be adapted for the analysis of the proteome and insoluble proteins extract from human brain tissue and mice models too. In parallel, it may provide useful information for the study of molecular and cellular pathways involved in neurodegenerative diseases as well as potential novel biomarkers and therapeutic targets. PMID:24747743

  8. AnisWave 2D

    Energy Science and Technology Software Center (ESTSC)

    2004-08-01

    AnisWave2D is a 2D finite-difference code for a simulating seismic wave propagation in fully anisotropic materials. The code is implemented to run in parallel over multiple processors and is fully portable. A mesh refinement algorithm has been utilized to allow the grid-spacing to be tailored to the velocity model, avoiding the over-sampling of high-velocity materials that usually occurs in fixed-grid schemes.

  9. Experimental and numerical study on condensation in transonic steam flow

    NASA Astrophysics Data System (ADS)

    Majkut, Mirosław; Dykas, Sławomir; Strozik, Michał; Smołka, Krystian

    2015-09-01

    The present paper describes an experimental and numerical study of steam condensing flow in a linear cascade of turbine stator blades. The experimental research was performed on the facility of a small scale steam power plant located at Silesian University of Technology in Gliwice, Poland. The test rig of the facility allows us to perform the tests of steam transonic flows for the conditions corresponding to these which prevail in the low-pressure (LP) condensing steam turbine stages. The experimental data of steam condensing flow through the blade-to- blade stator channel were compared with numerical results obtained using the in-house CFD numerical code TraCoFlow. Obtained results confirmed a good quality of the performed experiment and numerical calculations.

  10. HP-Lattice QSAR for dynein proteins: experimental proteomics (2D-electrophoresis, mass spectrometry) and theoretic study of a Leishmania infantum sequence.

    PubMed

    Dea-Ayuela, María Auxiliadora; Pérez-Castillo, Yunierkis; Meneses-Marcel, Alfredo; Ubeira, Florencio M; Bolas-Fernández, Francisco; Chou, Kuo-Chen; González-Díaz, Humberto

    2008-08-15

    The toxicity and inefficacy of actual organic drugs against Leishmaniosis justify research projects to find new molecular targets in Leishmania species including Leishmania infantum (L. infantum) and Leishmaniamajor (L. major), both important pathogens. In this sense, quantitative structure-activity relationship (QSAR) methods, which are very useful in Bioorganic and Medicinal Chemistry to discover small-sized drugs, may help to identify not only new drugs but also new drug targets, if we apply them to proteins. Dyneins are important proteins of these parasites governing fundamental processes such as cilia and flagella motion, nuclear migration, organization of the mitotic splinde, and chromosome separation during mitosis. However, despite the interest for them as potential drug targets, so far there has been no report whatsoever on dyneins with QSAR techniques. To the best of our knowledge, we report here the first QSAR for dynein proteins. We used as input the Spectral Moments of a Markov matrix associated to the HP-Lattice Network of the protein sequence. The data contain 411 protein sequences of different species selected by ClustalX to develop a QSAR that correctly discriminates on average between 92.75% and 92.51% of dyneins and other proteins in four different train and cross-validation datasets. We also report a combined experimental and theoretic study of a new dynein sequence in order to illustrate the utility of the model to search for potential drug targets with a practical example. First, we carried out a 2D-electrophoresis analysis of L. infantum biological samples. Next, we excised from 2D-E gels one spot of interest belonging to an unknown protein or protein fragment in the region M<20,200 and pI<4. We used MASCOT search engine to find proteins in the L. major data base with the highest similarity score to the MS of the protein isolated from L. infantum. We used the QSAR model to predict the new sequence as dynein with probability of 99.99% without

  11. Study on the numerical schemes for hypersonic flow simulation

    NASA Astrophysics Data System (ADS)

    Nagdewe, S. P.; Shevare, G. R.; Kim, Heuy-Dong

    2009-10-01

    Hypersonic flow is full of complex physical and chemical processes, hence its investigation needs careful analysis of existing schemes and choosing a suitable scheme or designing a brand new scheme. The present study deals with two numerical schemes Harten, Lax, and van Leer with Contact (HLLC) and advection upstream splitting method (AUSM) to effectively simulate hypersonic flow fields, and accurately predict shock waves with minimal diffusion. In present computations, hypersonic flows have been modeled as a system of hyperbolic equations with one additional equation for non-equilibrium energy and relaxing source terms. Real gas effects, which appear typically in hypersonic flows, have been simulated through energy relaxation method. HLLC and AUSM methods are modified to incorporate the conservation laws for non-equilibrium energy. Numerical implementation have shown that non-equilibrium energy convect with mass, and hence has no bearing on the basic numerical scheme. The numerical simulation carried out shows good comparison with experimental data available in literature. Both numerical schemes have shown identical results at equilibrium. Present study has demonstrated that real gas effects in hypersonic flows can be modeled through energy relaxation method along with either AUSM or HLLC numerical scheme.

  12. The quantum spacetime of c > 0 2 d gravity

    NASA Astrophysics Data System (ADS)

    Ambjørn, J.; Anagnostopoulos, K. N.; Thorleifsson, G.

    1998-04-01

    We review recent developments in the understanding of the fractal properties of quantum spacetime of 2d gravity coupled to c > 0 conformal matter. In particular we discuss bounds put by numerical simulations using dynamical triangulations on the value of the Hausdorff dimension dH obtained from scaling properties of two point functions defined in terms of geodesic distance. Further insight to the fractal structure of spacetime is obtained from the study of the loop length distribution function which reveals that the 0 < c ≤ 1 system has similar geometric properties with pure gravity, whereas the branched polymer structure becomes clear for c ≥ 5.

  13. Numerical study on small scale vertical axis wind turbine

    NASA Astrophysics Data System (ADS)

    Parra-Santos, Teresa; Gallegos, Armando; Uzarraga, Cristóbal N.; Rodriguez, Miguel A.

    2016-03-01

    The performance of a Vertical Axis Wind Turbine (VAWT) is numerically analyzed. The set-up is Hdarrieus with three straight blades airfoils NACA attached to a rotating vertical shaft. The wind turbine has solidity equals to the unity operating with wind velocity of 7 m/s. Influence of pitch angle is tested to get design tendencies. 2D, transient, Navier Stokes equations are solved using the code Ansys-Fluent. Conservation equations were solved with a Third-Order MUSCL scheme using SIMPLE to couple pressure and velocity. More than six revolutions must be simulated to get the periodic behavior. Two models of turbulence have been contrasted Realizable k-epsilon and Transition SST concluding the last one show more realistic flow features. Pitch angles of 0º, -6º and -10º have been tested with Tip Speed Ratios ranging from 0.7 and 1.6. The no null pitch angles improve the performance of the wind turbine. Instantaneous and averaged power coefficients as well as detailed flow field around the airfoils are showed.

  14. Numerical study of nonlinear full wave acoustic propagation

    NASA Astrophysics Data System (ADS)

    Velasco-Segura, Roberto; Rendon, Pablo L.

    2013-11-01

    With the aim of describing nonlinear acoustic phenomena, a form of the conservation equations for fluid dynamics is presented, deduced using slightly less restrictive hypothesis than those necessary to obtain the well known Westervelt equation. This formulation accounts for full wave diffraction, nonlinearity, and thermoviscous dissipative effects. A CLAWPACK based, 2D finite-volume method using Roe's linearization has been implemented to obtain numerically the solution of the proposed equations. In order to validate the code, two different tests have been performed: one against a special Taylor shock-like analytic solution, the other against published results on a HIFU system, both with satisfactory results. The code is written for parallel execution on a GPU and improves performance by a factor of over 50 when compared to the standard CLAWPACK Fortran code. This code can be used to describe moderate nonlinear phenomena, at low Mach numbers, in domains as large as 100 wave lengths. Applications range from modest models of diagnostic and therapeutic HIFU, parametric acoustic arrays, to acoustic wave guides. A couple of examples will be presented showing shock formation and oblique interaction. DGAPA PAPIIT IN110411, PAEP UNAM 2013.

  15. A numerical study of the energy flux in internal bores

    NASA Astrophysics Data System (ADS)

    Borden, Zachary; Meiburg, Eckart

    2009-11-01

    Internal bores, or hydraulic jumps, arise in many atmospheric and oceanographic phenomena. The classic single-layer hydraulic jump model accurately predicts a bore's behavior when the density difference between the expanding and contracting layer is large (i.e. water and air), but fails in the Boussinesq limit. A two-layer model, where mass is conserved separately in each layer and momentum is conserved globally, does a much better job but requires for closure an assumption about the loss of energy across a bore. It is widely agreed that assuming all the energy loss occurs entirely in one of the layers puts bounds on a bore's propagation speed. However, under some circumstances, both assumptions over-predict the propagation speed, implying an energy gain in the expanding layer. We directly examine the flux of energy within internal bores using 2D direct numerical simulations. We find that although there is a global loss of energy across the bore, there is a transfer of energy from the contracting to the expanding layer causing a net energy gain in that layer. The transfer is largely the result of the horizontal pressure gradient caused by a difference in hydrostatic pressure across the bore.

  16. 2D dry granular free-surface flow over complex topography with obstacles. Part I: experimental study using a consumer-grade RGB-D sensor

    NASA Astrophysics Data System (ADS)

    Caviedes-Voullième, Daniel; Juez, Carmelo; Murillo, Javier; García-Navarro, Pilar

    2014-12-01

    Avalanches, debris flows and other types of gravity-driven granular flows are a common hazard in mountainous regions. These regions often have human settlements in the lower parts of valleys, with human structures dangerously exposed to the destructive effects of these geophysical flows. Therefore a scientific effort has been made to understand, model and simulate geophysical granular flows. In order for computer models and simulations to be of predictive value they need to be validated under controlled, yet nature-like conditions. This work presents an experimental study of granular flow over a simplified mountain slope and valley topography. The experimental facility has a rough bed with very high slope at the upstream end and adverse slope on the downstream end, following a parabolic profile. Obstacles are present in the lower regions. Transient measurements of the moving granular surfaces were taken with a consumer-grade RGB-D sensor, providing transient 2D elevation fields around the obstacles. Three experimental configurations were tested, with semispheres of different diameters and a square dike obstacle. The experimental results are very consistent and repeatable. The quantitative, transient and two-dimensional data for all three experiments constitute excellent benchmarking tests for computational models, such as the one presented in a companion paper.

  17. Spin-coated and PECVD low dielectric constant porous organosilicate films studied by 1D and 2D solid-state NMR.

    PubMed

    Gerbaud, Guillaume; Hediger, Sabine; Bardet, Michel; Favennec, Laurent; Zenasni, Aziz; Beynet, Julien; Gourhant, Olivier; Jousseaume, Vincent

    2009-11-14

    In the research field of the sub-65 nm semiconductor industry, organosilicate SiOCH films with low dielectric constant (k < 2.4) need to be developed in order to improve the performance of integrated circuits [International Roadmap for Semiconductors (ITRS), San Jose, CA, 2004]. One way to produce SiOCH films of low dielectric constant is to introduce pores into the film. This is usually obtained in two steps. Firstly, co-deposition of a matrix precursor, with a sacrificial organic porogen, either by plasma enhanced chemical vapor deposition (PECVD) or spin-coating. Secondly, application of a specific thermal treatment to remove the porogen and create the porosity. This last step can be improved by adding to the thermal process a super-critical CO(2) treatment, an UV irradiation or an electronic bombardment (e-beam). In this study, the two deposition processes as well as the various treatments applied to eliminate the porogens were evaluated and compared using high-resolution solid-state NMR. For this purpose, hybrid (containing porogens) and porous films were extensively characterized on the basis of their (1)H, (13)C and (29)Si high-resolution NMR spectra. Information was obtained concerning the crosslinking of the Si skeleton. Spectral features could be correlated to the processes used. Isotropic chemical shift analyses and 2D correlation NMR experiments were used to show the existence and nature of the interactions between the matrix precursor and the organic porogen. PMID:19851550

  18. New dicyano cyclometalated compounds containing Pd(II)-Tl(I) bonds as building blocks in 2D extended structures: synthesis, structure, and luminescence studies.

    PubMed

    Sicilia, Violeta; Forniés, Juan; Fuertes, Sara; Martín, Antonio

    2012-10-15

    New mixed metal complexes [PdTl(C^N)(CN)(2)] [C^N = 7,8-benzoquinolinate (bzq, 3); 2-phenylpyridinate (ppy, 4)] have been synthesized by reaction of their corresponding precursors (NBu(4))[Pd(C^N)(CN)(2)] [C^N = bzq (1), ppy (2)] with TlPF(6). Compounds 3 and 4 were studied by X-ray diffraction, showing the not-so-common Pd(II)-Tl(I) bonds. Both crystal structures exhibit 2-D extended networks fashioned by organometallic "PdTl(C^N)(CN)(2)" units, each one containing a donor-acceptor Pd(II)-Tl(I) bond, which are connected through additional Tl···N≡C contacts and weak Tl···π (bzq) contacts in the case of 3. Solid state emissions are red-shifted compared with those of the precursors and have been assigned to metal-metal'-to-ligand charge transfer (MM'LCT [d/s σ*(Pd,Tl) → π*(C^N)]) mixed with some intraligand ((3)IL[π(C^N) → π*(C^N)]) character. In diluted solution either at room temperature or 77 K, the Pd-Tl bond is no longer retained as confirmed by mass spectrometry, NMR, and UV-vis spectroscopic techniques. PMID:22998590

  19. Reactions of Th(+) + H2, D2, and HD Studied by Guided Ion Beam Tandem Mass Spectrometry and Quantum Chemical Calculations.

    PubMed

    Cox, Richard M; Armentrout, P B; de Jong, Wibe A

    2016-03-01

    Kinetic energy dependent reactions of Th(+) with H2, D2, and HD were studied using a guided ion beam tandem mass spectrometer. Formation of ThH(+) and ThD(+) is endothermic in all cases with similar thresholds. Branching ratio results for the reaction with HD indicate that Th(+) reacts via a statistical mechanism, similar to Hf(+). The kinetic energy dependent cross sections for formation of ThH(+) and ThD(+) were evaluated to determine a 0 K bond dissociation energy (BDE) of D0(Th(+)-H) = 2.45 ± 0.07 eV. This value is in good agreement with a previous result obtained from analysis of the Th(+) + CH4 reaction. D0(Th(+)-H) is observed to be larger than its transition metal congeners, TiH(+), ZrH(+), and HfH(+), believed to be a result of lanthanide contraction. The reactions with H2 were also explored using quantum chemical calculations that include a semiempirical estimation and explicit calculation of spin-orbit contributions. These calculations agree nicely and indicate that ThH(+) most likely has a (3)Δ1 ground level with a low-lying (1)Σ(+) excited state. Theory also provides the reaction potential energy surfaces and BDEs that are in reasonable agreement with experiment. PMID:26414691

  20. Numerical study of subcritical flow with fluid injection

    NASA Technical Reports Server (NTRS)

    Balasubramanian, R.

    1990-01-01

    It is suggested that the study of synthetic flows, where controlled experiments can be performed, is useful in understanding turbulent flow structures. The early states of formation of hairpin structures in shear flows and the subsequent evolution of these structures is studied in shear flows and the subsequent evolution of these structures is studied through numerical simulations, by developing full-time dependent three-dimensional flow solution of an initially laminar (subcritical) flow in which injection of fluid through a narrow streamwise slot from the bottom wall of a plate is carried out. Details of the numerical approach and significance of the present findings are reported in this work.

  1. Experimental and Numerical Study of Free-Field Blast Mitigation

    NASA Astrophysics Data System (ADS)

    Allen, R. M.; Kirkpatrick, D. J.; Longbottom, A. W.; Milne, A. M.; Bourne, N. K.

    2004-07-01

    The development of a fundamental understanding of the mechanisms governing the attenuation of explosives effects by a surrounding mitigant material or system would benefit many civilian and military applications. Current approaches rely almost exclusively on empirical data, few if any truly predictive models exist. Dstl has recently pursued an experimental programme investigating the mitigation of effects from detonating explosives in support of general requirements to attenuate blast and fragmentation. The physical properties of a range of mitigant materials have been studied at a more fundamental level, both experimentally and numerically. A preliminary numerical parameter study has been undertaken by FGE using two-phase numerical simulations to complement the experimental studies. Initial work used idealised equations of state for generic mitigants but more recently material characterisation experiments have been undertaken at RMCS. Results confirm that porosity and particle density are dominant factors affecting the efficiency of the mitigant in reducing free-field blast.

  2. A Numerical Study of Hypersonic Forebody/Inlet Integration Problem

    NASA Technical Reports Server (NTRS)

    Kumar, Ajay

    1991-01-01

    A numerical study of hypersonic forebody/inlet integration problem is presented in the form of the view-graphs. The following topics are covered: physical/chemical modeling; solution procedure; flow conditions; mass flow rate at inlet face; heating and skin friction loads; 3-D forebogy/inlet integration model; and sensitivity studies.

  3. Numerical studies of laminar and turbulent drag reduction

    NASA Technical Reports Server (NTRS)

    Balasubramanian, R.; Orszag, S. A.

    1981-01-01

    Two-dimensional incompressible flow over wavy surfaces is studied numerically by spectral methods. Turbulence effects are modeled. Results for symmetric and asymmetric wave forms are presented. Effect of propagating surface waves on drag reduction is studied. Comparisons between computer simulations and experimental results are made.

  4. Numerical Study of Magnetic Damping During Unidirectional Solidification

    NASA Technical Reports Server (NTRS)

    Li, Ben Q.

    1997-01-01

    A fully 3-D numerical model is developed to represent magnetic damping of complex fluid flow, heat transfer and electromagnetic field distributions in a melt cavity. The model is developed based on our in-house finite element code for the fluid flow, heat transfer and electromagnetic field calculations. The computer code has been tested against benchmark test problems that are solved by other commercial codes as well as analytical solutions whenever available. The numerical model is tested against numerical and experimental results for water reported in literature. With the model so tested, various numerical simulations are carried out for the Sn-35.5% Pb melt convection and temperature distribution in a cylindrical cavity with and without the presence of a transverse magnetic field. Numerical results show that magnetic damping can be effectively applied to reduce turbulence and flow levels in the melt undergoing solidification and over a certain threshold value a higher magnetic field resulted in a higher velocity reduction. It is found also that for a fully 3-D representation of the magnetic damping effects, the electric field induced in the melt by the applied DC magnetic field does not vanish, as some researchers suggested, and must be included even for molten metal and semiconductors. Also, for the study of the melt flow instability, a long enough time has to be applied to ensure the final fluid flow recirculation pattern. Moreover, our numerical results suggested that there seems to exist a threshold value of applied magnetic field, above which magnetic damping becomes possible and below which the convection in the melt is actually enhanced. Because of the limited financial resource allocated for the project, we are unable to carry out extensive study on this effect, which should warrant further theoretical and experimental study. In that endeavor, the developed numerical model should be very useful; and the model should serve as a useful tool for exploring

  5. Numerical aerodynamic simulation facility preliminary study: Executive study

    NASA Technical Reports Server (NTRS)

    1977-01-01

    A computing system was designed with the capability of providing an effective throughput of one billion floating point operations per second for three dimensional Navier-Stokes codes. The methodology used in defining the baseline design, and the major elements of the numerical aerodynamic simulation facility are described.

  6. Similarities between 2D and 3D convection for large Prandtl number

    NASA Astrophysics Data System (ADS)

    Pandey, Ambrish; Verma, Mahendra K.; Chatterjee, Anando G.; Dutta, Biplab

    2016-06-01

    Using direct numerical simulations of Rayleigh-B\\'{e}nard convection (RBC), we perform a comparative study of the spectra and fluxes of energy and entropy, and the scaling of large-scale quantities for large and infinite Prandtl numbers in two (2D) and three (3D) dimensions. We observe close similarities between the 2D and 3D RBC, in particular the kinetic energy spectrum $E_u(k) \\sim k^{-13/3}$, and the entropy spectrum exhibits a dual branch with a dominant $k^{-2}$ spectrum. We showed that the dominant Fourier modes in the 2D and 3D flows are very close. Consequently, the 3D RBC is quasi two-dimensional, which is the reason for the similarities between the 2D and 3D RBC for large- and infinite Prandtl numbers.

  7. A temperature dependent 2D-ACAR study of untwinned metallic YBa{sub 2}Cu{sub 3}O{sub 7{minus}x}

    SciTech Connect

    Smedskjaer, L.C.; Welp, U.; Fang, Y.; Bailey, K.G.; Bansil, A.

    1992-02-01

    The authors have carried out 2D-ACAR measurements in the c-axis projection on an untwinned single crystal of YBa{sub 2}Cu{sub 3}O{sub 7{minus}x} as a function of temperature, for five temperatures ranging from 30K to 300K. These temperature dependent 2D-ACAR spectra can be approximated by a superposition of two temperature independent spectra with temperature dependent weighting factors. The authors discuss how the temperature dependence of the data can be exploited to obtain a {open_quote}background corrected{close_quote} experimental spectrum, which is found to be in remarkable accord with the corresponding band theory based predictions, including for the first time the overall amplitude of the anisotropy in the 2D-ACAR. The corrected data also show clear signatures of the ridge Fermi surface and an indication of the pillbox surface.

  8. Proton-detected 2D radio frequency driven recoupling solid-state NMR studies on micelle-associated cytochrome-b5

    NASA Astrophysics Data System (ADS)

    Pandey, Manoj Kumar; Vivekanandan, Subramanian; Yamamoto, Kazutoshi; Im, Sangchoul; Waskell, Lucy; Ramamoorthy, Ayyalusamy

    2014-05-01

    Solid-state NMR spectroscopy is increasingly used in the high-resolution structural studies of membrane-associated proteins and peptides. Most such studies necessitate isotopically labeled (13C, 15N and 2H) proteins/peptides, which is a limiting factor for some of the exciting membrane-bound proteins and aggregating peptides. In this study, we report the use of a proton-based slow magic angle spinning (MAS) solid-state NMR experiment that exploits the unaveraged 1H-1H dipolar couplings from a membrane-bound protein. We have shown that the difference in the buildup rates of cross-peak intensities against the mixing time - obtained from 2D 1H-1H radio frequency-driven recoupling (RFDR) and nuclear Overhauser effect spectroscopy (NOESY) experiments on a 16.7-kDa micelle-associated full-length rabbit cytochrome-b5 (cytb5) - can provide insights into protein dynamics and could be useful to measure 1H-1H dipolar couplings. The experimental buildup curves compare well with theoretical simulations and are used to extract relaxation parameters. Our results show that due to fast exchange of amide protons with water in the soluble heme-containing domain of cyb5, coherent 1H-1H dipolar interactions are averaged out for these protons while alpha and side chain protons show residual dipolar couplings that can be obtained from 1H-1H RFDR experiments. The appearance of resonances with distinct chemical shift values in 1H-1H RFDR spectra enabled the identification of residues (mostly from the transmembrane region) of cytb5 that interact with micelles.

  9. Proton-Detected 2D Radio Frequency Driven Recoupling Solid-state NMR Studies on Micelle-associated Cytochrome-b5

    PubMed Central

    Pandey, Manoj Kumar; Vivekanandan, Subramanian; Yamamoto, Kazutoshi; Im, Sangchoul; Waskell, Lucy; Ramamoorthy, Ayyalusamy

    2014-01-01

    Solid-state NMR spectroscopy is increasingly used in the high-resolution structural studies of membrane-associated proteins and peptides. Most such studies necessitate isotopically labeled (13C, 15N and 2H) proteins/peptides, which is a limiting factor for some of the exciting membrane-bound proteins and aggregating peptides. In this study, we report the use of a proton-based slow magic angle spinning (MAS) solid-state NMR experiment that exploits the unaveraged 1H-1H dipolar couplings from a membrane-bound protein. We have shown that the difference in the buildup rates of cross peak intensities against the mixing time - obtained from 2D 1H-1H radio frequency-driven recoupling (RFDR) and nuclear Overhauser effect spectroscopy (NOESY) experiments on a 16.7-kDa micelle-associated full-length rabbit cytochrome-b5 (cytb5) - can provide insights into protein dynamics and could be useful to measure 1H-1H dipolar couplings. The experimental buildup curves compare well with theoretical simulations and are used to extract relaxation parameters. Our results show that due to fast exchange of amide protons with water in the soluble heme-containing domain of cyb5, coherent 1H-1H dipolar interactions are averaged out for these protons while alpha and side chain protons show residual dipolar couplings that can be obtained from 1H-1H RFDR experiments. The appearance of resonances with distinct chemical shift values in 1H-1H RFDR spectra enabled the identification of residues (mostly from the transmembrane region) of cytb5 that interact with micelles. PMID:24657390

  10. Cerebral morphology and dopamine D2/D3receptor distribution in humans: A combined [18F]fallypride and voxel-based morphometry study

    PubMed Central

    Woodward, Neil D.; Zald, David H.; Ding, Zhaohua; Riccardi, Patrizia; Ansari, M. Sib; Baldwin, Ronald M.; Cowan, Ronald L.; Li, Rui; Kessler, Robert M.

    2009-01-01

    The relationship between cerebral morphology and the expression of dopamine receptors has not been extensively studied in humans. Elucidation of such relationships may have important methodological implications for clinical studies of dopamine receptor ligand binding differences between control and patient groups. The association between cerebral morphology and dopamine receptor distribution was examined in 45 healthy subjects who completed T1-weighted structural MRI and PET scanning with the D2/D3 ligand [18F]fallypride. Optimized voxel-based morphometry was used to create grey matter volume and density images. Grey matter volume and density images were correlated with binding potential (BPND) images on a voxel-by-voxel basis using the Biological Parametric Mapping toolbox. Associations between cerebral morphology and BPND were also examined for selected regions-of-interest (ROIs) after spatial normalization. Voxel-wise analyses indicated that grey matter volume and density positively correlated with BPND throughout the midbrain, including the substantia nigra. Positive correlations were observed in medial cortical areas, including anterior cingulate and medial prefrontal cortex, and circumscribed regions of the temporal, frontal, and parietal lobes. ROI analyses revealed significant positive correlations between BPND and cerebral morphology in the caudate, thalamus, and amygdala. Few negative correlations between morphology and BPND were observed. Overall, grey matter density appeared more strongly correlated with BPND than grey matter volume. Cerebral morphology, particularly grey matter density, correlates with [18F]fallypride BPND in a regionally specific manner. Clinical studies comparing dopamine receptor availability between clinical and control groups may benefit by accounting for potential differences in cerebral morphology that exist even after spatial normalization. PMID:19457373

  11. Numerical study of vorticity-enhanced heat transfer

    NASA Astrophysics Data System (ADS)

    Wang, Xiaolin; Alben, Silas

    2013-11-01

    Vortices produced by vibrated reeds and flapping foils can improve heat transfer efficiency in electronic hardware. Vortices enhance forced convection by boundary layer separation and thermal mixing in the bulk flow. In this work, we modeled and simulated the fluid flow and temperature in a 2-D channel flow with vortices injected at the upstream boundary. We classified four types of vortex streets depending on the Reynolds number and vortices' strengths and spacings, and studied the different vortex dynamics in each situation. We then used Lagrangian coherent structures (LCS) to study the effect of the vortices on mixing and determined how the Nusselt number and Coefficients of performance vary with flow parameters and Peclet numbers.

  12. MAZE96. Generates 2D Input for DYNA NIKE & TOPAZ

    SciTech Connect

    Sanford, L.; Hallquist, J.O.

    1992-02-24

    MAZE is an interactive program that serves as an input and two-dimensional mesh generator for DYNA2D, NIKE2D, TOPAZ2D, and CHEMICAL TOPAZ2D. MAZE also generates a basic template for ISLAND input. MAZE has been applied to the generation of input data to study the response of two-dimensional solids and structures undergoing finite deformations under a wide variety of large deformation transient dynamic and static problems and heat transfer analyses.

  13. Generates 2D Input for DYNA NIKE & TOPAZ

    Energy Science and Technology Software Center (ESTSC)

    1996-07-15

    MAZE is an interactive program that serves as an input and two-dimensional mesh generator for DYNA2D, NIKE2D, TOPAZ2D, and CHEMICAL TOPAZ2D. MAZE also generates a basic template for ISLAND input. MAZE has been applied to the generation of input data to study the response of two-dimensional solids and structures undergoing finite deformations under a wide variety of large deformation transient dynamic and static problems and heat transfer analyses.

  14. Positron annihilation 2D-ACAR study of semi-coherent Li nanoclusters in MgO( 1 0 0 ) and MgO( 1 1 0 )

    NASA Astrophysics Data System (ADS)

    Falub, C. V.; Mijnarends, P. E.; Eijt, S. W. H.; van Huis, M. A.; van Veen, A.; Schut, H.

    2002-05-01

    Depth selective positron annihilation two-dimensional angular correlation of annihilation radiation (2D-ACAR) is used to determine the electronic structure of Li nanoclusters formed by implantation of 10 16 cm -26Li ions (with an energy of 30 keV) in MgO(1 0 0) and (1 1 0) crystals, and subsequently annealed at 950 K. The 2D-ACAR spectra of Li-implanted MgO obtained with 4 keV positrons reveal the semi-coherent ordering state of the embedded metallic Li nanoclusters. The results agree with ab initio Korringa-Kohn-Rostoker calculations.

  15. Numerical study of damage growth in particulate composites

    SciTech Connect

    Kwon, Y.W.; Liu, C.T.

    1999-10-01

    A numerical study was conducted to simulate and predict damage initiation and growth around the crack tip in particulate composite specimens made of hard particles embedded in a soft rubber-like matrix material. Therefore, damage evolution in the matrix material around crack tips was investigated. The progressive damage was modeled using a micro/macro-approach which combined two levels of analyses like the micro-level and the macro-level analyses. Damage description was undertaken at the microlevel using a simplified three-dimensional unit-cell model and an isotropic continuum damage theory. The numerical study examined both thin and thick specimens with a short or long edge crack to understand the effects of specimen thickness and crack size on the damage initiation, growth, and saturation. Numerical results were compared with experimental data.

  16. Numerical study of axisymmetric collapses of submarine granular > columns

    NASA Astrophysics Data System (ADS)

    Monsorno, Davide; Varsakelis, Christos

    2014-11-01

    In this talk, we report on the results of a numerical study of the axisymmetric collapse of subaqueous granular columns. Our study is based on a 2-pressure, 2-velocity continuum flow model for fluid-saturated granular materials. This model is integrated via a multi-phase projection method that incorporates a regularization method for the treatment of material interfaces. In our simulations, a dense column of a granular material immersed in water is placed on a horizontal plane and is allowed to collapse and spread due to its weight. Emphasis is placed on the run-out distance and the termination height and their correlation with the aspect ratio, the volume fraction and the diameter of the grains. Comparisons against experimental measurements and previous numerical predictions are also performed. Finally, in order to examine and quantify the role of the interstitial fluid, we compare our numerical predictions against experimental results from column collapses of dry granular materials.

  17. Evaluation of cell binding to collagen and gelatin: a study of the effect of 2D and 3D architecture and surface chemistry.

    PubMed

    Davidenko, Natalia; Schuster, Carlos F; Bax, Daniel V; Farndale, Richard W; Hamaia, Samir; Best, Serena M; Cameron, Ruth E

    2016-10-01

    Studies of cell attachment to collagen-based materials often ignore details of the binding mechanisms-be they integrin-mediated or non-specific. In this work, we have used collagen and gelatin-based substrates with different dimensional characteristics (monolayers, thin films and porous scaffolds) in order to establish the influence of composition, crosslinking (using carbodiimide) treatment and 2D or 3D architecture on integrin-mediated cell adhesion. By varying receptor expression, using cells with collagen-binding integrins (HT1080 and C2C12 L3 cell lines, expressing α2β1, and Rugli expressing α1β1) and a parent cell line C2C12 with gelatin-binding receptors (αvβ3 and α5β1), the nature of integrin binding sites was studied in order to explain the bioactivity of different protein formulations. We have shown that alteration of the chemical identity, conformation and availability of free binding motifs (GxOGER and RGD), resulting from addition of gelatin to collagen and crosslinking, have a profound effect on the ability of cells to adhere to these formulations. Carbodiimide crosslinking ablates integrin-dependent cell activity on both two-dimensional and three-dimensional architectures while the three-dimensional scaffold structure also leads to a high level of non-specific interactions remaining on three-dimensional samples even after a rigorous washing regime. This phenomenon, promoted by crosslinking, and attributed to cell entrapment, should be considered in any assessment of the biological activity of three-dimensional substrates. Spreading data confirm the importance of integrin-mediated cell engagement for further cell activity on collagen-based compositions. In this work, we provide a simple, but effective, means of deconvoluting the effects of chemistry and dimensional characteristics of a substrate, on the cell activity of protein-derived materials, which should assist in tailoring their biological properties for specific tissue engineering

  18. Influence of anisotropic grain boundary properties on the evolution of grain boundary character distribution during grain growth—a 2D level set study

    NASA Astrophysics Data System (ADS)

    Hallberg, Håkan

    2014-12-01

    The present study elaborates on a 2D level set model of polycrystal microstructures that was recently established by adding the influence of anisotropic grain boundary energy and mobility on microstructure evolution. The new model is used to trace the evolution of grain boundary character distribution during grain growth. The employed level set formulation conveniently allows the grain boundary characteristics to be quantified in terms of coincidence site lattice (CSL) type per unit of grain boundary length, providing a measure of the distribution of such boundaries. In the model, both the mobility and energy of the grain boundaries are allowed to vary with misorientation. In addition, the influence of initial polycrystal texture is studied by comparing results obtained from a polycrystal with random initial texture against results from a polycrystal that initially has a cube texture. It is shown that the proposed level set formulation can readily incorporate anisotropic grain boundary properties and the simulation results further show that anisotropic grain boundary properties only have a minor influence on the evolution of CSL boundary distribution during grain growth. As anisotropic boundary properties are considered, the most prominent changes in the CSL distributions are an increase of general low-angle Σ1 boundaries as well as a more stable presence of Σ3 boundaries. The observations also hold for the case of an initially cube-textured polycrystal. The presence of this kind of texture has little influence over the evolution of the CSL distribution. Taking into consideration the anisotropy of grain boundary properties, grain growth alone does not seem to be sufficient to promote any significantly increased overall presence of CSL boundaries.

  19. The mouse ruby-eye 2(d) (ru2(d) /Hps5(ru2-d) ) allele inhibits eumelanin but not pheomelanin synthesis.

    PubMed

    Hirobe, Tomohisa; Ito, Shosuke; Wakamatsu, Kazumasa

    2013-09-01

    The novel mutation named ru2(d) /Hps5(ru2-d) , characterized by light-colored coats and ruby-eyes, prohibits differentiation of melanocytes by inhibiting tyrosinase (Tyr) activity, expression of Tyr, Tyr-related protein 1 (Tyrp1), Tyrp2, and Kit. However, it is not known whether the ru2(d) allele affects pheomelanin synthesis in recessive yellow (e/Mc1r(e) ) or in pheomelanic stage in agouti (A) mice. In this study, effects of the ru2(d) allele on pheomelanin synthesis were investigated by chemical analysis of melanin present in dorsal hairs of 5-week-old mice from F2 generation between C57BL/10JHir (B10)-co-isogenic ruby-eye 2(d) and B10-congenic recessive yellow or agouti. Eumelanin content was decreased in ruby-eye 2(d) and ruby-eye 2(d) agouti mice, whereas pheomelanin content in ruby-eye 2(d) recessive yellow and ruby-eye 2(d) agouti mice did not differ from the corresponding Ru2(d) /- mice, suggesting that the ru2(d) allele inhibits eumelanin but not pheomelanin synthesis. PMID:23672590

  20. Numerical Study for Gta Weld Shape Variation by Coupling Welding Arc and Weld Pool

    NASA Astrophysics Data System (ADS)

    Dong, Wenchao; Lu, Shanping; Li, Dianzhong; Li, Yiyi

    A numerical modeling of the welding arc and weld pool is studied for moving GTA welding to investigate the effect of the surface active element oxygen and the plasma drag force on the weld shape. Based on the 2D axisymmetric numerical modeling of the argon arc, the heat flux, current density and plasma drag force are obtained under different welding currents. Numerical calculations to the weld pool development are carried out for moving GTA welding on SUS304 stainless steel with different oxygen contents 30 ppm and 220 ppm, respectively. The results show that the plasma drag force is another dominating driving force affecting the liquid pool flow pattern, except for the Marangoni force. The different welding currents will change the temperature distribution and plasma drag force on the pool surface, and affect the strength of Marangoni convection and the weld shape. The weld D/W ratio initially increases, followed by a constant value around 0.5 with the increasing welding current under high oxygen content. The weld D/W ratio under the low oxygen content slightly decreases with the increasing welding current. The predicted weld shape by simulation agrees well with experimental results.

  1. Numerical Studies of Nonlinear Schrodinger and Klein-Gordon Systems: Techniques and Applications

    NASA Astrophysics Data System (ADS)

    Choi, Dae-Il

    ödinger-Poisson equations. In particular, I study the dynamics of stationary stars, stars with linear momentum, and binary star systems. The recent discovery of Bose-Einstein condensates (BEC) in dilute atomic gases has led to renewed experimental and theoretical interest in the study of quantum degenerate gases. These condensates provide a new testing ground for atomic and many-body physics, and there are many unanswered questions in this emerging field. I present methods for manipulating the condensates by an optical lattice generated by laser light and study the effect of atomic interaction on the quantum transport properties. I also study Bloch oscillations and Landau-Zener tunnelings in an accelerating optical lattice. The study of hydrogen atoms interacting with ultra-intense laser light in the non-perturbative regime has gained attention as a surprising new phenomena in nonlinear atomic physics. Particularly noteworthy are high harmonic generation (HHG) and stabilization, which provide interesting new physics. I use a 2D model to study stabilization behavior for an arbitrary polarization. As a first step, I studied circular and linear laser polarizations. In the circular case, I found spiral wave functions with strong stabilization. In the linear case, I found dichotomous wave functions with weaker stabilization. I have also observed the related HHG signatures. Finally, adaptive mesh refinement (AMR) techniques are crucial for the numerical solution of problems which have large dynamical range. I present results from the implementation and testing of some general algorithms for use in AMR work, including 2D and 3D clustering routines.

  2. Guided ion beam and theoretical study of the reactions of Os{sup +} with H{sub 2}, D{sub 2}, and HD

    SciTech Connect

    Hinton, Christopher S.; Citir, Murat; Armentrout, P. B.

    2011-12-21

    Reactions of the third-row transition metal cation Os{sup +} with H{sub 2}, D{sub 2}, and HD to form OsH{sup +} (OsD{sup +}) were studied using a guided ion beam tandem mass spectrometer. A flow tube ion source produces Os{sup +} in its {sup 6}D (6s{sup 1}5d{sup 6}) electronic ground state level. Corresponding state-specific reaction cross sections are obtained. The kinetic energy dependences of the cross sections for the endothermic formation of OsH{sup +} and OsD{sup +} are analyzed to give a 0 K bond dissociation energy of D{sub 0}(Os{sup +}-H) = 2.45 {+-} 0.10 eV. Quantum chemical calculations are performed here at several levels of theory, with B3LYP approaches generally overestimating the experimental bond energy whereas results obtained using BHLYP and CCSD(T), coupled-cluster with single, double, and perturbative triple excitations, levels show good agreement. Theory also provides the electronic structures of these species and the potential energy surfaces for reaction. Results from the reactions with HD provide insight into the reaction mechanism and indicate that Os{sup +} reacts via a direct reaction. We also compare this third-row transition metal system with the first-row and second-row congeners, Fe{sup +} and Ru{sup +}, and find that Os{sup +} reacts more efficiently with dihydrogen, forming a stronger M{sup +}-H bond. These differences can be attributed to the lanthanide contraction and relativistic effects.

  3. A comparative study of DIGNET, average, complete, single hierarchical and k-means clustering algorithms in 2D face image recognition

    NASA Astrophysics Data System (ADS)

    Thanos, Konstantinos-Georgios; Thomopoulos, Stelios C. A.

    2014-06-01

    The study in this paper belongs to a more general research of discovering facial sub-clusters in different ethnicity face databases. These new sub-clusters along with other metadata (such as race, sex, etc.) lead to a vector for each face in the database where each vector component represents the likelihood of participation of a given face to each cluster. This vector is then used as a feature vector in a human identification and tracking system based on face and other biometrics. The first stage in this system involves a clustering method which evaluates and compares the clustering results of five different clustering algorithms (average, complete, single hierarchical algorithm, k-means and DIGNET), and selects the best strategy for each data collection. In this paper we present the comparative performance of clustering results of DIGNET and four clustering algorithms (average, complete, single hierarchical and k-means) on fabricated 2D and 3D samples, and on actual face images from various databases, using four different standard metrics. These metrics are the silhouette figure, the mean silhouette coefficient, the Hubert test Γ coefficient, and the classification accuracy for each clustering result. The results showed that, in general, DIGNET gives more trustworthy results than the other algorithms when the metrics values are above a specific acceptance threshold. However when the evaluation results metrics have values lower than the acceptance threshold but not too low (too low corresponds to ambiguous results or false results), then it is necessary for the clustering results to be verified by the other algorithms.

  4. A Numerical/Experimental Study of Nitinol Actuator Springs

    NASA Astrophysics Data System (ADS)

    Auricchio, Ferdinando; Scalet, Giulia; Urbano, Marco

    2014-07-01

    This study deals with the numerical modeling, simulation and experimental analysis of shape-memory alloy (SMA) helicoidal springs. An experimental campaign is conducted on both SMA straight wires and helicoidal springs that experienced the same annealing process. Then, we use such experimental results to investigate three phenomenological constitutive models able to represent SMA macroscopic behavior. In particular, after the identification of all the material parameters from experimental results on SMA wires, we inspect the thermo-mechanical behavior of SMA helicoidal springs by comparing numerical predictions to experimental data. Finally, we discuss models capabilities and some aspects characterizing SMA material behavior.

  5. Numerical study of the small scale structures in Boussinesq convection

    NASA Technical Reports Server (NTRS)

    Weinan, E.; Shu, Chi-Wang

    1992-01-01

    Two-dimensional Boussinesq convection is studied numerically using two different methods: a filtered pseudospectral method and a high order accurate Essentially Nonoscillatory (ENO) scheme. The issue whether finite time singularity occurs for initially smooth flows is investigated. The numerical results suggest that the collapse of the bubble cap is unlikely to occur in resolved calculations. The strain rate corresponding to the intensification of the density gradient across the front saturates at the bubble cap. We also found that the cascade of energy to small scales is dominated by the formulation of thin and sharp fronts across which density jumps.

  6. Numerical study of the Kerr solution in rotating coordinates

    NASA Astrophysics Data System (ADS)

    Bai, S.; Izquierdo, G.; Klein, C.

    2016-06-01

    The Kerr solution in coordinates corotating with the horizon is studied as a testbed for a spacetime with a helical Killing vector in the Ernst picture. The solution is numerically constructed by solving the Ernst equation with a spectral method and a Newton iteration. We discuss convergence of the iteration for several initial iterates and different values of the Kerr parameters.

  7. Numerical studies of gravity effects in two-phase reservoirs

    SciTech Connect

    Bodvarsson, G.S.; Cox, B.L.

    1986-06-01

    Numerical studies are performed to investigate the effects of localized feed zones on the pressure transients in two-phase reservoirs. It is shown that gravity effects can significantly affect the pressure transients, because of the large difference in the density of liquid water and vapor. Pressure transients for shallow and deep feed zones and the resulting fluid flow patterns are discussed.

  8. Numerical study of porosity in titanium dental castings.

    PubMed

    Wu, M; Sahm, P R; Augthun, M; Spiekermann, H; Schädlich-Stubenrauch, J

    1999-09-01

    A commercial software package, MAGMASOFT (MAGMA Giessereitechnologie GmbH, Aachen, Germany), was used to study shrinkage and gas porosity in titanium dental castings. A geometrical model for two simplified tooth crowns connected by a connector bar was created. Both mold filling and solidification of this casting model were numerically simulated. Shrinkage porosity was quantitatively predicted by means of a built-in feeding criterion. The risk of gas pore formation was investigated using the numerical filling and solidification results. The results of the numerical simulations were compared with experiments, which were carried out on a centrifugal casting machine with an investment block mold. The block mold was made of SiO2 based slurry with a 1 mm thick Zr2 face coat to reduce metal-mold reactions. Both melting and casting were carried out under protective argon (40 kPa). The finished castings were sectioned and the shrinkage porosity determined. The experimentally determined shrinkage porosity coincided with the predicted numerical simulation results. No apparent gas porosity was found in these model castings. Several running and gating systems for the above model casting were numerically simulated. An optimized running and gating system design was then experimentally cast, which resulted in porosity-free castings. PMID:15348102

  9. Numerical Study of Interaction of a Vortical Density Inhomogeneity with Shock and Expansion Waves

    NASA Technical Reports Server (NTRS)

    Povitsky, A.; Ofengeim, D.

    1998-01-01

    We studied the interaction of a vortical density inhomogeneity (VDI) with shock and expansion waves. We call the VDI the region of concentrated vorticity (vortex) with a density different from that of ambiance. Non-parallel directions of the density gradient normal to the VDI surface and the pressure gradient across a shock wave results in an additional vorticity. The roll-up of the initial round VDI towards a non-symmetrical shape is studied numerically. Numerical modeling of this interaction is performed by a 2-D Euler code. The use of an adaptive unstructured numerical grid makes it possible to obtain high accuracy and capture regions of induced vorticity with a moderate overall number of mesh points. For the validation of the code, the computational results are compared with available experimental results and good agreement is obtained. The interaction of the VDI with a propagating shock wave is studied for a range of initial and induced circulations and obtained flow patterns are presented. The splitting of the VDI develops into the formation of a non-symmetrical vortex pair and not in a set of vortices. A method for the analytical computation of an overall induced circulation Gamma(sub 1) as a result of the interaction of a moving VDI with a number of waves is proposed. Simplified, approximated, expressions for Gamma(sub 1) are derived and their accuracy is discussed. The splitting of the VDI passing through the Prandtl-Meyer expansion wave is studied numerically. The obtained VDI patterns are compared to those for the interaction of the VDI with a propagating shock wave for the same values of initial and induced circulations. These patterns have similar shapes for corresponding time moments.

  10. The cytochrome P450 2D-mediated formation of serotonin from 5-methoxytryptamine in the brain in vivo: a microdialysis study.

    PubMed

    Haduch, Anna; Bromek, Ewa; Kot, Marta; Kamińska, Katarzyna; Gołembiowska, Krystyna; Daniel, Wladyslawa A

    2015-04-01

    The cytochrome P450 2D (CYP2D) mediates synthesis of serotonin from 5-methoxytryptamine (5-MT), shown in vitro for cDNA-expressed CYP2D-isoforms and liver and brain microsomes. We aimed to demonstrate this synthesis in the brain in vivo. We measured serotonin tissue content in brain regions after 5-MT injection into the raphe nuclei (Model-A), and its extracellular concentration in rat frontal cortex and striatum using an in vivo microdialysis (Model-B) in male Wistar rats. Naïve rats served as control animals. 5-MT injection into the raphe nuclei of PCPA-(tryptophan hydroxylase inhibitor)-pretreated rats increased the tissue concentration of serotonin (from 40 to 90% of the control value, respectively, in the striatum), while the CYP2D inhibitor quinine diminished serotonin level in some brain structures of those animals (Model-A). 5-MT given locally through a microdialysis probe markedly increased extracellular serotonin concentration in the frontal cortex and striatum (to 800 and 1000% of the basal level, respectively) and changed dopamine concentration (Model-B). Quinine alone had no effect on serotonin concentration; however, given jointly with 5-MT, it prevented the 5-MT-induced increase in cortical serotonin in naïve rats and in striatal serotonin in PCPA-treated animals. These results indicate that the CYP2D-catalyzed alternative pathway of serotonin synthesis from 5-MT is relevant in the brain in vivo, and set a new target for the action of psychotropics. PMID:25581337

  11. Numerical study of self modulation instability of 1 nC electron bunch at ATF

    SciTech Connect

    Fang Yun; Mori, Warren; Muggli, Patric

    2012-12-21

    The development of self-modulation instability (SMI) is investigated numerically for the 1 nC electron bunch available at Accelerator Test Facility (ATF) of Brookhaven National Laboratory (BNL). Possible experiment based on the simulation results is proposed. All the simulations are performed with the 2D-cylindrically symmetric particle-in-cell code.

  12. Stacking up 2D materials

    NASA Astrophysics Data System (ADS)

    Mayor, Louise

    2016-05-01

    Graphene might be the most famous example, but there are other 2D materials and compounds too. Louise Mayor explains how these atomically thin sheets can be layered together to create flexible “van der Waals heterostructures”, which could lead to a range of novel applications.

  13. MAGNUM-2D computer code: user's guide

    SciTech Connect

    England, R.L.; Kline, N.W.; Ekblad, K.J.; Baca, R.G.

    1985-01-01

    Information relevant to the general use of the MAGNUM-2D computer code is presented. This computer code was developed for the purpose of modeling (i.e., simulating) the thermal and hydraulic conditions in the vicinity of a waste package emplaced in a deep geologic repository. The MAGNUM-2D computer computes (1) the temperature field surrounding the waste package as a function of the heat generation rate of the nuclear waste and thermal properties of the basalt and (2) the hydraulic head distribution and associated groundwater flow fields as a function of the temperature gradients and hydraulic properties of the basalt. MAGNUM-2D is a two-dimensional numerical model for transient or steady-state analysis of coupled heat transfer and groundwater flow in a fractured porous medium. The governing equations consist of a set of coupled, quasi-linear partial differential equations that are solved using a Galerkin finite-element technique. A Newton-Raphson algorithm is embedded in the Galerkin functional to formulate the problem in terms of the incremental changes in the dependent variables. Both triangular and quadrilateral finite elements are used to represent the continuum portions of the spatial domain. Line elements may be used to represent discrete conduits. 18 refs., 4 figs., 1 tab.

  14. Seismic study of the inner part of the Tyrrhenian basin from 2-D joint refraction and reflection travel-time tomography

    NASA Astrophysics Data System (ADS)

    Prada, M.; Sallares, V.; Ranero, C. R.; Guzman, M.; Grevemeyer, I.; Zitellini, N.

    2011-12-01

    Located between Italy, Corsica, Sardinia and Sicily the Tyrrhenian Sea is a Neogen back-arc basin formed by continental extension attributed to the southeastward rollback of the subducting Ionian plate. This triangle-shaped basin is an ideal place to study the evolution of extension process. The basin displays different states of extension along its length, finding from the early, low-extension episodes of continental rifting in the northern areas to the exhumation of the mantle in the deepest part of the basin. In order to study the nature of the crust and the 4D evolution of the Tyrrhenian basin, we have collected a survey of multichannel (MCS) and wide angle seismic (WAS) data. This survey was carried out into the framework of the MEDOC project during 2010 with the coordination of 2 research vessels, the R/V Sarmiento de Gamboa and the R/V Urania. During the experiment a total of 17 lines of MCS and 5 lines of WAS were acquired, with more than 100 deployments of both Ocean Bottom Hydrophones (OBH) and Ocean Bottom Seismometers (OBS). The coordination with more than one team on land made possible to record data by land stations in Corsica, Sardinia and Italy. Here we present 2D P-wave velocity models with the velocity distribution in the crust and uppermost mantle and the geometry of the moho boundary, obtained by joint refraction and reflection tomography of WAS data. The data belong to lines recorded between Sardinia and Italy and Sardinia and Sicily. The data selected for the inversion consist in phases refracted through the crust and upper mantle (phases Pg and Pn) and reflected in the moho boundary (phases PmP). A detailed statistical uncertainty analysis will allow us to use seismic velocities to predict the petrology of the different domains recognized. The aim of this modeling effort is to identify the different crustal units across the basin in order to determine the transition between the continental little extended crust and the exhumed mantle.

  15. Numerical Studies on a Rotor with Distributed Suction for Noise Reduction

    NASA Astrophysics Data System (ADS)

    Lutz, Thorsten; Arnold, Benjamin; Wolf, Alexander; Krämer, Ewald

    2014-06-01

    Minimizing the flow-induced noise is an important issue in the design of modern onshore wind turbines. There is a number of proven passive means to reduce the aeroacoustic noise, such as the implementation of serrations, porous trailing edges or the aeroacoustic airfoil design. The noise emission can be further reduced by active flow control techniques. In the present study the impact of distributed boundary layer suction on the noise emission of an airfoil and a complete rotor is investigated. Aerodynamic and aeroacoustic wind tunnel tests were performed for the NACA 64-418 airfoil and supplemented by numerical calculations. The aeroacoustic analyses have been conducted by means of the institute's Rnoise prediction scheme. The 2D studies have shown that noise reductions of 5 dB can be achieved by suction at moderate mass flow rates. To study the impact of three-dimensional effects numerical investigations have been conducted on the example of the generic NREL 5MW rotor with suction applied in the outer part of the blade. The predictions for the complete rotor provided smaller benefits compared to those for the isolated airfoil, mainly because the examined suction configurations were not optimized with respect to the extent of the suction patch and suction distribution.

  16. Numerical Model Studies of the Martian Mesoscale Circulations

    NASA Technical Reports Server (NTRS)

    Segal, Moti; Arritt, Raymond W.

    1997-01-01

    The study objectives were to evaluate by numerical modeling various possible mesoscale circulation on Mars and related atmospheric boundary layer processes. The study was in collaboration with J. Tillman of the University of Washington (who supported the study observationally). Interaction has been made with J. Prusa of Iowa State University in numerical modeling investigation of dynamical effects of topographically-influenced flow. Modeling simulations included evaluations of surface physical characteristics on: (i) the Martian atmospheric boundary layer and (ii) their impact on thermally and dynamically forced mesoscale flows. Special model evaluations were made in support of selection of the Pathfinder landing sites. J. Tillman's finding of VL-2 inter-annual temperature difference was followed by model simulations attempting to point out the forcing for this feature. Publication of the results in the reviewed literature in pending upon completion of the manuscripts in preparation as indicated later.

  17. Numerical studies of HF Doppler variations caused by ionospheric disturbances

    NASA Astrophysics Data System (ADS)

    Takefu, M.; Hiroshige, N.

    HF Doppler variations caused by ionospheric disturbances are studied using an ionosphere model containing sinusoidal traveling electron density fluctuations. The present study uses a more realistic ionosphere model and a more accurate numerical method than previous works using corrugated specular reflector models. The study gives a clue to estimate the TID-associated fluctuations of ionospheric electron density by means of HF Doppler measurements. It is shown that some kinds of characteristic HF Doppler traces result depending on the wavelength of the disturbance and its traveling direction. Numerical results suggest that more or less 5 percent of the background electron density can explain most of the quasi-periodic variations on the observed HF Doppler records.

  18. EPR study of the onset of long-range order in the 2D organo-metallic magnet Cu(pyz)2(pyo)2(PF6)2

    SciTech Connect

    Mcdonald, Ross D; Ayala - Valenzuela, Oscar E; Singleton, John; Goddard, Paul A; Franke, I; Manson, J. L.

    2011-01-14

    The spin (S) 1/2 two-dimensional (2D) square-lattice quantum Heisenberg antiferromagnet system has long been interesting to theoretical physicists due to the variety of transitions that can arise. Moreover, the role of S = 1/2 fluctuations on a square lattice in the mechanism for cuprate superconductivity is hotly debated. Low dimensional metal-organic magnets, such as Cu(pyz){sub 2}(pyo){sub 2}(PF{sub 6}){sub 2}, offer the possibility to readily control the exchange parameters in a 20 system by changing chemical composition, thus creating spin architectures with desirable properties 'to order'. For a perfectly 20 system, long range magnetic order would not occur at finite temperature. However, in the metal-organic systems, interlayer coupling gives rise to a finite Neel temperature. For these quasi-2D systems the ordering temperature is dominated by the weakest (the interlayer) exchange interaction, whereas the saturation magnetic field is dominated by the strongest exchange interactions, thus providing a means of estimating the spatial exchange anisotropy in the system. It should be noted that the more 2D the system, the wider the temperature (T) range, T{sub N} < T < J/k{sub B}, over which magnetic fluctuations dominate. As evident by the ratio of magnetic saturation field, H{sub sat} {approx} 30 T, to the Neel temperature, T{sub N} = 1.72 K, Cu(pyz){sub 2}(pyo){sub 2}(PF{sub 6}){sub 2} is a good example of a 2D system with the anisotropy between inplane and interplane exchange interactions being of the order of 10{sup 3}.

  19. Analytical and Numerical Studies of Coherent Field Configurations

    NASA Astrophysics Data System (ADS)

    Muller, Hans-Reinhard

    Motivated by the goal of investigating the dynamics of the electroweak phase transition in the early Universe, a study of dynamical aspects of nonlinear field-theoretical systems is performed. Symmetric and asymmetric double-well potentials in the φ4 theory are used as a model for these systems. In the first part, it is shown that in this model, a class of localized, time-dependent, spherically-symmetric objects dubbed oscillons exists. The most distinctive feature of these objects is that they are extremely long-lived. The properties of oscillons are studied by numerical and analytical means. In the second part of the study, the matching between (1+1)-dimensional nonlinear field theories coupled to an external stochastic environment and their lattice simulations is investigated. In particular, a method is developed to obtain numerical results which are lattice-spacing independent, and to extract the correct effective potential which emerges from the simulations. As an application, the thermal production of kinks is studied, obtaining the lattice-spacing independent number density of kinks and the effective barrier for kink production, i.e., the effective kink mass. Within its range of validity, the approach can be used to match numerical simulations to continuum studies of the emergence of coherent field structures in cosmology and condensed matter physics.

  20. Electrochemical incineration of indigo. A comparative study between 2D (plate) and 3D (mesh) BDD anodes fitted into a filter-press reactor.

    PubMed

    Nava, José L; Sirés, Ignasi; Brillas, Enric

    2014-01-01

    This paper compares the performance of 2D (plate) and 3D (mesh) boron-doped diamond (BDD) electrodes, fitted into a filter-press reactor, during the electrochemical incineration of indigo textile dye as a model organic compound in chloride medium. The electrolyses were carried out in the FM01-LC reactor at mean fluid velocities between 0.9 ≤ u ≤ 10.4 and 1.2 ≤ u ≤ 13.9 cm s(-1) for the 2D BDD and the 3D BDD electrodes, respectively, at current densities of 5.63 and 15 mA cm(-2). The oxidation of the organic matter was promoted, on the one hand, via the physisorbed hydroxyl radicals (BDD(·OH)) formed from water oxidation at the BDD surface and, on the other hand, via active chlorine formed from the oxidation of chloride ions on BDD. The performance of 2D BDD and 3D BDD electrodes in terms of current efficiency, energy consumption, and charge passage during the treatments is discussed. PMID:24737017

  1. Numerical study of wave propagation around an underground cavity: acoustic case

    NASA Astrophysics Data System (ADS)

    Esterhazy, Sofi; Perugia, Ilaria; Schöberl, Joachim; Bokelmann, Götz

    2015-04-01

    Motivated by the need to detect an underground cavity within the procedure of an On-Site-Inspection (OSI) of the Comprehensive Nuclear Test Ban Treaty Organization (CTBTO), which might be caused by a nuclear explosion/weapon testing, we aim to provide a basic numerical study of the wave propagation around and inside such an underground cavity. The aim of the CTBTO is to ban all nuclear explosions of any size anywhere, by anyone. Therefore, it is essential to build a powerful strategy to efficiently investigate and detect critical signatures such as gas filled cavities, rubble zones and fracture networks below the surface. One method to investigate the geophysical properties of an underground cavity allowed by the Comprehensive Nuclear-test Ban Treaty is referred to as 'resonance seismometry' - a resonance method that uses passive or active seismic techniques, relying on seismic cavity vibrations. This method is in fact not yet entirely determined by the Treaty and there are also only few experimental examples that have been suitably documented to build a proper scientific groundwork. This motivates to investigate this problem on a purely numerical level and to simulate these events based on recent advances in the mathematical understanding of the underlying physical phenomena. Here, we focus our numerical study on the propagation of P-waves in two dimensions. An extension to three dimensions as well as an inclusion of the full elastic wave field is planned in the following. For the numerical simulations of wave propagation we use a high order finite element discretization which has the significant advantage that it can be extended easily from simple toy designs to complex and irregularly shaped geometries without excessive effort. Our computations are done with the parallel Finite Element Library NGSOLVE ontop of the automatic 2D/3D tetrahedral mesh generator NETGEN (http://sourceforge.net/projects/ngsolve/). Using the basic mathematical understanding of the

  2. Numerical Study on Cryogenic Coflowing Jets under Transcritical Conditions

    NASA Astrophysics Data System (ADS)

    Tani, Hiroumi; Teramoto, Susumu; Okamoto, Koji; Yamanishi, Nobuhiro

    2012-11-01

    A numerical and experimental study is presented on cryogenic coflowing jets under transcritical conditions for a better understanding of the propellant mixing in supercritical-pressure rocket engines. The major concerns are dominant flow structures in the mixing of cryogenic coflowing jets under transcritical conditions. Experimentally, in advance of detailed numerical simulations, cryogenic nitrogen/gaseous nitrogen coaxial jets were visualized by the backlighting photography technique. It was observed that a dense nitrogen core has a shear-layer instability near the injector exit and eventually breaks up into large lumps which dissolve and fade away downstream. In numerical simulations, LES technique was employed for more detailed discussion on the flow structures. LES of a cryogenic nitrogen/gaseous nitrogen coflowing plane jet was conducted with the same density and velocity ratios of inner/outer jets as the experiments. As observed in the experiments, the shear-layer instability in the inner mixing layers is predominant near the injector exit. After roll-up and paring, the shear-layer instability waves become large-scale vortices. They cause coherent vortex structures which become dominant in the downstream and break the dense core into lumps. Strouhal numbers of the shear-layer instability and the dense lump shedding in the numerical simulations were comparable to those measured in the experiments, respectively.

  3. On the Numerical Study of Heavy Rainfall in Taiwan

    NASA Technical Reports Server (NTRS)

    Tao, Wei-Kuo; Chen, Ching-Sen; Chen, Yi-Leng; Jou, Ben Jong-Dao; Lin, Pay-Liam; Starr, David OC. (Technical Monitor)

    2001-01-01

    Heavy rainfall events are frequently observed over the western side of the CMR (central mountain range), which runs through Taiwan in a north-south orientation, in a southwesterly flow regime and over the northeastern side of the CMR in a northeasterly flow regime. Previous studies have revealed the mechanisms by which the heavy rainfall events are formed. Some of them have examined characteristics of the heavy rainfall via numerical simulations. In this paper, some of the previous numerical studies on heavy rainfall events around Taiwan during the Mei-Yu season (May and June), summer (non-typhoon cases) and autumn will be reviewed. Associated mechanisms proposed from observational studies will be reviewed first, and then characteristics of numerically simulated heavy rainfall events will be presented. The formation mechanisms of heavy rainfall from simulated results and from observational analysis are then compared and discussed. Based on these previous modeling studies, we will also discuss what are the major observations and modeling processes which will be needed for understanding the heavy precipitation in the future.

  4. Numerical Studies of a Fluidic Diverter for Flow Control

    NASA Technical Reports Server (NTRS)

    Gokoglu, Suleyman A.; Kuczmarski, Maria A.; Culley, Dennis E.; Raghu, Surya

    2009-01-01

    The internal flow structure in a specific fluidic diverter is studied over a range from low subsonic to sonic inlet conditions by a time-dependent numerical analysis. The understanding will aid in the development of fluidic diverters with minimum pressure losses and advanced designs of flow control actuators. The velocity, temperature and pressure fields are calculated for subsonic conditions and the self-induced oscillatory behavior of the flow is successfully predicted. The results of our numerical studies have excellent agreement with our experimental measurements of oscillation frequencies. The acoustic speed in the gaseous medium is determined to be a key factor for up to sonic conditions in governing the mechanism of initiating the oscillations as well as determining its frequency. The feasibility of employing plasma actuation with a minimal perturbation level is demonstrated in steady-state calculations to also produce oscillation frequencies of our own choosing instead of being dependent on the fixed-geometry fluidic device.

  5. Numerical study of fractional nonlinear Schrödinger equations

    PubMed Central

    Klein, Christian; Sparber, Christof; Markowich, Peter

    2014-01-01

    Using a Fourier spectral method, we provide a detailed numerical investigation of dispersive Schrödinger-type equations involving a fractional Laplacian in an one-dimensional case. By an appropriate choice of the dispersive exponent, both mass and energy sub- and supercritical regimes can be identified. This allows us to study the possibility of finite time blow-up versus global existence, the nature of the blow-up, the stability and instability of nonlinear ground states and the long-time dynamics of solutions. The latter is also studied in a semiclassical setting. Moreover, we numerically construct ground state solutions of the fractional nonlinear Schrödinger equation. PMID:25484604

  6. Numerical study of unsteady processes in a Faraday MHD generator

    NASA Astrophysics Data System (ADS)

    Vinogradova, G. N.; Panchenko, V. P.

    1981-07-01

    A numerical study is presented on the unsteady processes occurring in a Faraday MHD generator with a high power-conversion efficiency. A supersonic MHD generator operating with an equilibrium plasma and designed to convert energy in a system using a thermonuclear reactor is considered, and the steady operating modes are established for cases when an ohmic load is connected, disconnected, or reduced. A magnetic field is assumed to be generated by a suitable profiling of the external magnetic field, and the working medium is modeled by an ideal gas. Partial differential equations are solved numerically by using a central difference predictor-corrector scheme. The study can be applied to problems (e.g., transient times, nominal parameter maximal values and rates of change, methods of regulating the generator and switching it on and off) arising during the design of MHD generators.

  7. Attosecond lighthouses in gases: A theoretical and numerical study

    NASA Astrophysics Data System (ADS)

    Auguste, T.; Gobert, O.; Ruchon, T.; Quéré, F.

    2016-03-01

    We present an extensive theoretical and numerical study of the attosecond lighthouse effect in gases. We study how this scheme impacts the spatiotemporal structure of the driving laser field all along the generation medium, and show that this can modify the phase matching relation governing high-harmonic generation (HHG) in gases. We then present a set of numerical simulations performed to test the robustness of the effect against variations of HHG parameters, and to identify possible solutions for relaxing the constraint on the driving laser pulse duration. We thus demonstrate that the lighthouse effect can actually be achieved with laser pulses consisting of up to ˜8 optical periods available from current lasers without postcompression, for instance by using an appropriate combination of 800 - and 1600 -nm wavelength fields.

  8. Numerical study of fractional nonlinear Schrödinger equations.

    PubMed

    Klein, Christian; Sparber, Christof; Markowich, Peter

    2014-12-01

    Using a Fourier spectral method, we provide a detailed numerical investigation of dispersive Schrödinger-type equations involving a fractional Laplacian in an one-dimensional case. By an appropriate choice of the dispersive exponent, both mass and energy sub- and supercritical regimes can be identified. This allows us to study the possibility of finite time blow-up versus global existence, the nature of the blow-up, the stability and instability of nonlinear ground states and the long-time dynamics of solutions. The latter is also studied in a semiclassical setting. Moreover, we numerically construct ground state solutions of the fractional nonlinear Schrödinger equation. PMID:25484604

  9. Numerical study of multicomponent droplet vaporization at near critical conditions

    NASA Technical Reports Server (NTRS)

    Hsieh, Kwang-Chung; Shuen, Jian-Shun; Yang, Vigor

    1988-01-01

    A comprehensive numerical analysis of multicomponent droplet vaporization at near critical conditions has been carried out. The model is based on the full time-dependent conservation equations and accommodates various important high-pressure phenomena. As an example, the case involving a two-component (n-pentane and n-octane) fuel droplet in nitrogen gas is studied. The influences of transient effects, surface regression, ambient gas solubility, and phase-equilibrium relations on vaporization mechanisms are examined in detail.

  10. A numerical study of the Nordic Sea circulation and outflows

    NASA Astrophysics Data System (ADS)

    Yang, J.; Pratt, L. J.

    2010-12-01

    The Nordic Seas outflow over the Greenland-Iceland-Scotland Ridge is investigated by using a two-layer numerical model with both idealized and realistic topography. The study focuses on physical processes and topographic effects that influence the pathways of the Nordic Seas source water that feeds the overflow through the Denmark Strait and Faroe Bank Channel. The potential vorticity balance and integral constraints will be used to explain the sensitivity of the overflows to the upstream (Nordic Seas) circulation and forcing.

  11. MOSS2D V1

    Energy Science and Technology Software Center (ESTSC)

    2001-01-31

    This software reduces the data from two-dimensional kSA MOS program, k-Space Associates, Ann Arbor, MI. Initial MOS data is recorded without headers in 38 columns, with one row of data per acquisition per lase beam tracked. The final MOSS 2d data file is reduced, graphed, and saved in a tab-delimited column format with headers that can be plotted in any graphing software.

  12. Numerical Study of Buoyancy and Different Diffusion Effects on the Structure and Dynamics of Triple Flames

    NASA Technical Reports Server (NTRS)

    Chen, Jyh-Yuan; Echekki, Tarek

    2001-01-01

    Numerical simulations of 2-D triple flames under gravity force have been implemented to identify the effects of gravity on triple flame structure and propagation properties and to understand the mechanisms of instabilities resulting from both heat release and buoyancy effects. A wide range of gravity conditions, heat release, and mixing widths for a scalar mixing layer are computed for downward-propagating (in the same direction with the gravity vector) and upward-propagating (in the opposite direction of the gravity vector) triple flames. Results of numerical simulations show that gravity strongly affects the triple flame speed through its contribution to the overall flow field. A simple analytical model for the triple flame speed, which accounts for both buoyancy and heat release, is developed. Comparisons of the proposed model with the numerical results for a wide range of gravity, heat release and mixing width conditions, yield very good agreement. The analysis shows that under neutral diffusion, downward propagation reduces the triple flame speed, while upward propagation enhances it. For the former condition, a critical Froude number may be evaluated, which corresponds to a vanishing triple flame speed. Downward-propagating triple flames at relatively strong gravity effects have exhibited instabilities. These instabilities are generated without any artificial forcing of the flow. Instead disturbances are initiated by minute round-off errors in the numerical simulations, and subsequently amplified by instabilities. A linear stability analysis on mean profiles of stable triple flame configurations have been performed to identify the most amplified frequency in spatially developed flows. The eigenfunction equations obtained from the linearized disturbance equations are solved using the shooting method. The linear stability analysis yields reasonably good agreements with the observed frequencies of the unstable triple flames. The frequencies and amplitudes of

  13. Experimental and numerical study on fragmentation of steel projectiles

    NASA Astrophysics Data System (ADS)

    Råkvaag, K. G.; Børvik, T.; Hopperstad, O. S.; Westermann, I.

    2012-08-01

    A previous experimental study on penetration and perforation of circular Weldox 460E target plates with varying thicknesses struck by blunt-nose projectiles revealed that fragmentation of the projectile occurred if the target thickness or impact velocity exceeded a certain value. Thus, numerical simulations that do not account for fragmentation during impact can underestimate the perforation resistance of protective structures. Previous numerical studies have focused primarily on the target plate behaviour. This study considers the behaviour of the projectile and its possible fragmentation during impact. Hardened steel projectiles were launched at varying velocities in a series of Taylor tests. The impact events were captured using a high-speed camera. Fractography of the fragmented projectiles showed that there are several fracture mechanisms present during the fragmentation process. Tensile tests of the projectile material revealed that the hardened material has considerable variations in yield stress and fracture stress and strain. In the finite element model, the stress-strain behaviour from tensile tests was used to model the projectile material with solid elements and the modified Johnson-Cook constitutive relation. Numerical simulations incorporating the variations in material properties are capable of reproducing the experimental fracture patterns, albeit the predicted fragmentation velocities are too low.

  14. Determination of the Ground Vibrational State Parameters of the C2D4 Molecule

    NASA Astrophysics Data System (ADS)

    Fomchenko, A. L.; Zhang, F.; Gromova, O. V.; Buttersack, T.

    2016-07-01

    The object of the study is the C2D4 molecule, as it is important to know its properties to address numerous problems of molecular physics. The analysis of high-resolution spectra of the deuterated ethylene molecule was made in the range of 600-1200 cm-1, specifically bands ν7 and ν12. The results obtained were used to determine high-accurate values of the vibrational-rotational levels of the ground vibrational state of the C2D4 molecule.

  15. Two Keggin-type heteropolytungstates with transition metal as a central atom: Crystal structure and magnetic study with 2D-IR correlation spectroscopy

    SciTech Connect

    Chai, Feng; Chen, YiPing; You, ZhuChai; Xia, ZeMin; Ge, SuZhi; Sun, YanQiong; Huang, BiHua

    2013-06-01

    Two Keggin-type heteropolytungstates, [Co(phen)₃]₃[CoW₁₂O₄₀]·9H₂O 1 (phen=1,10-phenanthroline) and [Fe(phen)₃]₂[FeW₁₂O₄₀]·H₃O·H₂O 2, have been synthesized via the hydrothermal technique and characterized by single crystal X-ray diffraction analyses, IR, XPS, TG analysis, UV–DRS, XRD, thermal-dependent and magnetic-dependent 2D-COS IR (two-dimensional infrared correlation spectroscopy). Crystal structure analysis reveals that the polyanions in compound 1 are linked into 3D supramolecule through hydrogen bonding interactions between lattice water molecules and terminal oxygen atoms of polyanion units, and [Co(phen)₃]²⁺ cations distributed in the polyanion framework with many hydrogen bonding interactions. The XPS spectra indicate that all the Co atoms in 1 are +2 oxidation state, the Fe atoms in 2 existing with +2 and +3 mixed oxidation states. - Graphical abstract: The magnetic-dependent synchronous 2D correlation IR spectra of 1 (a), 2 (b) over 0–50 mT in the range of 600–1000 cm⁻¹, the obvious response indicate two Keggin polyanions skeleton susceptible to applied magnetic field. Highlights: • Two Keggin-type heteropolytungstates with transition metal as a central atom has been obtained. • Compound 1 forms into 3D supramolecular architecture through hydrogen bonding between water molecules and polyanions. • Magnetic-dependent 2D-IR correlation spectroscopy was introduced to discuss the magnetism of polyoxometalate.

  16. Field Study and Numerical Simulation of Sub Slab Ventilation Systems

    SciTech Connect

    Bonnefous, Y.C.; Gadgil, A.J.; Fisk, W.J.; Prill, R.J.; Nematollahi, A.R.

    1992-05-01

    The effectiveness of the technique of subslab ventilation (SSV) for limiting radon entry into basements was investigated through complementary experimentation and numerical modeling. Subslab pressure fields resulting from SSV were measured in six well-characterized basements, each with a different combination of soil and aggregate permeability. The relationship between air velocity and pressure gradient was measured in the laboratory for the three types of aggregate installed beneath the basement slabs. A new numerical model of SSV was developed and verified with the field data. This model simulates non-Darcy flow in the aggregate. We demonstrate that non-Darcy effects significantly impact SSV performance. Field data and numerical simulations indicate that increasing the aggregate permeability within the investigated range of 2 x 10{sup -8} m{sup 2} to 3 x 10{sup -7} m{sup 2} substantially improves the extension of the subslab pressure field due to SSV operation. Sealing of cracks in the slab and excavation of a small pit where the SSV pipe penetrates the slab also dramatically improve this pressure field extension. Our findings are consistent with the results of prior field studies; however, the studies reported here have improved our understanding of factors affecting SSV performance. The dependence of SSV performance on the relevant parameters are currently under investigation with the model.

  17. Numerical study of cluster formation in binary charged colloids

    NASA Astrophysics Data System (ADS)

    Okuzono, Tohru; Odai, Kana; Masuda, Tatsuhiro; Toyotama, Akiko; Yamanaka, Junpei

    2016-07-01

    Cluster formation of oppositely charged colloidal particles is studied numerically. A simple Brownian dynamics method with a screened-Coulomb (Yukawa) potential is employed for numerical simulations. An equilibrium phase which consists of clusters and unassociated particles is obtained. It is shown that the equilibrium association number of clusters and their shapes are determined by charge numbers and charge ratio of the binary particles. The phase diagram of cluster formation for various charge numbers and their ratios is obtained. A simple relation between the association number and the charge ratio is found. It is demonstrated that in the case of high charge ratio the cluster takes a multilayer structure which is highly symmetric. It is also pointed out that the cluster-particle interaction changes dynamically in the cluster formation process, which is involved in the selection of final cluster structure.

  18. Numerical and experimental study of rotating jet flows

    NASA Astrophysics Data System (ADS)

    Shin, Seungwon; Che, Zhizhao; Kahouadji, Lyes; Matar, Omar; Chergui, Jalel; Juric, Damir

    2015-11-01

    Rotating jets are investigated through experimental measurements and numerical simulations. The experiments are performed on a rotating jet rig and the effects of a range of parameters controlling the liquid jet are investigated, e.g. jet flow rate, rotation speed, jet diameter, etc. Different regimes of the jet morphology are identified, and the dependence on several dimensionless numbers is studied, e.g. Reynolds number, Weber number, etc. The breakup process of droplets is visualized through high speed imaging. Full three-dimensional direct numerical simulations are performed using BLUE, a massively parallel two-phase flow code. The novel interface algorithms in BLUE track the gas-liquid interface through a wide dynamic range including ligament formation, break up and rupture. EPSRC Programme Grant, MEMPHIS, EP/K0039761/1.

  19. Numerical Relativity as a tool for studying the Early Universe

    NASA Astrophysics Data System (ADS)

    Garrison, David

    2013-04-01

    Numerical simulations are becoming a more effective tool for conducting detailed investigations into the evolution of our universe. In this presentation, I show how the framework of numerical relativity can be used for studying cosmological models. We are working to develop a large-scale simulation of the dynamical processes in the early universe. These take into account interactions of dark matter, scalar perturbations, gravitational waves, magnetic fields and a turbulent plasma. The code described in this report is a GRMHD code based on the Cactus framework and is structured to utilize one of several different differencing methods chosen at run-time. It is being developed and tested on the Texas Learning and Computation Center's Xanadu cluster.

  20. Numerical study on tsunami hazard mitigation using a submerged breakwater.

    PubMed

    Ha, Taemin; Yoo, Jeseon; Han, Sejong; Cho, Yong-Sik

    2014-01-01

    Most coastal structures have been built in surf zones to protect coastal areas. In general, the transformation of waves in the surf zone is quite complicated and numerous hazards to coastal communities may be associated with such phenomena. Therefore, the behavior of waves in the surf zone should be carefully analyzed and predicted. Furthermore, an accurate analysis of deformed waves around coastal structures is directly related to the construction of economically sound and safe coastal structures because wave height plays an important role in determining the weight and shape of a levee body or armoring material. In this study, a numerical model using a large eddy simulation is employed to predict the runup heights of nonlinear waves that passed a submerged structure in the surf zone. Reduced runup heights are also predicted, and their characteristics in terms of wave reflection, transmission, and dissipation coefficients are investigated. PMID:25215334

  1. Numerical study of cluster formation in binary charged colloids.

    PubMed

    Okuzono, Tohru; Odai, Kana; Masuda, Tatsuhiro; Toyotama, Akiko; Yamanaka, Junpei

    2016-07-01

    Cluster formation of oppositely charged colloidal particles is studied numerically. A simple Brownian dynamics method with a screened-Coulomb (Yukawa) potential is employed for numerical simulations. An equilibrium phase which consists of clusters and unassociated particles is obtained. It is shown that the equilibrium association number of clusters and their shapes are determined by charge numbers and charge ratio of the binary particles. The phase diagram of cluster formation for various charge numbers and their ratios is obtained. A simple relation between the association number and the charge ratio is found. It is demonstrated that in the case of high charge ratio the cluster takes a multilayer structure which is highly symmetric. It is also pointed out that the cluster-particle interaction changes dynamically in the cluster formation process, which is involved in the selection of final cluster structure. PMID:27575181

  2. Numerical study of librationally driven Flow in planetary interiors

    NASA Astrophysics Data System (ADS)

    Laguerre, Raphael; Karatekin, Ozgur; Noir, Jérôme

    2010-05-01

    Forced librations are observed for many planetary bodies. In the case of interior fluid layers, i.e. liquid cores or subsurface oceans, the resulting librational response could be different compared to that of a solid body. The coupling between the fluid layer and mantle depends strongly on the interior properties of the planet. Here we study numerically the properties of a librationally driven flow by taking into account both longitudinal and latitudinal forcing. The numerical method is based on an finite element approximation in meridian planes and a Fourier decomposition of the variables in the azimuthal direction (SFEMANS, Spectral Finite Element for Maxwell and Navier Stokes ). This allows us to specify the direction of rotation vector arbitrarily. In the case of longitudinal forcing we compare our solutions to the experimental results of Noir et al. 2009 obtained for cores with spherical shape. For latitudinal librations, we consider also the influence of ellipticity.

  3. An analytical and numerical study of axisymmetric flow around spheroids

    NASA Astrophysics Data System (ADS)

    Chang, Chien-Cheng; Liou, Biing-Horng; Chern, Ruey-Ling

    1992-01-01

    Axisymmetric viscous flow around ellipsoids of circular section is examined in detail using a matched asymptotic analysis and a deterministic hybrid vortex method. The hybrid vortex method solves the viscous vorticity equation by combining a finite-difference method for diffusion and a vortex-in-cell method for convection and stretching. The numerical study was carried out for an ellipsoid of axis ratio 2:1 and the limiting case of a sphere at Reynolds numbers between 100 and 3000. Particular attention is given to evaluation of the drag coefficient using three different approaches. Numerical and asymptotic results at small times are found to be in good agreement. Separation angles, wake lengths, and stationary drag coefficients for the sphere are also in good agreement with previous results obtained by a finite-difference method and with the standard drag curve.

  4. Numerical Study on Tsunami Hazard Mitigation Using a Submerged Breakwater

    PubMed Central

    Yoo, Jeseon; Han, Sejong; Cho, Yong-Sik

    2014-01-01

    Most coastal structures have been built in surf zones to protect coastal areas. In general, the transformation of waves in the surf zone is quite complicated and numerous hazards to coastal communities may be associated with such phenomena. Therefore, the behavior of waves in the surf zone should be carefully analyzed and predicted. Furthermore, an accurate analysis of deformed waves around coastal structures is directly related to the construction of economically sound and safe coastal structures because wave height plays an important role in determining the weight and shape of a levee body or armoring material. In this study, a numerical model using a large eddy simulation is employed to predict the runup heights of nonlinear waves that passed a submerged structure in the surf zone. Reduced runup heights are also predicted, and their characteristics in terms of wave reflection, transmission, and dissipation coefficients are investigated. PMID:25215334

  5. Feasibility of vibro-acoustography with a quasi-2D ultrasound array transducer for detection and localizing of permanent prostate brachytherapy seeds: A pilot ex vivo study

    SciTech Connect

    Mehrmohammadi, Mohammad; Kinnick, Randall R.; Fatemi, Mostafa; Alizad, Azra; Davis, Brian J.

    2014-09-15

    Purpose: Effective permanent prostate brachytherapy (PPB) requires precise placement of radioactive seeds in and around the prostate. The impetus for this research is to examine a new ultrasound-based imaging modality, vibro-acoustography (VA), which may serve to provide a high rate of PPB seed detection while also effecting enhanced prostate imaging. The authors investigate the ability of VA, implemented on a clinical ultrasound (US) scanner and equipped with a quasi-2D (Q2D) array US transducer, to detect and localize PPB seeds in excised prostate specimens. Methods: Nonradioactive brachytherapy seeds were implanted into four excised cadaver prostates. A clinical US scanner equipped with a Q2D array US transducer was customized to acquire both US and C-scan VA images at various depths. The VA images were then used to detect and localize the implanted seeds in prostate tissue. To validate the VA results, computed tomography (CT) images of the same tissue samples were obtained to serve as the reference by which to evaluate the performance of VA in PPB seed detection. Results: The results indicate that VA is capable of accurately identifying the presence and distribution of PPB seeds with a high imaging contrast. Moreover, a large ratio of the PPB seeds implanted into prostate tissue samples could be detected through acquired VA images. Using CT-based seed identification as the standard, VA was capable of detecting 74%–92% of the implanted seeds. Additionally, the angular independency of VA in detecting PPB seeds was demonstrated through a well-controlled phantom experiment. Conclusions: Q2DVA detected a substantial portion of the seeds by using a 2D array US transducer in excised prostate tissue specimens. While VA has inherent advantages associated with conventional US imaging, it has the additional advantage of permitting detection of PPB seeds independent of their orientation. These results suggest the potential of VA as a method for PPB imaging that

  6. 13C and 15N—Chemical Shift Anisotropy of Ampicillin and Penicillin-V Studied by 2D-PASS and CP/MAS NMR

    NASA Astrophysics Data System (ADS)

    Antzutkin, Oleg N.; Lee, Young K.; Levitt, Malcolm H.

    1998-11-01

    The principal values of the chemical shift tensors of all13C and15N sites in two antibiotics, ampicillin and penicillin-V, were determined by 2-dimensionalphaseadjustedspinningsideband (2D-PASS) and conventional CP/MAS experiments. The13C and15N chemical shift anisotropies (CSA), and their confidence limits, were evaluated using a Mathematica program. The CSA values suggest a revised assignment of the 2-methyl13C sites in the case of ampicillin. We speculate on a relationship between the chemical shift principal values of many of the13C and15N sites and the β-lactam ring conformation.

  7. Feasibility of vibro-acoustography with a quasi-2D ultrasound array transducer for detection and localizing of permanent prostate brachytherapy seeds: A pilot ex vivo study

    PubMed Central

    Mehrmohammadi, Mohammad; Alizad, Azra; Kinnick, Randall R.; Davis, Brian J.; Fatemi, Mostafa

    2014-01-01

    Purpose: Effective permanent prostate brachytherapy (PPB) requires precise placement of radioactive seeds in and around the prostate. The impetus for this research is to examine a new ultrasound-based imaging modality, vibro-acoustography (VA), which may serve to provide a high rate of PPB seed detection while also effecting enhanced prostate imaging. The authors investigate the ability of VA, implemented on a clinical ultrasound (US) scanner and equipped with a quasi-2D (Q2D) array US transducer, to detect and localize PPB seeds in excised prostate specimens. Methods: Nonradioactive brachytherapy seeds were implanted into four excised cadaver prostates. A clinical US scanner equipped with a Q2D array US transducer was customized to acquire both US and C-scan VA images at various depths. The VA images were then used to detect and localize the implanted seeds in prostate tissue. To validate the VA results, computed tomography (CT) images of the same tissue samples were obtained to serve as the reference by which to evaluate the performance of VA in PPB seed detection. Results: The results indicate that VA is capable of accurately identifying the presence and distribution of PPB seeds with a high imaging contrast. Moreover, a large ratio of the PPB seeds implanted into prostate tissue samples could be detected through acquired VA images. Using CT-based seed identification as the standard, VA was capable of detecting 74%–92% of the implanted seeds. Additionally, the angular independency of VA in detecting PPB seeds was demonstrated through a well-controlled phantom experiment. Conclusions: Q2DVA detected a substantial portion of the seeds by using a 2D array US transducer in excised prostate tissue specimens. While VA has inherent advantages associated with conventional US imaging, it has the additional advantage of permitting detection of PPB seeds independent of their orientation. These results suggest the potential of VA as a method for PPB imaging that

  8. Study of plasma equilibrium in toroidal fusion devices using mesh-free numerical calculation method

    NASA Astrophysics Data System (ADS)

    Rasouli, C.; Abbasi Davani, F.; Rokrok, B.

    2016-08-01

    Plasma confinement using external magnetic field is one of the successful ways leading to the controlled nuclear fusion. Development and validation of the solution process for plasma equilibrium in the experimental toroidal fusion devices is the main subject of this work. Solution of the nonlinear 2D stationary problem as posed by the Grad-Shafranov equation gives quantitative information about plasma equilibrium inside the vacuum chamber of hot fusion devices. This study suggests solving plasma equilibrium equation which is essential in toroidal nuclear fusion devices, using a mesh-free method in a condition that the plasma boundary is unknown. The Grad-Shafranov equation has been solved numerically by the point interpolation collocation mesh-free method. Important features of this approach include truly mesh free, simple mathematical relationships between points and acceptable precision in comparison with the parametric results. The calculation process has been done by using the regular and irregular nodal distribution and support domains with different points. The relative error between numerical and analytical solution is discussed for several test examples such as small size Damavand tokamak, ITER-like equilibrium, NSTX-like equilibrium, and typical Spheromak.

  9. Nanoimprint lithography: 2D or not 2D? A review

    NASA Astrophysics Data System (ADS)

    Schift, Helmut

    2015-11-01

    Nanoimprint lithography (NIL) is more than a planar high-end technology for the patterning of wafer-like substrates. It is essentially a 3D process, because it replicates various stamp topographies by 3D displacement of material and takes advantage of the bending of stamps while the mold cavities are filled. But at the same time, it keeps all assets of a 2D technique being able to pattern thin masking layers like in photon- and electron-based traditional lithography. This review reports about 20 years of development of replication techniques at Paul Scherrer Institut, with a focus on 3D aspects of molding, which enable NIL to stay 2D, but at the same time enable 3D applications which are "more than Moore." As an example, the manufacturing of a demonstrator for backlighting applications based on thermally activated selective topography equilibration will be presented. This technique allows generating almost arbitrary sloped, convex and concave profiles in the same polymer film with dimensions in micro- and nanometer scale.

  10. Feasibility study for a numerical aerodynamic simulation facility: Summary

    NASA Technical Reports Server (NTRS)

    Lincoln, N. R.

    1979-01-01

    The Ames Research Center of NASA is engaged in the development and investigation of numerical methods and computer technologies to be employed in conjunction with physical experiments, particularly utilizing wind tunnels in the furtherance of the field of aircraft and aerodynamic body design. Several studies, aimed primarily at the areas of development and production of extremely high-speed computing facilities, were conducted. The studies focused on evaluating the aspects of feasibility, reliability, costs, and practicability of designing, constructing, and bringing into effect production of a special-purpose system. An executive summary of the activities for this project is presented in this volume.

  11. Numerical studies of transverse curvature effects on transonic flow stability

    NASA Technical Reports Server (NTRS)

    Macaraeg, M. G.; Daudpota, Q. I.

    1992-01-01

    A numerical study of transverse curvature effects on compressible flow temporal stability for transonic to low supersonic Mach numbers is presented for axisymmetric modes. The mean flows studied include a similar boundary-layer profile and a nonsimilar axisymmetric boundary-layer solution. The effect of neglecting curvature in the mean flow produces only small quantitative changes in the disturbance growth rate. For transonic Mach numbers (1-1.4) and aerodynamically relevant Reynolds numbers (5000-10,000 based on displacement thickness), the maximum growth rate is found to increase with curvature - the maximum occurring at a nondimensional radius (based on displacement thickness) between 30 and 100.

  12. Numerical study of transient flow phenomena in shock tunnels

    NASA Technical Reports Server (NTRS)

    Tokarcik-Polsky, Susan; Cambier, Jean-Luc

    1994-01-01

    Computational fluid dynamics (CFD) was used to study some transient flow features that can occur during the startup process of a shoch tunnel. The investigation concentrated on two areas: (1) the flow near the endwall of the driven tube during shock reflection and (2) the transient flow in the nozzle. The driven tube calculations were inviscid and focused on the study of a vortex system that was seen to form at the driven tube's axis of symmetry. The nozzle flow calculations examined viscous and inviscid effects during nozzle startup. The CFD solutions of the nozzle flows were compared with experimental data to demonstrate the effectiveness of the numerical analysis.

  13. 2D bifurcations and Newtonian properties of memristive Chua's circuits

    NASA Astrophysics Data System (ADS)

    Marszalek, W.; Podhaisky, H.

    2016-01-01

    Two interesting properties of Chua's circuits are presented. First, two-parameter bifurcation diagrams of Chua's oscillatory circuits with memristors are presented. To obtain various 2D bifurcation images a substantial numerical effort, possibly with parallel computations, is needed. The numerical algorithm is described first and its numerical code for 2D bifurcation image creation is available for free downloading. Several color 2D images and the corresponding 1D greyscale bifurcation diagrams are included. Secondly, Chua's circuits are linked to Newton's law φ ''= F(t,φ,φ')/m with φ=\\text{flux} , constant m > 0, and the force term F(t,φ,φ') containing memory terms. Finally, the jounce scalar equations for Chua's circuits are also discussed.

  14. Numerical study of forced convective heat transfer around airships

    NASA Astrophysics Data System (ADS)

    Dai, Qiumin; Fang, Xiande

    2016-02-01

    Forced convective heat transfer is an important factor that affects the thermal characteristics of airships. In this paper, the steady state forced convective heat transfer around an ellipsoid is numerically investigated. The numerical simulation is carried out by commercial computational fluid dynamic (CFD) software over the extended Re range from 20 to 108 and the aspect ratio from 2 to 4. Based on the regression and optimization with software, a new piecewise correlation of the Nusselt number at constant wall temperature for ellipsoid is proposed, which is suitable for applications to airships and other ellipse shaped bodies such as elliptical balloons. The thermal characteristics of a stratospheric airship in midsummer located in the north hemisphere are numerical studied. The helium temperature predicated using the new correlation is compared to those predicted by correlations applicable for spheres and flat plates. The results show that the helium temperature obtained using the new correlation at noon is about 5.4 K lower than that using the correlation of spheres and about 2.1 K higher than that of flat plates.

  15. Theoretical and Experimental Study of a Numerical Aperture for Multimode PCS Fiber Optics Using an Imaging Technique

    NASA Astrophysics Data System (ADS)

    Saman, Q. Mawlud; Nahlah, Q. Muhamad

    2012-11-01

    We study theoretically and experimentally the properties of numerical aperture (NA) of multimode graded-index plastic core silica (PCS) fibers by using an image technique. A He-Ne laser at wavelength 632.8 nm and output power 1 mW is used as the transmitter light source. The output beam images and intensity profiles of an optical fiber are investigated by using an imaging technique. The laser beam profiles captured by a sensitive digital Nikon camera are processed and analyzed by using a Gaussian intensity distribution in a 2D graph. A MathCAD 14 program is used for converting the image of the laser output beam into data. The theoretical and experimental values of the numerical aperture for the used optical fiber in this study are found to be 0.5 and 0.4924, respectively. The theoretical value of V-number is also calculated to be approximately 2482.

  16. Hydraulic fracturing: insights from field, lab, and numerical studies

    NASA Astrophysics Data System (ADS)

    Walsh, S. D.; Johnson, S.; Fu, P.; Settgast, R. R.

    2011-12-01

    Hydraulic fracturing has become an increasingly important technique in stimulating reservoirs for gas, oil, and geothermal energy production. In use commercially since the 1950's, the technique has been widely lauded, when combined with other techniques, for enabling the development of shale gas resources in the United States, providing a valuable and extensive source of domestic energy. However, the technique has also drawn a degree of notoriety from high-profile incidents involving contamination of drinking water associated with gas extraction operations in the Marcellus shale region. This work highlights some of the insights on the behavior of subsurface hydraulic fracturing operations that have been derived from field and laboratory observations as well as from numerical simulations. The sensitivity of fracture extent and orientation to parameters such as matrix material heterogeneity, presence and distribution of discontinuities, and stress orientation is of particular interest, and we discuss this in the context of knowledge derived from both observation and simulation. The limitations of these studies will also be addressed in terms of resolution, uncertainty, and assumptions as well as the balance of fidelity to cost, both in computation time (for numerical studies) and equipment / operation cost (for observational studies). We also identify a number of current knowledge gaps and propose alternatives for addressing those gaps. We especially focus on the role of numerical studies for elucidating key concepts and system sensitivities. The problem is inherently multi-scale in both space and time as well as highly coupled hydromechanically, and, in several applications, thermally as well. We will summarize the developments to date in analyzing these systems and present an approach for advancing the capabilities of our models in the short- to long-term and how these advances can help provide solutions to reduce risk and improve efficiency of hydraulic fracturing

  17. Differential CYP 2D6 Metabolism Alters Primaquine Pharmacokinetics

    PubMed Central

    Potter, Brittney M. J.; Xie, Lisa H.; Vuong, Chau; Zhang, Jing; Zhang, Ping; Duan, Dehui; Luong, Thu-Lan T.; Bandara Herath, H. M. T.; Dhammika Nanayakkara, N. P.; Tekwani, Babu L.; Walker, Larry A.; Nolan, Christina K.; Sciotti, Richard J.; Zottig, Victor E.; Smith, Philip L.; Paris, Robert M.; Read, Lisa T.; Li, Qigui; Pybus, Brandon S.; Sousa, Jason C.; Reichard, Gregory A.

    2015-01-01

    Primaquine (PQ) metabolism by the cytochrome P450 (CYP) 2D family of enzymes is required for antimalarial activity in both humans (2D6) and mice (2D). Human CYP 2D6 is highly polymorphic, and decreased CYP 2D6 enzyme activity has been linked to decreased PQ antimalarial activity. Despite the importance of CYP 2D metabolism in PQ efficacy, the exact role that these enzymes play in PQ metabolism and pharmacokinetics has not been extensively studied in vivo. In this study, a series of PQ pharmacokinetic experiments were conducted in mice with differential CYP 2D metabolism characteristics, including wild-type (WT), CYP 2D knockout (KO), and humanized CYP 2D6 (KO/knock-in [KO/KI]) mice. Plasma and liver pharmacokinetic profiles from a single PQ dose (20 mg/kg of body weight) differed significantly among the strains for PQ and carboxy-PQ. Additionally, due to the suspected role of phenolic metabolites in PQ efficacy, these were probed using reference standards. Levels of phenolic metabolites were highest in mice capable of metabolizing CYP 2D6 substrates (WT and KO/KI 2D6 mice). PQ phenolic metabolites were present in different quantities in the two strains, illustrating species-specific differences in PQ metabolism between the human and mouse enzymes. Taking the data together, this report furthers understanding of PQ pharmacokinetics in the context of differential CYP 2D metabolism and has important implications for PQ administration in humans with different levels of CYP 2D6 enzyme activity. PMID:25645856

  18. Numerical study of the Azov Sea level seiche oscillations

    NASA Astrophysics Data System (ADS)

    Matishov, G. G.; Inzhebeikin, Yu. I.

    2009-08-01

    Seiche oscillations of the Azov Sea level are studied on the basis of the developed two-dimensional numerical hydrodynamic model grounded on the shallow water theory and recent data on the morphometric characteristics of the Sea of Azov. Frequency and spatial characteristics of the first five modes corresponding to seiche oscillations of the Azov Sea level are computed. It is shown that the frequency and spatial characteristics of the first five modes obtained for the Sea of Azov level changes correspond to seiche oscillations. The calculated parameters are compared with the field observations, which show their realistic character.

  19. The shape of a growing crystal: a numerical study

    NASA Astrophysics Data System (ADS)

    Rakin, V. I.

    1995-10-01

    A numerical model of the "crystal-solution" system based on experimental data on K-alum sulphate was proposed. The development of the crystal shape under different physical and chemical growth conditions was studied. A correlation between crystal shape and supersaturation during crystal growth was not observed. We introduced the idea of a "steady shape" of the crystal. The correlation between the shape and the growth conditions was measured. A parameter indicating the dynamic equilibrium of the growth system was introduced. The crystal growth process can be optimised using the proposed model.

  20. A numerical and experimental study of confined swirling jets

    NASA Technical Reports Server (NTRS)

    Nikjooy, M.; Mongia, H. C.; Samuelsen, G. S.; Mcdonell, V. G.

    1989-01-01

    A numerical and experimental study of a confined strong swirling flow is presented. Detailed velocity measurements are made using a two-component laser Doppler velocimeter (LDV) technique. Computations are performed using a differential second-moment (DSM) closure. The effect of inlet dissipation rate on calculated mean and turbulence fields is investigated. Various model constants are employed in the pressure-strain model to demonstrate their influences on the predicted results. Finally, comparison of the DSM calculations with the algebraic second-monent (ASM) closure results shows that the DSM is better suited for complex swirling flow analysis.

  1. Dispersion of helically corrugated waveguides: analytical, numerical, and experimental study.

    PubMed

    Burt, G; Samsonov, S V; Ronald, K; Denisov, G G; Young, A R; Bratman, V L; Phelps, A D R; Cross, A W; Konoplev, I V; He, W; Thomson, J; Whyte, C G

    2004-10-01

    Helically corrugated waveguides have recently been studied for use in various applications such as interaction regions in gyrotron traveling-wave tubes and gyrotron backward-wave oscillators and as a dispersive medium for passive microwave pulse compression. The paper presents a summary of various methods that can be used for analysis of the wave dispersion of such waveguides. The results obtained from an analytical approach, simulations with the three-dimensional numerical code MAGIC, and cold microwave measurements are analyzed and compared. PMID:15600525

  2. Binding of 7-methoxy-4-(aminomethyl)-coumarin to wild-type and W128F mutant cytochrome P450 2D6 studied by time-resolved fluorescence spectroscopy

    PubMed Central

    Stortelder, Aike; Keizers, Peter H. J.; Oostenbrink, Chris; De Graaf, Chris; De Kruijf, Petra; Vermeulen, Nico P. E.; Gooijer, Cees; Commandeur, Jan N. M.; Van Der Zwan, Gert

    2005-01-01

    Enzyme structure and dynamics may play a main role in substrate binding and the subsequent steps in the CYP (cytochrome P450) catalytic cycle. In the present study, changes in the structure of human CYP2D6 upon binding of the substrate are studied using steady-state and time-resolved fluorescence methods, focusing not only on the emission of the tryptophan residues, but also on emission of the substrate. As a substrate, MAMC [7-methoxy-4-(aminomethyl)-coumarin] was selected, a compound exhibiting native fluorescence. As well as the wild-type, the W128F (Trp128→Phe) mutant of CYP2D6 was studied. After binding, a variety of energy transfer possibilities exist, and molecular dynamics simulations were performed to calculate distances and relative orientations of donors and acceptors. Energy transfer from Trp128 to haem appeared to be important; its emission was related to the shortest of the three average tryptophan fluorescence lifetimes observed for CYP2D6. MAMC to haem energy transfer was very efficient as well: when bound in the active site, the emission of MAMC was fully quenched. Steady-state anisotropy revealed that besides the MAMC in the active site, another 2.4% of MAMC was bound outside of the active site to wild-type CYP2D6. The tryptophan residues in CYP2D6 appeared to be less accessible for the external quenchers iodide and acrylamide in presence of MAMC, indicating a tightening of the enzyme structure upon substrate binding. However, the changes in the overall enzyme structure were not very large, since the emission characteristics of the enzyme were not very different in the presence of MAMC. PMID:16190863

  3. High-resolution infrared study of AsH 2D: The stretching fundamental bands ν1/ ν5 and ν2

    NASA Astrophysics Data System (ADS)

    Ulenikov, O. N.; Bekhtereva, E. S.; Yukhnik, Yu. B.; Vershinina, O. G.; Jerzembeck, W.; Bürger, H.

    2008-11-01

    High-resolution (ca. 0.0025 cm -1) Fourier transform infrared spectra of AsH 2D were recorded in the regions of the As-H and As-D stretching fundamental bands ν1/ ν5 and ν2, respectively, and analyzed. Strong resonance interactions between the bands ν1 and ν5, and also between the band ν2 and the bending overtone band 2 ν4 were established. From transitions observed in the ν1 and ν5 bands ground state rotational energies for larger values of rotational quantum numbers than previously available could be determined. Thereof improved ground state rotational parameters were derived. More than 3200 assigned transitions corresponding to 1059 upper state energy levels which were almost equally distributed over the three stretching states were fitted with an rms-deviation of 0.00031 cm -1, which corresponds to experimental precision.

  4. Reaction of O2(+)(X 2Pi sub g) with H2, D2, and HD - Guided ion beam studies, MO correlations, and statistical theory calculations

    NASA Technical Reports Server (NTRS)

    Weber, M. E.; Dalleska, N. F.; Tjelta, B. L.; Fisher, E. R.; Armentrout, P. B.

    1993-01-01

    Guided ion-beam mass spectrometry is used to examined the reactions of vibrationally cold ground-state O2(+)(X 2Pi sub g) with H2, D2, and HD. The energy dependence of the absolute integral cross sections from thermal energy to over 4 eV are measured in the center-of-mass frame of reference. Results are also presented for internally excited O2(+) ions reacting with D2 and HD. The results are consistent with the dominant state being the a 4Pi sub u electronic state. The experimental excitation functions are analyzed in detail and interpreted by extending the molecular orbital correlation arguments of Mahan (1971) and by comparison with results of statistical phase space theory and with a theory that predicts a tight transition state.

  5. The antibacterial activity of some sulfonamides and sulfonyl hydrazones, and 2D-QSAR study of a series of sulfonyl hydrazones

    NASA Astrophysics Data System (ADS)

    Aslan, H. Güzin; Özcan, Servet; Karacan, Nurcan

    2012-12-01

    Benzenesulfonicacid-1-methylhydrazide (1) and its four aromatic sulfonyl hydrazone derivatives (1a-1d), N-(3-amino-2-hydroxypropyl)benzene sulfonamide (2) and N-(2-hydroxyethyl)benzenesulfonamide (3) were synthesized and their structures were determined by IR, 1H NMR, 13C NMR, and LCMS techniques. Antibacterial activities of new synthesized compounds were evaluated against various bacteria strains by microdilution and disk diffusion methods. The experimental results show that presence of OH group on sulfonamides reduces the antimicrobial activity, and antimicrobial activities of the sulfonyl hydrazones (1a-1d) are smaller than that of the parent sulfonamide (1), except Candida albicans. In addition, 2D-QSAR analysis was performed on 28 aromatic sulfonyl hydrazones as antimicrobial agents against Escherichia coli and Staphylococcus aureus. In the QSAR models, the most important descriptor is total point-charge component of the molecular dipole for E. coli, and partial negative surface area (PNSA-1) for S. aureus.

  6. An experimental and theoretical study on the kinetic isotope effect of C2H6 and C2D6 reaction with OH

    NASA Astrophysics Data System (ADS)

    Khaled, Fethi; Giri, Binod Raj; Szőri, Milán; Viskolcz, Béla; Farooq, Aamir

    2015-11-01

    We report experimental and theoretical results for the deuterated kinetic isotope effect (DKIE) of the reaction of OH with ethane (C2H6) and deuterated ethane (C2D6). The reactions were investigated behind reflected shock waves over 800-1350 K by monitoring OH radicals near 306.69 nm using laser absorption. In addition, high level CCSD(T)/cc-pV(T,Q)Z//MP2/cc-pVTZ quantum chemical and statistical rate theory calculations were performed which agreed very well with the experimental findings. The results reported herein provide the first experimental evidence that DKIE asymptotes to a value of 1.4 at high temperatures.

  7. Guided ion beam and theoretical study of the reactions of Hf{sup +} with H{sub 2}, D{sub 2}, and HD

    SciTech Connect

    Hinton, Christopher S.; Armentrout, P. B.

    2010-09-28

    The kinetic energy dependences of reactions of the third-row transition metal cation Hf{sup +} with H{sub 2}, D{sub 2}, and HD were determined using a guided ion beam tandem mass spectrometer. A flow tube ion source produces Hf{sup +} in its {sup 2}D (6s{sup 2}5d{sup 1}) electronic ground state level. Corresponding state-specific reaction cross sections are obtained. The kinetic energy dependences of the cross sections for the endothermic formation of HfH{sup +} and HfD{sup +} are analyzed to give a 0 K bond dissociation energy of D{sub 0}(Hf{sup +}-H)=2.11{+-}0.08 eV. Quantum chemical calculations at several levels of theory performed here generally overestimate the experimental bond energy but results obtained using the Becke-half-and-half-LYP functional show good agreement. Theory also provides the electronic structures of these species and the reactive potential energy surfaces. Results from the reactions with HD provide insight into the reaction mechanisms and indicates that Hf{sup +} reacts via a statistical mechanism. We also compare this third-row transition metal system with the first-row and second-row congeners, Ti{sup +} and Zr{sup +}, and find that Hf{sup +} has a weaker M{sup +}-H bond. As most third-row transition metal hydride cation bonds exceed their lighter congeners, this trend is unusual but can be understood using promotion energy arguments.

  8. Numerical modelling of fluid-rock interactions: Lessons learnt from carbonate rocks diagenesis studies

    NASA Astrophysics Data System (ADS)

    Nader, Fadi; Bachaud, Pierre; Michel, Anthony

    2015-04-01

    Quantitative assessment of fluid-rock interactions and their impact on carbonate host-rocks has recently become a very attractive research topic within academic and industrial realms. Today, a common operational workflow that aims at predicting the relevant diagenetic processes on the host rocks (i.e. fluid-rock interactions) consists of three main stages: i) constructing a conceptual diagenesis model including inferred preferential fluids pathways; ii) quantifying the resulted diagenetic phases (e.g. depositing cements, dissolved and recrystallized minerals); and iii) numerical modelling of diagenetic processes. Most of the concepts of diagenetic processes operate at the larger, basin-scale, however, the description of the diagenetic phases (products of such processes) and their association with the overall petrophysical evolution of sedimentary rocks remain at reservoir (and even outcrop/ well core) scale. Conceptual models of diagenetic processes are thereafter constructed based on studying surface-exposed rocks and well cores (e.g. petrography, geochemistry, fluid inclusions). We are able to quantify the diagenetic products with various evolving techniques and on varying scales (e.g. point-counting, 2D and 3D image analysis, XRD, micro-CT and pore network models). Geochemical modelling makes use of thermodynamic and kinetic rules as well as data-bases to simulate chemical reactions and fluid-rock interactions. This can be through a 0D model, whereby a certain process is tested (e.g. the likelihood of a certain chemical reaction to operate under specific conditions). Results relate to the fluids and mineral phases involved in the chemical reactions. They could be used as arguments to support or refute proposed outcomes of fluid-rock interactions. Coupling geochemical modelling with transport (reactive transport model; 1D, 2D and 3D) is another possibility, attractive as it provides forward simulations of diagenetic processes and resulting phases. This

  9. Numerical Study of Low Emission Gas Turbine Combustor Concepts

    NASA Technical Reports Server (NTRS)

    Yang, Song-Lin

    2002-01-01

    To further reduce pollutant emissions, such as CO, NO(x), UHCs, etc., in the next few decades, innovative concepts of gas turbine combustors must be developed. Several concepts, such as the LIPP (Lean- Premixed- Prevaporized), RQL (Rich-Burn Quick-Quench Lean-Burn), and LDI (Lean-Direct-Injection), have been under study for many years. To fully realize the potential of these concepts, several improvements, such as inlet geometry, air swirler, aerothermochemistry control, fuel preparation, fuel injection and injector design, etc., must be made, which can be studied through the experimental method and/or the numerical technique. The purpose of this proposal is to use the CFD technique to study, and hence, to guide the design process for low emission gas turbine combustors. A total of 13 technical papers have been (or will be) published.

  10. Options of applying of numerical codes for the study of transient processes in a binary star with a white dwarf

    NASA Astrophysics Data System (ADS)

    Boneva, Daniela; Kononov, Dmitry

    In this paper we present the idea of applying of numerical codes, particularly of the ZEUS, for the study of transient processes in the close binary stars during the interaction. As a transient processes they could be long- and short-lived and we take into consideration both of them in our survey, as we explained their behavior and connection with tidal influence in the binary configuration. Basic features of the code are revealed. Using the hydrodynamical possibilities of ZEUS 2D and applying our hydrodynamical system of examination, we show what kind of possible results we can derive. This solution gives the initial distribution of the wave after tidally flow of the matter through the contact point of the binary. It is compared to the results obtained with recently employed codes, the ability of working with ZEUS and other numerical codes capabilities to find out the most suitable code or their combination and to make the problem solvable.

  11. Numerical Simulation Study on the Hydraulic Behavior in Closed Fractures

    NASA Astrophysics Data System (ADS)

    Zhang, C.; Shu, L.; Wen, Z.; Wu, G.; Zhang, X.; Hu, B. X.

    2015-12-01

    As the main repositories for groundwater in karst systems, fractures involve the movement and storage of groundwater. Fundamentally, Navier-Stokes (NS) Equations is used to describe flow in fractures. However, due to the complexity of Navier-Stokes Equations, it is rarely applied to solve fracture flow problems. Thus, based on some simplifications, Stokes equations, Reynolds equations and Cubic Law (CL) are derived to describe fracture flow. The validity of the three simplified equations were extensively studies. Among the three simplified equations of NS, CL is the simplest and used to describe flow in open, smooth and paralleled fractures. In the previous work, most researchers focused on the open fractures. But it's the closed fractures exist widely in the field not the open fractures. The objective of this paper aims to check the validity of CL in closed fractures with different apertures and widths of fracture. After comparing the experimental results and simulations results from the COMSOL Multiphysics (FEM), this software was applied to solve the 3D or 2D NS equations in the closed fractures. The results obtained from NS simulation results and calculation results from CL were compared to indicate the degree of the validity of CL in application. A critical velocity was proposed to illustrate the validity of CL in closed fractures. Furthermore, the impacts of aperture size, width of fracture size, and velocity magnitude on both the hydraulic conductivity and velocity profile were also analyzed. The results showed the CL was capable of describing flow in closed fractures when the velocity was less than the critical velocity varying from 0.02 to 30.08cm/s. The ratio of NS results and CL results was between 0.9 and 2, with velocity varying from 0 to 40cm/s. The discrepancy between NS equation and CL increased with Reynolds number, increased with aperture size and decreased with width of fracture.

  12. Analytical and Numerical Studies of Several Fluid Mechanical Problems

    NASA Astrophysics Data System (ADS)

    Kong, D. L.

    2014-03-01

    In this thesis, three parts, each with several chapters, are respectively devoted to hydrostatic, viscous, and inertial fluids theories and applications. Involved topics include planetary, biological fluid systems, and high performance computing technology. In the hydrostatics part, the classical Maclaurin spheroids theory is generalized, for the first time, to a more realistic multi-layer model, establishing geometries of both the outer surface and the interfaces. For one of its astrophysical applications, the theory explicitly predicts physical shapes of surface and core-mantle-boundary for layered terrestrial planets, which enables the studies of some gravity problems, and the direct numerical simulations of dynamo flows in rotating planetary cores. As another application of the figure theory, the zonal flow in the deep atmosphere of Jupiter is investigated for a better understanding of the Jovian gravity field. An upper bound of gravity field distortions, especially in higher-order zonal gravitational coefficients, induced by deep zonal winds is estimated firstly. The oblate spheroidal shape of an undistorted Jupiter resulting from its fast solid body rotation is fully taken into account, which marks the most significant improvement from previous approximation based Jovian wind theories. High viscosity flows, for example Stokes flows, occur in a lot of processes involving low-speed motions in fluids. Microorganism swimming is such a typical case. A fully three dimensional analytic solution of incompressible Stokes equation is derived in the exterior domain of an arbitrarily translating and rotating prolate spheroid, which models a large family of microorganisms such as cocci bacteria. The solution is then applied to the magnetotactic bacteria swimming problem, and good consistency has been found between theoretical predictions and laboratory observations of the moving patterns of such bacteria under magnetic fields. In the analysis of dynamics of planetary

  13. Numerical Study of Pyrolysis of Biomass in Fluidized Beds

    NASA Technical Reports Server (NTRS)

    Bellan, Josette; Lathouwers, Danny

    2003-01-01

    A report presents a numerical-simulation study of pyrolysis of biomass in fluidized-bed reactors, performed by use of the mathematical model described in Model of Fluidized Bed Containing Reacting Solids and Gases (NPO-30163), which appears elsewhere in this issue of NASA Tech Briefs. The purpose of the study was to investigate the effect of various operating conditions on the efficiency of production of condensable tar from biomass. The numerical results indicate that for a fixed particle size, the fluidizing-gas temperature is the foremost parameter that affects the tar yield. For the range of fluidizing-gas temperatures investigated, and under the assumption that the pyrolysis rate exceeds the feed rate, the optimum steady-state tar collection was found to occur at 750 K. In cases in which the assumption was not valid, the optimum temperature for tar collection was found to be only slightly higher. Scaling up of the reactor was found to exert a small negative effect on tar collection at the optimal operating temperature. It is also found that slightly better scaling is obtained by use of shallower fluidized beds with greater fluidization velocities.

  14. Mechanical stability of propped hydraulic fractures: A numerical study

    SciTech Connect

    Asgian, M.I.; Cundall, P.A.; Brady, B.H.

    1995-03-01

    Proppant is sometimes produced along with hydrocarbons in hydraulically fractured petroleum wells. Sometimes 10% to 20% of the proppant is backproduced, which can lead to damaged equipment and downtime. Furthermore, proppant flowback can lead to a substantial loss of fracture conductivity. A numerical study was conducted to help understand what conditions are likely to lead to proppant flowback. In the simulations, the mechanical interaction of a larger number (several thousand) individual proppant grains was modeled with a distinct-element-type code. The numerical simulations show that hydraulic fractures propped with cohesionless, unbonded proppant fail under closure stress at a critical ratio of mean grain diameter to fracture width. This is consistent with published laboratory studies. The simulations identify the mechanism (arch failure) that triggers the mechanical instability and also show that the primary way that drawdowns (less than {approx} 75 psi/ft) affect proppant flowback is to transport loose proppant grains in front of the stable arch to the wellbore. Drawdowns > 75 psi/ft are sufficient to destabilize the arch and to cause progressive failure of the propped fractures.

  15. Numerical Study of Rotating Turbulence with External Forcing

    NASA Technical Reports Server (NTRS)

    Yeung, P. K.; Zhou, Ye

    1998-01-01

    Direct numerical simulation at 256(exp 3) resolution have been carried out to study the response of isotropic turbulence to the concurrent effects of solid-body rotation and numerical forcing at the large scales. Because energy transfer to the smaller scales is weakened by rotation, energy input from forcing gradually builds up at the large scales, causing the overall kinetic energy to increase. At intermediate wavenumbers the energy spectrum undergoes a transition from a limited k(exp -5/3) inertial range to k(exp -2) scaling recently predicted in the literature. Although the Reynolds stress tensor remains approximately isotropic and three-components, evidence for anisotropy and quasi- two-dimensionality in length scales and spectra in different velocity components and directions is strong. The small scales are found to deviate from local isotropy, primarily as a result of anisotropic transfer to the high wavenumbers. To understand the spectral dynamics of this flow we study the detailed behavior of nonlinear triadic interactions in wavenumber space. Spectral transfer in the velocity component parallel to the axis of rotation is qualitatively similar to that in non-rotating turbulence; however the perpendicular component is characterized by a greatly suppressed energy cascade at high wavenumber and a local reverse transfer at the largest scales. The broader implications of this work are briefly addressed.

  16. Experimental and numerical study of open-air active cooling

    NASA Astrophysics Data System (ADS)

    Al-Fifi, Salman Amsari

    The topic of my thesis is Experimental and Numerical Study of Open Air Active Cooling. The present research is intended to investigate experimentally and Numerically the effectiveness of cooling large open areas like stadiums, shopping malls, national gardens, amusement parks, zoos, transportation facilities and government facilities or even in buildings outdoor gardens and patios. Our cooling systems are simple cooling fans with different diameters and a mist system. This type of cooling systems has been chosen among the others to guarantee less energy consumption, which will make it the most favorable and applicable for cooling such places mentioned above. In the experiments, the main focus is to study the temperature domain as a function of different fan diameters aerodynamically similar in different heights till we come up with an empirical relationship that can determine the temperature domain for different fan diameters and for different heights of these fans. The experimental part has two stages. The first stage is devoted to investigate the maximum range of airspeed and profile for three different fan diameters and for different heights without mist, while the second stage is devoted to investigate the maximum range of temperature and profile for the three different diameter fans and for different heights with mist. The computational study is devoted to built an experimentally verified mathematical model to be used in the design and optimization of water mist cooling systems, and to compare the mathematical results to the experimental results and to get an insight of how to apply such evaporative mist cooling for different places for different conditions. In this study, numerical solution is presented based on experimental conditions, such dry bulb temperature, wet bulb temperature, relative humidity, operating pressure and fan airspeed. In the computational study, all experimental conditions are kept the same for the three fans except the fan airspeed

  17. Differential Cytochrome P450 2D Metabolism Alters Tafenoquine Pharmacokinetics

    PubMed Central

    Vuong, Chau; Xie, Lisa H.; Potter, Brittney M. J.; Zhang, Jing; Zhang, Ping; Duan, Dehui; Nolan, Christina K.; Sciotti, Richard J.; Zottig, Victor E.; Nanayakkara, N. P. Dhammika; Tekwani, Babu L.; Walker, Larry A.; Smith, Philip L.; Paris, Robert M.; Read, Lisa T.; Li, Qigui; Pybus, Brandon S.; Sousa, Jason C.; Reichard, Gregory A.; Smith, Bryan

    2015-01-01

    Cytochrome P450 (CYP) 2D metabolism is required for the liver-stage antimalarial efficacy of the 8-aminoquinoline molecule tafenoquine in mice. This could be problematic for Plasmodium vivax radical cure, as the human CYP 2D ortholog (2D6) is highly polymorphic. Diminished CYP 2D6 enzyme activity, as in the poor-metabolizer phenotype, could compromise radical curative efficacy in humans. Despite the importance of CYP 2D metabolism for tafenoquine liver-stage efficacy, the exact role that CYP 2D metabolism plays in the metabolism and pharmacokinetics of tafenoquine and other 8-aminoquinoline molecules has not been extensively studied. In this study, a series of tafenoquine pharmacokinetic experiments were conducted in mice with different CYP 2D metabolism statuses, including wild-type (WT) (reflecting extensive metabolizers for CYP 2D6 substrates) and CYPmouse 2D knockout (KO) (reflecting poor metabolizers for CYP 2D6 substrates) mice. Plasma and liver pharmacokinetic profiles from a single 20-mg/kg of body weight dose of tafenoquine differed between the strains; however, the differences were less striking than previous results obtained for primaquine in the same model. Additionally, the presence of a 5,6-ortho-quinone tafenoquine metabolite was examined in both mouse strains. The 5,6-ortho-quinone species of tafenoquine was observed, and concentrations of the metabolite were highest in the WT extensive-metabolizer phenotype. Altogether, this study indicates that CYP 2D metabolism in mice affects tafenoquine pharmacokinetics and could have implications for human tafenoquine pharmacokinetics in polymorphic CYP 2D6 human populations. PMID:25870069

  18. Numerical Study of EUV Wave Phenomenon on 2009 February 13

    NASA Astrophysics Data System (ADS)

    Zhang, Lei; Zheng, Hui-Nan; Liao, Chi-Jian

    2014-01-01

    Combining the observations of STEREO satellites with the method of three-dimensional magnetohydrodynamic (MHD) numerical simulation, adopt- ing the magnetic field data of the Wilcox Solar Observatory (WSO) and the model of potential field source surface to build up the initial magnetic field in solar corona, and adding a time-varying disturbance of pressure to the active re- gion on the solar surface, the study on the event of coronal mass ejection (CME) and extreme-ultraviolet (EUV) wave happened at 05:35 UT of 2009 February 13 has been performed. It is judged from the images of COR1/STEREO-A that the front speed of this CME is about 350 km·s-1, and the angular width is about 60∘. By analyzing the running difference images of EUVI/STEREO-B at 195 ˚A, it is found that the bright toroidal wavefront is spreading toward all directions around the active region, and behind the bright toroidal wavefront is a coronal dimming area. The positions of the wavefront in four directions are taken to perform linear fittings, it is known that the EUV wave speed is 247 km·s-1, and the EUV wave speed obtained from the numerical simulation is 245 km·s-1. After the IDL visualization program has been carried out for the calculated result, the structures of the bright loop and dimming area can be seen clearly. The numerical simulation is consistent with the satellite observation, which shows that the observed EUV wave may belong to the fast magnetosonic wave.

  19. A numerical study of fundamental shock noise mechanisms

    NASA Astrophysics Data System (ADS)

    Meadows, Kristine R.

    1995-05-01

    The results of this thesis demonstrate that direct numerical simulation can predict sound generation in unsteady aerodynamic flows containing shock waves. Shock waves can be significant sources of sound in high speed jet flows, on helicopter blades, and in supersonic combustion inlets. Direct computation of sound permits the prediction of noise levels in the preliminary design stage and can be used as a tool to focus experimental studies, thereby reducing cost and increasing the probability of a successfully quiet product in less time. This thesis reveals and investigates two mechanisms fundamental to sound generation by shocked flows: shock motion and shock deformation. Shock motion is modeled by the interaction of a sound wave with a shock. During the interaction, the shock wave begins to move and the sound pressure is amplified as the wave passes through the shock. The numerical approach presented in this thesis is validated by the comparison of results obtained in a quasi-one dimensional simulation with linear theory. Analysis of the perturbation energy demonstrated for the first time that acoustic energy is generated by the interaction. Shock deformation is investigated by the numerical simulation of a ring vortex interacting with a shock. This interaction models the passage of turbulent structures through the shock wave. The simulation demonstrates that both acoustic waves and contact surfaces are generated downstream during the interaction. Analysis demonstrates that the acoustic wave spreads cylindrically, that the sound intensity is highly directional, and that the sound pressure level increases significantly with increasing shock strength. The effect of shock strength on sound pressure level is consistent with experimental observations of shock noise, indicating that the interaction of a ring vortex with a shock wave correctly models a dominant mechanism of shock noise generation.

  20. High-Resolution 3-T Endorectal Prostate MRI: A Multireader Study of Radiologist Preference and Perceived Interpretive Quality of 2D and 3D T2-Weighted Fast Spin-Echo MR Images

    PubMed Central

    Westphalen, Antonio C.; Noworolski, Susan M.; Harisinghani, Mukesh; Jhaveri, Kartik S.; Raman, Steve S.; Rosenkrantz, Andrew B.; Wang, Zhen J.; Zagoria, Ronald J.; Kurhanewicz, John

    2016-01-01

    OBJECTIVE The goal of this study was to compare the perceived quality of 3-T axial T2-weighted high-resolution 2D and high-resolution 3D fast spin-echo (FSE) endorectal MR images of the prostate. MATERIALS AND METHODS Six radiologists independently reviewed paired 3-T axial T2-weighted high-resolution 2D and 3D FSE endorectal MR images of the prostates of 85 men in two sessions. In the first session (n = 85), each reader selected his or her preferred images; in the second session (n = 28), they determined their confidence in tumor identification and compared the depiction of the prostatic anatomy, tumor conspicuity, and subjective intrinsic image quality of images. A meta-analysis using a random-effects model, logistic regression, and the paired Wilcoxon rank-sum test were used for statistical analyses. RESULTS Three readers preferred the 2D acquisition (67–89%), and the other three preferred the 3D images (70–80%). The option for one of the techniques was not associated with any of the predictor variables. The 2D FSE images were significantly sharper than 3D FSE (p < 0.001) and significantly more likely to exhibit other (nonmotion) artifacts (p = 0.002). No other statistically significant differences were found. CONCLUSION Our results suggest that there are strong individual preferences for the 2D or 3D FSE MR images, but there was a wide variability among radiologists. There were differences in image quality (image sharpness and presence of artifacts not related to motion) but not in the sequences’ ability to delineate the glandular anatomy and depict a cancerous tumor. PMID:26491891

  1. Integrating Mobile Multimedia into Textbooks: 2D Barcodes

    ERIC Educational Resources Information Center

    Uluyol, Celebi; Agca, R. Kagan

    2012-01-01

    The major goal of this study was to empirically compare text-plus-mobile phone learning using an integrated 2D barcode tag in a printed text with three other conditions described in multimedia learning theory. The method examined in the study involved modifications of the instructional material such that: a 2D barcode was used near the text, the…

  2. 2-D or not 2-D, that is the question: A Northern California test

    SciTech Connect

    Mayeda, K; Malagnini, L; Phillips, W S; Walter, W R; Dreger, D

    2005-06-06

    Reliable estimates of the seismic source spectrum are necessary for accurate magnitude, yield, and energy estimation. In particular, how seismic radiated energy scales with increasing earthquake size has been the focus of recent debate within the community and has direct implications on earthquake source physics studies as well as hazard mitigation. The 1-D coda methodology of Mayeda et al. has provided the lowest variance estimate of the source spectrum when compared against traditional approaches that use direct S-waves, thus making it ideal for networks that have sparse station distribution. The 1-D coda methodology has been mostly confined to regions of approximately uniform complexity. For larger, more geophysically complicated regions, 2-D path corrections may be required. The complicated tectonics of the northern California region coupled with high quality broadband seismic data provides for an ideal ''apples-to-apples'' test of 1-D and 2-D path assumptions on direct waves and their coda. Using the same station and event distribution, we compared 1-D and 2-D path corrections and observed the following results: (1) 1-D coda results reduced the amplitude variance relative to direct S-waves by roughly a factor of 8 (800%); (2) Applying a 2-D correction to the coda resulted in up to 40% variance reduction from the 1-D coda results; (3) 2-D direct S-wave results, though better than 1-D direct waves, were significantly worse than the 1-D coda. We found that coda-based moment-rate source spectra derived from the 2-D approach were essentially identical to those from the 1-D approach for frequencies less than {approx}0.7-Hz, however for the high frequencies (0.7{le} f {le} 8.0-Hz), the 2-D approach resulted in inter-station scatter that was generally 10-30% smaller. For complex regions where data are plentiful, a 2-D approach can significantly improve upon the simple 1-D assumption. In regions where only 1-D coda correction is available it is still preferable over 2

  3. Technical Review of the UNET2D Hydraulic Model

    SciTech Connect

    Perkins, William A.; Richmond, Marshall C.

    2009-05-18

    The Kansas City District of the US Army Corps of Engineers is engaged in a broad range of river management projects that require knowledge of spatially-varied hydraulic conditions such as velocities and water surface elevations. This information is needed to design new structures, improve existing operations, and assess aquatic habitat. Two-dimensional (2D) depth-averaged numerical hydraulic models are a common tool that can be used to provide velocity and depth information. Kansas City District is currently using a specific 2D model, UNET2D, that has been developed to meet the needs of their river engineering applications. This report documents a tech- nical review of UNET2D.

  4. Numerical aerodynamic simulation facility feasibility study, executive summary

    NASA Technical Reports Server (NTRS)

    1979-01-01

    There were three major issues examined in the feasibility study. First, the ability of the proposed system architecture to support the anticipated workload was evaluated. Second, the throughput of the computational engine (the flow model processor) was studied using real application programs. Third, the availability, reliability, and maintainability of the system were modeled. The evaluations were based on the baseline systems. The results show that the implementation of the Numerical Aerodynamic Simulation Facility, in the form considered, would indeed be a feasible project with an acceptable level of risk. The technology required (both hardware and software) either already exists or, in the case of a few parts, is expected to be announced this year.

  5. Reconstruction of Fractional Quantum Hall Edges: Numerical Studies

    NASA Astrophysics Data System (ADS)

    Wan, Xin; Yang, Kun; Rezayi, E. H.

    2003-03-01

    The interplay of electron-electron interaction and confining potential can lead to the reconstruction of fractional quantum Hall edges (Xin Wan, Kun Yang, and E. H. Rezayi, Phys. Rev. Lett. 88, 056802 (2002).). We have performed exact diagonalization studies on microscopic models of fractional quantum Hall liquids, in finite size systems with disc geometry, and found numerical evidence that suggests edge reconstruction occurs under rather general conditions. Due to edge reconstruction, additional nonchiral edge modes can arise for both incompressible and compressible states. We have studied the electron dipole spectral function that is directly related to the microwave conductivity measurement of a two-dimensional electron gas with an array of antidots (P. D. Ye et al., Phys. Rev. B 65, 121305 (2002).). Our results are consistent with the enhanced microwave conductivity observed in experiments at low temperatures, and its suppression at higher temperatures. We also discuss the effects of the edge reconstruction on the fractional quantum Hall edge tunneling experiments.

  6. Impacts on foam stabilised composite structures: Experimental and numerical study

    NASA Astrophysics Data System (ADS)

    Rivallant, S.; Ferrero, J. F.; Barrau, J. J.

    2003-09-01

    A dropweight tester is used to make low velocity tests on specific sandwich type structures. Sandwich are made of glass-epoxy skin and polyurethane foam core. The skins can be straight or little curved, and impact direction is the global skin direction. The aim of these tests is to study the initiation of rupture in such structures: local buckling of skin and foam core rupture. Experimental results are given. They show the evolution of buckling critical stress in the skin when impact velocity increases. The rupture mode in curved skin specimen is also studied: rupture is no more provoked by buckling. A numerical analysis is proposed to model the behaviour of the structure and the rupture initiation. Finally, a method is developed, in order to predict the propagation of skin debonding during impact: an element layer under the skin is damaged with a specific law to simulate debonding.

  7. Numerical study of a high-speed miniature centrifugal compressor

    NASA Astrophysics Data System (ADS)

    Li, Xiaoyi

    A miniature centrifugal compressor is a key component of reverse Brayton cycle cryogenic cooling system. The system is commonly used to generate a low cryogenic temperature environment for electronics to increase their efficiency, or generate, store and transport cryogenic liquids, such as liquid hydrogen and oxygen, where space limit is also an issue. Because of space limitation, the compressor is composed of a radial IGV, a radial impeller and an axial-direction diffuser (which reduces the radial size because of smaller diameter). As a result of reduction in size, rotating speed of the impeller is as high as 313,000 rpm, and Helium is used as the working fluid, in order to obtain the required static pressure ratio/rise. Two main characteristics of the compressor---miniature and high-speed, make it distinct from conventional compressors. Higher compressor efficiency is required to obtain a higher COP (coefficient of performance) system. Even though miniature centrifugal compressors start to draw researchers' attention in recent years, understanding of the performance and loss mechanism is still lacking. Since current experimental techniques are not advanced enough to capture details of flow at miniature scale, numerical methods dominate miniature turbomachinery study. This work numerically studied a high speed miniature centrifugal compressor with commercial CFD code. The overall performance of the compressor was predicted with consideration of interaction between blade rows by using sliding mesh model. The law of similarity of turbomachinery was validated for small scale machines. It was found that the specific ratio effect needs to be considered when similarity law is applied. But Reynolds number effect can be neglected. The loss mechanism of each component was analyzed. Loss due to turning bend was significant in each component. Tip leakage loss of small scale turbomachines has more impact on the impeller performance than that of large scale ones. Because the

  8. Human erythrocytes analyzed by generalized 2D Raman correlation spectroscopy

    NASA Astrophysics Data System (ADS)

    Wesełucha-Birczyńska, Aleksandra; Kozicki, Mateusz; Czepiel, Jacek; Łabanowska, Maria; Nowak, Piotr; Kowalczyk, Grzegorz; Kurdziel, Magdalena; Birczyńska, Malwina; Biesiada, Grażyna; Mach, Tomasz; Garlicki, Aleksander

    2014-07-01

    The most numerous elements of the blood cells, erythrocytes, consist mainly of two components: homogeneous interior filled with hemoglobin and closure which is the cell membrane. To gain insight into their specific properties we studied the process of disintegration, considering these two constituents, and comparing the natural aging process of human healthy blood cells. MicroRaman spectra of hemoglobin within the single RBC were recorded using 514.5, and 785 nm laser lines. The generalized 2D correlation method was applied to analyze the collected spectra. The time passed from blood donation was regarded as an external perturbation. The time was no more than 40 days according to the current storage limit of blood banks, although, the average RBC life span is 120 days. An analysis of the prominent synchronous and asynchronous cross peaks allow us to get insight into the mechanism of hemoglobin decomposition. Appearing asynchronous cross-peaks point towards globin and heme separation from each other, while synchronous shows already broken globin into individual amino acids. Raman scattering analysis of hemoglobin “wrapping”, i.e. healthy erythrocyte ghosts, allows for the following peculiarity of their behavior. The increasing power of the excitation laser induced alterations in the assemblage of membrane lipids. 2D correlation maps, obtained with increasing laser power recognized as an external perturbation, allows for the consideration of alterations in the erythrocyte membrane structure and composition, which occurs first in the proteins. Cross-peaks were observed indicating an asynchronous correlation between the senescent-cell antigen (SCA) and heme or proteins vibrations. The EPR spectra of the whole blood was analyzed regarding time as an external stimulus. The 2D correlation spectra points towards participation of the selected metal ion centers in the disintegration process.

  9. Numerical study of delta wing leading edge blowing

    NASA Technical Reports Server (NTRS)

    Yeh, David; Tavella, Domingo; Roberts, Leonard

    1988-01-01

    Spanwise and tangential leading edge blowing as a means of controlling the position and strength of the leading edge vortices are studied by numerical solution of the three-dimensional Navier-Stokes equations. The leading edge jet is simulated by defining a permeable boundary, corresponding to the jet slot, where suitable boundary conditions are implemented. Numerical results are shown to compare favorably with experimental measurements. It is found that the use of spanwise leading edge blowing at moderate angle of attack magnifies the size and strength of the leading edge vortices, and moves the vortex cores outboard and upward. The increase in lift primarily comes from the greater nonlinear vortex lift. However, spanwise blowing causes earlier vortex breakdown, thus decreasing the stall angle. The effects of tangential blowing at low to moderate angles of attack tend to reduce the pressure peaks associated with leading edge vortices and to increase the suction peak around the leading edge, so that the integrated value of the surface pressure remains about the same. Tangential leading edge blowing in post-stall conditions is shown to re-establish vortical flow and delay vortex bursting, thus increasing C sub L sub max and stall angle.

  10. Numerical Study of Unsteady Flow in Centrifugal Cold Compressor

    NASA Astrophysics Data System (ADS)

    Zhang, Ning; Zhang, Peng; Wu, Jihao; Li, Qing

    In helium refrigeration system, high-speed centrifugal cold compressor is utilized to pumped gaseous helium from saturated liquid helium tank at low temperature and low pressure for producing superfluid helium or sub-cooled helium. Stall and surge are common unsteady flow phenomena in centrifugal cold compressors which severely limit operation range and impact efficiency reliability. In order to obtain the installed range of cold compressor, unsteady flow in the case of low mass flow or high pressure ratio is investigated by the CFD. From the results of the numerical analysis, it can be deduced that the pressure ratio increases with the decrease in reduced mass flow. With the decrease of the reduced mass flow, backflow and vortex are intensified near the shroud of impeller. The unsteady flow will not only increase the flow loss, but also damage the compressor. It provided a numerical foundation of analyzing the effect of unsteady flow field and reducing the flow loss, and it is helpful for the further study and able to instruct the designing.

  11. Numerical Study on Mixed-mode Fracture in Reinforced Concrete

    NASA Astrophysics Data System (ADS)

    Yu, Rena C.; Saucedo, Luis; Ruiz, Gonzalo

    2010-05-01

    The object of this work is to model the propagation of fracture in mixed-mode in lightly reinforced concrete beams. When a notched beam does not have enough shear reinforcement, fracture can initiate and propagate unstably and lead to failure through diagonal tension. In order to study this phenomenon numerically, a model capable of dealing with both static and dynamic crack propagation as well as the natural transition of those two regimes is necessary. We adopt a cohesive model for concrete fracture and an interface model for the deterioration between concrete and steel re-bar, both combined with an insertion algorithm. The static process is solved by dynamic relaxation (DR) method together with a modified technique [1] to enhance convergence rate. The same DR method is used to detect a dynamic process and switch to a dynamic calculation. The numerically obtained load-displacement curves, load-CMOD curves and crack patterns fit reasonably well with their experimental counterparts, having in mind that we fed the calculations only with parameters measured experimentally.

  12. Numerical study of Taylor bubbles with adaptive unstructured meshes

    NASA Astrophysics Data System (ADS)

    Xie, Zhihua; Pavlidis, Dimitrios; Percival, James; Pain, Chris; Matar, Omar; Hasan, Abbas; Azzopardi, Barry

    2014-11-01

    The Taylor bubble is a single long bubble which nearly fills the entire cross section of a liquid-filled circular tube. This type of bubble flow regime often occurs in gas-liquid slug flows in many industrial applications, including oil-and-gas production, chemical and nuclear reactors, and heat exchangers. The objective of this study is to investigate the fluid dynamics of Taylor bubbles rising in a vertical pipe filled with oils of extremely high viscosity (mimicking the ``heavy oils'' found in the oil-and-gas industry). A modelling and simulation framework is presented here which can modify and adapt anisotropic unstructured meshes to better represent the underlying physics of bubble rise and reduce the computational effort without sacrificing accuracy. The numerical framework consists of a mixed control-volume and finite-element formulation, a ``volume of fluid''-type method for the interface capturing based on a compressive control volume advection method, and a force-balanced algorithm for the surface tension implementation. Numerical examples of some benchmark tests and the dynamics of Taylor bubbles are presented to show the capability of this method. EPSRC Programme Grant, MEMPHIS, EP/K0039761/1.

  13. Experimental and numerical FSI study of compliant hydrofoils

    NASA Astrophysics Data System (ADS)

    Augier, B.; Yan, J.; Korobenko, A.; Czarnowski, J.; Ketterman, G.; Bazilevs, Y.

    2015-06-01

    A propulsion system based on tandem hydrofoils is studied experimentally and numerically. An experimental measurement system is developed to extract hydrodynamic loads on the foils and capture their twisting deformation during operation. The measured data allowed us to assess the efficiency of the propulsion system as a function of travel speed and stroke frequency. The numerical simulation of the propulsion system is also presented and involves 3D, full-scale fluid-structure interaction (FSI) computation of a single (forward) foil. The foil is modeled as a combination of the isogeometric rotation-free Kirchhoff-Love shell and bending-stabilized cable, while the hydrodynamics makes use of the finite-element-based arbitrary Lagrangian-Eulerian variational multiscale formulation. The large added mass is handled through a quasi-direct FSI coupling technique. The measurement data collected is used in the validation of the FSI simulation, and excellent agreement is achieved between the predicted and measured hydrodynamic loads and foil twisting motion.

  14. Numerical Study of a Four-Roll Coating System

    NASA Astrophysics Data System (ADS)

    Tsuda, Takeaki

    The characteristics of a four-roll coating system were numerically investigated and compared with experimental data to validate the theoretical models used in this study. In the theoretical models, a film splitting model using a power-law-type equation, a roll-gap model based on elastohydrodynamics, and a flow model from a rotating-cylinder system were applied. The parametric computations for each operational condition revealed the steady and dynamic behaviors of a coating film and liquid films on the coating rolls. The results of the frequency response to the speed disturbances of the coating rolls indicated that the sensitivity of the lowest coating roll to the disturbance was half that of the others; this implies that the requirement for the accuracy of a driving system of the coating roll is not as severe as compared with others. The experimental data and the numerical results at steady state agreed well. Therefore, the theoretical models used in this research were found to be appropriate.

  15. Numerical study of sink-flow boundary layers

    NASA Technical Reports Server (NTRS)

    Spalart, Philippe R.

    1986-01-01

    Direct numerical simulations of sink-flow boundary layers, with acceleration parameters K between 1.5 x 10 to the -6th and 3.0 x 10 to the -6th, are presented. The three-dimensional, time-dependent Navier-Stokes equations are solved numerically, using a spectral method, with about one million degrees of freedom. The flow is assumed to be statistically steady, and self-similar. A multiple-scale approximation and periodic conditions are applied to the fluctuations. The turbulence is studied using instantaneous and statistical results. Good agreement with the experiments of Jones and Launder (1972) is observed. The two effects of the favorable pressure gradient are to extend the logarithmic layer, and to alter the energy balance of the turbulence near the edge of the boundary layer. At low Reynolds number the logarithmic layer is shortened and slightly displaced, but wall-layer streaks are present even at the lowest values of R(theta) for which turbulence can be sustained. Large quiescent patches appear in the flow. Relaminarization occurs at K = 3.0 x 10 to the -6th, corresponding to a Reynolds number R(theta) of about 330.

  16. MAGNETIZATION DEGREE OF GAMMA-RAY BURST FIREBALLS: NUMERICAL STUDY

    SciTech Connect

    Harrison, Richard; Kobayashi, Shiho

    2013-08-01

    The relative strength between forward and reverse shock emission in early gamma-ray burst (GRB) afterglow reflects that of magnetic energy densities in the two shock regions. We numerically show that with the current standard treatment, the fireball magnetization is underestimated by up to two orders of magnitude. This discrepancy is especially large in the sub-relativistic reverse shock regime (i.e., the thin shell and intermediate regime), where most optical flashes were detected. We provide new analytic estimates of the reverse shock emission based on a better shock approximation, which well describe numerical results in the intermediate regime. We show that the reverse shock temperature at the onset of afterglow is constant, ( {Gamma}-bar{sub d}-1){approx}8 Multiplication-Sign 10{sup -2}, when the dimensionless parameter {xi}{sub 0} is more than several. Our approach is applied to case studies of GRB 990123 and 090102, and we find that magnetic fields in the fireballs are even stronger than previously believed. However, these events are still likely to be due to a baryonic jet with {sigma} {approx} 10{sup -3} for GRB 990123 and {approx}3 Multiplication-Sign 10{sup -4} to 3 for GRB 090102.

  17. 2D Regimes of Non-Fourier Convection

    NASA Astrophysics Data System (ADS)

    Papanicolaou, N. C.

    2010-11-01

    In this work, we investigate the 2D flow in a rectangular cavity subject to both vertical and horizontal temperature gradients. The linearized model is studied and the effect of thermal relaxation, as described by the Maxwell-Cattaneo law of heat conduction is examined. To this end, a spectral numerical model is created based on a Galerkin expansion. The basis is the Cartesian product of systems of beam functions and trigonometric functions. The natural modes of the system are derived for both the Fourier and non-Fourier models. The results are compared to earlier works for the plain Fourier law. Our computations show that for the same set of parameters, the Maxwell-Cattaneo law yields modes which are quantitatively different from the Fourier. It is found that the real parts of the eigenvalues increase with the Straughan number Sg, which quantifies the non-Fourier effects. This confirms the destabilizing effect of the MC-law on the convective flow.

  18. Numerical Study on GRB-Jet Formation in Collapsars

    SciTech Connect

    Nagataki, Shigehiro; Takahashi, Rohta; Mizuta, Akira; Takiwaki, Tomoya; /Tokyo U.

    2006-08-22

    Two-dimensional magnetohydrodynamic simulations are performed using the ZEUS-2D code to investigate the dynamics of a collapsar that generates a GRB jet, taking account of realistic equation of state, neutrino cooling and heating processes, magnetic fields, and gravitational force from the central black hole and self gravity. It is found that neutrino heating processes are not so efficient to launch a jet in this study. It is also found that a jet is launched mainly by B{sub {phi}} fields that are amplified by the winding-up effect. However, since the ratio of total energy relative to the rest mass energy in the jet is not so high as several hundred, we conclude that the jets seen in this study are not be a GRB jet. This result suggests that general relativistic effects, which are not included in this study, will be important to generate a GRB jet. Also, the accretion disk with magnetic fields may still play an important role to launch a GRB jet, although a simulation for much longer physical time {approx} 10-100 s is required to confirm this effect. It is shown that considerable amount of {sup 56}Ni is synthesized in the accretion disk. Thus there