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Sample records for quasinormal mode spectroscopy

  1. Quasinormal mode theory and modelling of electron energy loss spectroscopy for plasmonic nanostructures

    NASA Astrophysics Data System (ADS)

    Ge, Rong-Chun; Hughes, Stephen

    2016-05-01

    Understanding light-matter interactions using localized surface plasmons (LSPs) is of fundamental interest in classical and quantum plasmonics and has a wide range of applications. In order to understand the spatial properties of LSPs, electron energy loss spectroscopy (EELS) is a common and powerful method of spatially resolving the extreme localized fields that can be obtained with metal resonators. However, modelling EELS for general shaped resonators presents a major challenge in computational electrodynamics, requiring the full photon Green function as a function of two space points and frequency. Here we present an intuitive and computationally simple method for computing EELS maps of plasmonic resonators using a quasinormal mode (QNM) expansion technique. By separating the contribution of the QNM and the bulk material, we give closed-form analytical formulas for the plasmonic QNM contribution to the EELS maps. We exemplify our technique for a split ring resonator, a gold nanorod, and a nanorod dimer structure. The method is accurate, intuitive, and gives orders of magnitude improvements over direct dipole simulations that numerically solve the full 3D Maxwell equations. We also show how the same QNM Green function can be used to obtain the Purcell factor (and projected local density of optical states) from quantum dipole emitters or two level atoms, and we demonstrate how the spectral features differ in general to the EELS spectrum.

  2. Quasinormal modes of a Schwarzschild white hole

    SciTech Connect

    Bishop, Nigel T.; Kubeka, Amos S.

    2009-09-15

    We investigate perturbations of the Schwarzschild geometry using a linearization of the Einstein vacuum equations within a Bondi-Sachs, or null cone, formalism. We develop a numerical method to calculate the quasinormal modes, and present results for the case l=2. The values obtained are different than those of a Schwarzschild black hole, and we interpret them as quasinormal modes of a Schwarzschild white hole.

  3. Quasi-exactly solvable quasinormal modes

    SciTech Connect

    Ho, C.-L.; Cho, H.-T.

    2007-11-20

    We consider quasinormal modes with complex energies from the point of view of the theory of quasi-exactly solvable (QES) models. We demonstrate that it is possible to find new potentials which admit exactly solvable or QES quasinormal modes by suitable complexification of parameters defining the QES potentials. Particularly, we obtain one QES and four exactly solvable potentials out of the five one-dimensional QES systems based on the sl(2) algebra.

  4. Quasinormal modes of near extremal black branes

    NASA Astrophysics Data System (ADS)

    Starinets, Andrei O.

    2002-12-01

    We find quasinormal modes of near extremal black branes by solving a singular boundary value problem for the Heun equation. The corresponding eigenvalues determine the dispersion law for the collective excitations in the dual strongly coupled N=4 supersymmetric Yang-Mills theory at finite temperature.

  5. Quasinormal modes of superfluid neutron stars

    NASA Astrophysics Data System (ADS)

    Gualtieri, L.; Kantor, E. M.; Gusakov, M. E.; Chugunov, A. I.

    2014-07-01

    We study nonradial oscillations of neutron stars with superfluid baryons, in a general relativistic framework, including finite temperature effects. Using a perturbative approach, we derive the equations describing stellar oscillations, which we solve by numerical integration, employing different models of nucleon superfluidity, and determining frequencies and gravitational damping times of the quasinormal modes. As expected by previous results, we find two classes of modes, associated to superfluid and non-superfluid degrees of freedom, respectively. We study the temperature dependence of the modes, finding that at specific values of the temperature, the frequencies of the two classes of quasinormal modes show avoided crossings, and their damping times become comparable. We also show that, when the temperature is not close to the avoided crossings, the frequencies of the modes can be accurately computed by neglecting the coupling between normal and superfluid degrees of freedom. Our results have potential implications on the gravitational wave emission from neutron stars.

  6. Quasinormal modes of a two-dimensional black hole

    NASA Astrophysics Data System (ADS)

    Estrada-Jiménez, S.; Gómez-Díaz, J. R.; López-Ortega, A.

    2013-11-01

    For a two-dimensional black hole we determine the quasinormal frequencies of the Klein-Gordon and Dirac fields. In contrast to the well known examples whose spectrum of quasinormal frequencies is discrete, for this black hole we find a continuous spectrum of quasinormal frequencies, but there are unstable quasinormal modes. In the framework of the Hod and Maggiore proposals we also discuss the consequences of these results on the form of the entropy spectrum for the two-dimensional black hole.

  7. Exact quasinormal modes for a special class of black holes

    SciTech Connect

    Oliva, Julio; Troncoso, Ricardo

    2010-07-15

    Analytic exact expressions for the quasinormal modes of scalar and electromagnetic perturbations around a special class of black holes are found in d{>=}3 dimensions. It is shown that the size of the black hole provides a lower bound for the angular momentum of the perturbation. Quasinormal modes appear when this bound is fulfilled; otherwise the excitations become purely damped.

  8. TOPICAL REVIEW: Quasinormal modes of black holes and black branes

    NASA Astrophysics Data System (ADS)

    Berti, Emanuele; Cardoso, Vitor; Starinets, Andrei O.

    2009-08-01

    Quasinormal modes are eigenmodes of dissipative systems. Perturbations of classical gravitational backgrounds involving black holes or branes naturally lead to quasinormal modes. The analysis and classification of the quasinormal spectra require solving non-Hermitian eigenvalue problems for the associated linear differential equations. Within the recently developed gauge-gravity duality, these modes serve as an important tool for determining the near-equilibrium properties of strongly coupled quantum field theories, in particular their transport coefficients, such as viscosity, conductivity and diffusion constants. In astrophysics, the detection of quasinormal modes in gravitational wave experiments would allow precise measurements of the mass and spin of black holes as well as new tests of general relativity. This review is meant as an introduction to the subject, with a focus on the recent developments in the field.

  9. Quasinormal modes in a time-dependent black hole background

    SciTech Connect

    Shao Chenggang; Wang Bin; Abdalla, Elcio; Su Rukeng

    2005-02-15

    We have studied the evolution of the massless scalar field propagating in a time-dependent charged Vaidya black hole background. A generalized tortoise coordinate transformation was used to study the evolution of the massless scalar field. It is shown that, for the slowest damped quasinormal modes, the approximate formulas in the stationary Reissner-Nordstroem black hole turn out to be a reasonable prescription, showing that results from quasinormal mode analysis are rather robust.

  10. The Eikonal Quasinormal Modes of Kerr-Newman Black Holes

    NASA Astrophysics Data System (ADS)

    Mark, Zachary; Yang, Huan; Zimmerman, Aaron; Chen, Yanbei

    2015-04-01

    Due to the complicated coupling between gravity and electromagnetism near a Kerr-Newman black hole, a master, separable equation governing gravitational or electromagnetic perturbations has yet to be discovered, impeding efforts to calculate the quasinormal modes of perturbed black holes with arbitrary spin and charge. Instead, gravitational and electromagnetic perturbations are found to obey a pair of coupled, partial differential equations. To study the quasinormal modes, we examine these equations in the eikonal limit (where the waves are rapidly changing in space and time) via a newly developed WKB technique capable of handling coupled wave equations. Surprisingly, it turns out that an approximate master equation introduced by Dudley and Finley provides an accurate description of perturbations in the eikonal regime. These techniques allow the ``geometric correspondence'' between quasinormal modes and photon geodesics that is known to be true for Kerr black holes to be extended to Kerr-Newman black holes.

  11. Quasi-Normal Modes of Stars and Black Holes.

    PubMed

    Kokkotas, Kostas D; Schmidt, Bernd G

    1999-01-01

    Perturbations of stars and black holes have been one of the main topics of relativistic astrophysics for the last few decades. They are of particular importance today, because of their relevance to gravitational wave astronomy. In this review we present the theory of quasi-normal modes of compact objects from both the mathematical and astrophysical points of view. The discussion includes perturbations of black holes (Schwarzschild, Reissner-Nordström, Kerr and Kerr-Newman) and relativistic stars (non-rotating and slowly-rotating). The properties of the various families of quasi-normal modes are described, and numerical techniques for calculating quasi-normal modes reviewed. The successes, as well as the limits, of perturbation theory are presented, and its role in the emerging era of numerical relativity and supercomputers is discussed.

  12. Quasinormal modes of black holes: The improved semianalytic approach

    NASA Astrophysics Data System (ADS)

    Matyjasek, Jerzy; Opala, Michał

    2017-07-01

    We extend the semianalytic technique of Iyer and Will for computing the complex quasinormal frequencies of black holes, ω , by constructing the Padé approximants of the (formal) series for ω2. It is shown that for the (so-far best documented) quasinormal frequencies of the Schwarzschild and Reissner-Nordström black holes the Padé transforms P66 and P76 are, within the domain of applicability, always in excellent agreement with the numerical results. We argue that the method may serve as a black box with the "potential" Q (x ) as an input and the accurate quasinormal modes as the output. The generalizations and modifications of the method are briefly discussed as well as the preliminary results for other classes of black holes.

  13. Quasinormal modes of Reissner-Nordstrom black holes

    NASA Technical Reports Server (NTRS)

    Leaver, Edward W.

    1990-01-01

    A matrix-eigenvalue algorithm is presented for accurately computing the quasi-normal frequencies and modes of charged static blackholes. The method is then refined through the introduction of a continued-fraction step. The approach should generalize to a variety of nonseparable wave equations, including the Kerr-Newman case of charged rotating blackholes.

  14. Looking at the Gregory-Laflamme instability through quasinormal modes

    SciTech Connect

    Konoplya, R. A.; Murata, Keiju; Soda, Jiro; Zhidenko, A.

    2008-10-15

    We study evolution of gravitational perturbations of black strings. It is well known that for all wave numbers less than some threshold value, the black string is unstable against the scalar type of gravitational perturbations, which is named the Gregory-Laflamme instability. Using numerical methods, we find the quasinormal modes and time-domain profiles of the black string perturbations in the stable sector and also show the appearance of the Gregory-Laflamme instability in the time domain. The dependence of the black string quasinormal spectrum and late-time tails on such parameters as the wave vector and the number of extra dimensions is discussed. There is numerical evidence that at the threshold point of instability, the static solution of the wave equation is dominant. For wave numbers slightly larger than the threshold value, in the region of stability, we see tiny oscillations with very small damping rate. While, for wave numbers slightly smaller than the threshold value, in the region of the Gregory-Laflamme instability, we observe tiny oscillations with very small growth rate. We also find the level crossing of imaginary part of quasinormal modes between the fundamental mode and the first overtone mode, which accounts for the peculiar time domain profiles.

  15. Quasinormal modes and classical wave propagation in analogue black holes

    SciTech Connect

    Berti, Emanuele; Cardoso, Vitor; Lemos, Jose P.S.

    2004-12-15

    Many properties of black holes can be studied using acoustic analogues in the laboratory through the propagation of sound waves. We investigate in detail sound wave propagation in a rotating acoustic (2+1)-dimensional black hole, which corresponds to the 'draining bathtub' fluid flow. We compute the quasinormal mode frequencies of this system and discuss late-time power-law tails. Because of the presence of an ergoregion, waves in a rotating acoustic black hole can be superradiantly amplified. We also compute superradiant reflection coefficients and instability time scales for the acoustic black hole bomb, the equivalent of the Press-Teukolsky black hole bomb. Finally we discuss quasinormal modes and late-time tails in a nonrotating canonical acoustic black hole, corresponding to an incompressible, spherically symmetric (3+1)-dimensional fluid flow.

  16. Fermionic quasinormal modes for two-dimensional Hořava-Lifshitz black holes

    NASA Astrophysics Data System (ADS)

    Stetsko, M. M.

    2017-06-01

    To obtain fermionic quasinormal modes, the Dirac equation for two types of black holes is investigated. It is shown that two different geometries lead to distinctive types of quasinormal modes, while the boundary conditions imposed on the solutions in both cases are identical. For the first type of black hole, the quasinormal modes have continuous spectrum with negative imaginary part that provides the stability of perturbations. For the second type of the black hole, the quasinormal modes have a discrete spectrum and are completely imaginary.

  17. Model for Quasinormal Mode Excitation by a Particle Plunging into a Black Hole

    NASA Astrophysics Data System (ADS)

    Mark, Zachary; Zimmerman, Aaron; Yang, Huan; Chen, Yanbei

    2016-03-01

    It is known that the late time gravitational waveform produced by a particle plunging into a Kerr black hole is well described by a sum of quasinormal modes. However it is not yet understood how the early part of the waveform gives way to the quasinormal mode description, which diverges at early times, nor how the inhomogenous part of the waveform contributes. Motivated by, we offer a model for quasinormal mode excitation by a particle plunging into a Schwarzschild black hole. To develop our model we study approximations to the Regge-Wheeler equation that allow for a closed-form expression for the frequency-domain Green's function, which we use to isolate the component of the waveform that should be identified with quasinormal ringing. Our description of quasinormal ringing does not diverge at early times and reveals that quasinormal ringing should be understood in analogy with a damped harmonic oscillator experiencing a transient driving source.

  18. Resolving nanophotonic spectra with quasi-normal modes (Conference Presentation)

    NASA Astrophysics Data System (ADS)

    Powell, David A.

    2016-09-01

    Many nanophotonic systems are strongly coupled to radiating waves, or suffer significant dissipative losses. Furthermore, they may have complex shapes which are not amenable to closed form calculations. This makes it challenging to determine their modes without resorting to quasi-static or point dipole approximations. To solve this problem, the quasi-normal modes (QNMs) are found from an integral equation model of the particle. These give complex frequencies where excitation can be supported without any incident field. The corresponding eigenvectors yield the modal distributions, which are non-orthogonal due to the non-Hermitian nature of the system. The model based on quasi-normal modes is applied to plasmonic and dielectric particles, and compared with a spherical multipole decomposition. Only with the QNMs is it possible to resolve all features of the extinction spectrum, as each peak in the spectrum can be attributed to a particular mode. In contrast, many of the multipole coefficient have multiple peaks and dips. Furthermore, by performing a multipolar decomposition of each QNM, the spectrum of multipole coefficients is explained in terms of destructive interference between modes of the same multipole order.

  19. Quasinormal modes of Einstein-Gauss-Bonnet-dilaton black holes

    NASA Astrophysics Data System (ADS)

    Blázquez-Salcedo, Jose Luis; Khoo, Fech Scen; Kunz, Jutta

    2017-09-01

    We study quasinormal modes of static Einstein-Gauss-Bonnet-dilaton black holes. Both axial and polar perturbations are considered and studied from l =0 to l =3 . We emphasize the difference in the spectrum between the Schwarzschild solutions and dilatonic black holes. At large Gauss-Bonnet coupling constant, a small secondary branch of black holes is present, when the dilaton coupling is sufficiently strong. The modes of the primary branch can differ from the Schwarzschild modes up to 10%. The secondary branch is unstable and possesses long-lived modes. We address the possible effects of these modes on future observations of gravitational waves emitted during the ringdown phase of astrophysical black holes.

  20. Quasinormal modes and the phase structure of strongly coupled matter

    NASA Astrophysics Data System (ADS)

    Janik, Romuald A.; Jankowski, Jakub; Soltanpanahi, Hesam

    2016-06-01

    We investigate the poles of the retarded Green's functions of strongly coupled field theories exhibiting a variety of phase structures from a crossover up to different first order phase transitions. These theories are modeled by a dual gravitational description. The poles of the holographic Green's functions appear at the frequencies of the quasinormal modes of the dual black hole background. We focus on quantifying linearized level dynamical response of the system in the critical region of phase diagram. Generically non-hydrodynamic degrees of freedom are important for the low energy physics in the vicinity of a phase transition. For a model with linear confinement in the meson spectrum we find degeneracy of hydrodynamic and non-hydrodynamic modes close to the minimal black hole temperature, and we establish a region of temperatures with unstable non-hydrodynamic modes in a branch of black hole solutions.

  1. Quasinormal modes of asymptotically (A)dS black hole in Lovelock background

    NASA Astrophysics Data System (ADS)

    Abbasvandi, N.; Soleimani, M. J.; Abdullah, W. A. T. Wan; Radiman, Shahidan

    2017-03-01

    We study the quasinormal modes of the massless scalar field in asymptotically (A)dS black holes in Lovelock spacetime by using the sixth order of the WKB approximation. We consider the effects of the second and third order of Lovelock coupling constants on quasinormal frequencies spectrum as well as cosmological constant.

  2. Computing black hole partition functions from quasinormal modes

    DOE PAGES

    Arnold, Peter; Szepietowski, Phillip; Vaman, Diana

    2016-07-07

    We propose a method of computing one-loop determinants in black hole space-times (with emphasis on asymptotically anti-de Sitter black holes) that may be used for numerics when completely-analytic results are unattainable. The method utilizes the expression for one-loop determinants in terms of quasinormal frequencies determined by Denef, Hartnoll and Sachdev in [1]. A numerical evaluation must face the fact that the sum over the quasinormal modes, indexed by momentum and overtone numbers, is divergent. A necessary ingredient is then a regularization scheme to handle the divergent contributions of individual fixed-momentum sectors to the partition function. To this end, we formulatemore » an effective two-dimensional problem in which a natural refinement of standard heat kernel techniques can be used to account for contributions to the partition function at fixed momentum. We test our method in a concrete case by reproducing the scalar one-loop determinant in the BTZ black hole background. Furthermore, we then discuss the application of such techniques to more complicated spacetimes.« less

  3. Computing black hole partition functions from quasinormal modes

    SciTech Connect

    Arnold, Peter; Szepietowski, Phillip; Vaman, Diana

    2016-07-07

    We propose a method of computing one-loop determinants in black hole space-times (with emphasis on asymptotically anti-de Sitter black holes) that may be used for numerics when completely-analytic results are unattainable. The method utilizes the expression for one-loop determinants in terms of quasinormal frequencies determined by Denef, Hartnoll and Sachdev in [1]. A numerical evaluation must face the fact that the sum over the quasinormal modes, indexed by momentum and overtone numbers, is divergent. A necessary ingredient is then a regularization scheme to handle the divergent contributions of individual fixed-momentum sectors to the partition function. To this end, we formulate an effective two-dimensional problem in which a natural refinement of standard heat kernel techniques can be used to account for contributions to the partition function at fixed momentum. We test our method in a concrete case by reproducing the scalar one-loop determinant in the BTZ black hole background. Furthermore, we then discuss the application of such techniques to more complicated spacetimes.

  4. Computing black hole partition functions from quasinormal modes

    NASA Astrophysics Data System (ADS)

    Arnold, Peter; Szepietowski, Phillip; Vaman, Diana

    2016-07-01

    We propose a method of computing one-loop determinants in black hole space-times (with emphasis on asymptotically anti-de Sitter black holes) that may be used for numerics when completely-analytic results are unattainable. The method utilizes the expression for one-loop determinants in terms of quasinormal frequencies determined by Denef, Hartnoll and Sachdev in [1]. A numerical evaluation must face the fact that the sum over the quasinormal modes, indexed by momentum and overtone numbers, is divergent. A necessary ingredient is then a regularization scheme to handle the divergent contributions of individual fixed-momentum sectors to the partition function. To this end, we formulate an effective two-dimensional problem in which a natural refinement of standard heat kernel techniques can be used to account for contributions to the partition function at fixed momentum. We test our method in a concrete case by reproducing the scalar one-loop determinant in the BTZ black hole background. We then discuss the application of such techniques to more complicated spacetimes.

  5. Highly damped quasinormal modes and the small scale structure of quantum corrected black hole exteriors

    SciTech Connect

    Babb, James; Kunstatter, Gabor; Daghigh, Ramin

    2011-10-15

    Quasinormal modes provide valuable information about the structure of spacetime outside a black hole. There is also a conjectured relationship between the highly damped quasinormal modes and the semiclassical spectrum of the horizon area/entropy. In this paper, we show that for spacetimes characterized by more than one scale, the 'infinitely damped' modes in principle probe the structure of spacetime outside the horizon at the shortest length scales. We demonstrate this with the calculation of the highly damped quasinormal modes of the nonsingular, single-horizon, quantum corrected black hole derived in [A. Peltola and G. Kunstatter, Phys. Rev. D 79, 061501 (2009); ].

  6. Quasinormal Modes for Schwarzschild-AdS Black Holes: Exponential Convergence to the Real Axis

    NASA Astrophysics Data System (ADS)

    Gannot, Oran

    2014-09-01

    We study quasinormal modes for massive scalar fields in Schwarzschild-anti-de Sitter black holes. When the mass-squared is above the Breitenlohner-Freedman bound, we show that for large angular momenta, ℓ, there exist quasinormal modes with imaginary parts of size exp(- ℓ/ C). We provide an asymptotic expansion for the real parts of the modes closest to the real axis and identify the vanishing of certain coefficients depending on the dimension.

  7. A matrix method for quasinormal modes: Kerr and Kerr-Sen black holes

    NASA Astrophysics Data System (ADS)

    Lin, Kai; Qian, Wei-Liang; Pavan, Alan B.; Abdalla, Elcio

    2017-08-01

    In this paper, a matrix method is employed to study the scalar quasinormal modes of Kerr as well as Kerr-Sen black holes. Discretization is applied to transfer the scalar perturbation equation into a matrix form eigenvalue problem, where the resulting radial and angular equations are derived by the method of separation of variables. The eigenvalues, quasinormal frequencies ω and angular quantum numbers λ, are then obtained by numerically solving the resultant homogeneous matrix equation. This work shows that the present approach is an accurate, as well as efficient method for investigating quasinormal modes.

  8. Quasi-normal Modes of Rerssner-Nordström Black Hole

    NASA Astrophysics Data System (ADS)

    Jiang, Ji-Jian; Liu, Jing-Lun; Li, Chuan-An

    2017-07-01

    The minimum interval of event horizon area of Rerssner-Nordström black hole was calculated via using the loop quantum gravity theory. Based on the first law of black hole thermodynamics, the real part of quasi-normal modes frequency of the black hole was calculated. The expression of asymptotically quasi-normal mode frequency of Rerssner-Nordström black hole was deduced strictly. By analyzing the value of the minimum spin j m i n , the two families of quasi-normal mode spectra of the charged black hole were obtained for j m i n = 1/2 and j m i n = 1 respectively. Our conclusion is in complete agreement with the analytical results of Hod. Our results provide the theoretical basis for the source of the real part of the quasi-normal mode frequency of the black hole.

  9. Are eikonal quasinormal modes linked to the unstable circular null geodesics?

    NASA Astrophysics Data System (ADS)

    Konoplya, R. A.; Stuchlík, Z.

    2017-08-01

    In Cardoso et al. [6] it was claimed that quasinormal modes which any stationary, spherically symmetric and asymptotically flat black hole emits in the eikonal regime are determined by the parameters of the circular null geodesic: the real and imaginary parts of the quasinormal mode are multiples of the frequency and instability timescale of the circular null geodesics respectively. We shall consider asymptotically flat black hole in the Einstein-Lovelock theory, find analytical expressions for gravitational quasinormal modes in the eikonal regime and analyze the null geodesics. Comparison of the both phenomena shows that the expected link between the null geodesics and quasinormal modes is violated in the Einstein-Lovelock theory. Nevertheless, the correspondence exists for a number of other cases and here we formulate its actual limits.

  10. Quasinormal modes of non-Abelian hyperscaling violating Lifshitz black holes

    NASA Astrophysics Data System (ADS)

    Bécar, Ramón; González, P. A.; Vásquez, Yerko

    2017-02-01

    We study the quasinormal modes of scalar field perturbations in the background of non-Abelian hyperscaling violating Lifshitz black holes. We find that the quasinormal frequencies have no real part so there is no oscillatory behavior in the perturbations, only exponential decay, that is, the system is always overdamped, which guarantees the mode stability of non-Abelian hyperscaling violating Lifshitz black holes. We determine analytically the quasinormal modes for massless scalar fields for a dynamical exponent z=2 and hyperscaling violating exponent tilde{θ }>-2. Also, we obtain numerically the quasinormal frequencies for different values of the dynamical exponent and the hyperscaling violating exponent by using the improved asymptotic iteration method.

  11. Second-order quasinormal mode of the Schwarzschild black hole

    NASA Astrophysics Data System (ADS)

    Nakano, Hiroyuki; Ioka, Kunihito

    2007-10-01

    We formulate and calculate the second-order quasinormal modes (QNMs) of a Schwarzschild black hole (BH). Gravitational waves (GW) from a distorted BH, the so-called ringdowns, are well understood as QNMs in general relativity. Since QNMs from binary BH mergers will be detected with a high signal-to-noise ratio by GW detectors, it is also possible to detect the second perturbative order of QNMs, generated by nonlinear gravitational interaction near the BH. In the BH perturbation approach, we derive the master Zerilli equation for the metric perturbation to second order and explicitly regularize it at the horizon and spatial infinity. We numerically solve the second-order Zerilli equation by implementing the modified Leaver continued fraction method. The second-order QNM frequencies are found to be twice the first-order ones, and the GW amplitude is up to ˜10% that of the first order for the binary BH mergers. Since the second-order QNMs always exist, we can use their detections (i) to test the nonlinearity of general relativity, in particular, the no-hair theorem, (ii) to remove fake events in the data analysis of QNM GWs, and (iii) to measure the distance to the BH.

  12. Mesonic quasinormal modes of the Sakai-Sugimoto model at high temperature

    SciTech Connect

    Evans, Nick; Threlfall, Ed

    2008-06-15

    We examine the mesonic thermal spectrum of the Sakai-Sugimoto model of holographic QCD by finding the quasinormal frequencies of the supergravity dual. If flavor is added using D8-D8 branes there exist embeddings where the D-brane world volume contains a black hole. For these embeddings (the high-temperature phase of the Sakai-Sugimoto model) we determine the quasinormal spectra of scalar and vector mesons arising from the world volume Dirac-Born-Infeld (DBI) action of the D-brane. We stress the importance of a coordinate change that makes the infalling quasinormal modes regular at the horizon allowing a simple numerical shooting technique. Finally we examine the effect of finite spatial momentum on quasinormal spectra.

  13. Numerical study of the quasinormal mode excitation of Kerr black holes

    SciTech Connect

    Dorband, Ernst Nils; Diener, Peter; Tiglio, Manuel; Berti, Emanuele; Schnetter, Erik

    2006-10-15

    We present numerical results from three-dimensional evolutions of scalar perturbations of Kerr black holes. Our simulations make use of a high-order accurate multiblock code which naturally allows for adapted grids and smooth inner (excision) and outer boundaries. We focus on the quasinormal ringing phase, presenting a systematic method for extraction of the quasinormal mode frequencies and amplitudes and comparing our results against perturbation theory. The detection of a single mode in a ringdown waveform allows for a measurement of the mass and spin of a black hole; a multimode detection would allow a test of the Kerr nature of the source. Since the possibility of a multimode detection depends on the relative mode amplitude, we study this topic in some detail. The amplitude of each mode depends exponentially on the starting time of the quasinormal regime, which is not defined unambiguously. We show that this time-shift problem can be circumvented by looking at appropriately chosen relative mode amplitudes. From our simulations we extract the quasinormal frequencies and the relative and absolute amplitudes of corotating and counterrotating modes (including overtones in the corotating case). We study the dependence of these amplitudes on the shape of the initial perturbation, the angular dependence of the mode, and the black hole spin, comparing against results from perturbation theory in the so-called asymptotic approximation. We also compare the quasinormal frequencies from our numerical simulations with predictions from perturbation theory, finding excellent agreement. For rapidly rotating black holes (of spin j=0.98) we can extract the quasinormal frequencies of not only the fundamental mode, but also of the first two overtones. Finally we study under what conditions the relative amplitude between given pairs of modes gets maximally excited and present a quantitative analysis of rotational mode-mode coupling. The main conclusions and techniques of our

  14. Comment on "Normalization of quasinormal modes in leaky optical cavities and plasmonic resonators"

    NASA Astrophysics Data System (ADS)

    Muljarov, E. A.; Langbein, W.

    2017-07-01

    Recently, Kristensen, Ge, and Hughes [Phys. Rev. A 92, 053810 (2015), 10.1103/PhysRevA.92.053810] have compared three different methods for normalization of quasinormal modes in open optical systems and concluded that they all provide the same result. We show here that this conclusion is incorrect and illustrate that the normalization of 2 P. T. Kristensen et al., Opt. Lett. 37, 1649 (2012), 10.1364/OL.37.001649, is divergent for any optical mode having a finite quality factor, and that the Silver-Müller radiation condition is not fulfilled for quasinormal modes.

  15. Stability and quasinormal modes of the massive scalar field around Kerr black holes

    NASA Astrophysics Data System (ADS)

    Konoplya, R. A.; Zhidenko, A. V.

    2006-06-01

    In this paper, we find quasinormal spectrum of the massive scalar field in the background of the Kerr black holes. We show that all found modes are damped under the quasinormal modes boundary conditions when μM≲1, thereby implying stability of the massive scalar field. This complements the region of stability determined by the Beyer inequality for large masses of the field. We show that, similar to the case of a nonrotating black hole, the massive term of the scalar field does not contribute in the regime of high damping. Therefore, the high damping asymptotic should be the same as for the massless scalar field.

  16. Quasinormal modes of black holes in scalar-tensor theories with nonminimal derivative couplings

    NASA Astrophysics Data System (ADS)

    Dong, Ruifeng; Sakstein, Jeremy; Stojkovic, Dejan

    2017-09-01

    We study the quasinormal modes of asymptotically anti-de Sitter black holes in a class of shift-symmetric Horndeski theories where a gravitational scalar is derivatively coupled to the Einstein tensor. The spacetime differs from exact Schwarzschild-anti-de Sitter, resulting in a different effective potential for the quasinormal modes and a different spectrum. We numerically compute this spectrum for a massless test scalar coupled both minimally to the metric, and nonminimally to the gravitational scalar. We find interesting differences from the Schwarzschild-anti-de Sitter black hole found in general relativity.

  17. Quasinormal-mode spectrum of Kerr black holes and its geometric interpretation

    NASA Astrophysics Data System (ADS)

    Yang, Huan; Nichols, David A.; Zhang, Fan; Zimmerman, Aaron; Zhang, Zhongyang; Chen, Yanbei

    2012-11-01

    There is a well-known, intuitive geometric correspondence between high-frequency quasinormal modes of Schwarzschild black holes and null geodesics that reside on the light ring (often called spherical photon orbits): the real part of the mode’s frequency relates to the geodesic’s orbital frequency, and the imaginary part of the frequency corresponds to the Lyapunov exponent of the orbit. For slowly rotating black holes, the quasinormal mode’s real frequency is a linear combination of the orbit’s precessional and orbital frequencies, but the correspondence is otherwise unchanged. In this paper, we find a relationship between the quasinormal-mode frequencies of Kerr black holes of arbitrary (astrophysical) spins and general spherical photon orbits, which is analogous to the relationship for slowly rotating holes. To derive this result, we first use the Wentzel-Kramers-Brillouin approximation to compute accurate algebraic expressions for large-l quasinormal-mode frequencies. Comparing our Wentzel-Kramers-Brillouin calculation to the leading-order, geometric-optics approximation to scalar-wave propagation in the Kerr spacetime, we then draw a correspondence between the real parts of the parameters of a quasinormal mode and the conserved quantities of spherical photon orbits. At next-to-leading order in this comparison, we relate the imaginary parts of the quasinormal-mode parameters to coefficients that modify the amplitude of the scalar wave. With this correspondence, we find a geometric interpretation of two features of the quasinormal-mode spectrum of Kerr black holes: First, for Kerr holes rotating near the maximal rate, a large number of modes have nearly zero damping; we connect this characteristic to the fact that a large number of spherical photon orbits approach the horizon in this limit. Second, for black holes of any spins, the frequencies of specific sets of modes are degenerate; we find that this feature arises when the spherical photon orbits

  18. Quasinormal modes of a quantum-corrected Schwarzschild black hole: gravitational and Dirac perturbations

    NASA Astrophysics Data System (ADS)

    Saleh, Mahamat; Bouetou, Bouetou Thomas; Kofane, Timoleon Crepin

    2016-04-01

    In this work, quasinormal modes (QNMs) of the Schwarzschild black hole are investigated by taking into account the quantum fluctuations. Gravitational and Dirac perturbations were considered for this case. The Regge-Wheeler gauge and the Dirac equation were used to derive the perturbation equations of the gravitational and Dirac fields respectively and the third order Wentzel-Kramers-Brillouin (WKB) approximation method is used for the computing of the quasinormal frequencies. The results show that due to the quantum fluctuations in the background of the Schwarzschild black hole, the QNMs of the black hole damp more slowly when increasing the quantum correction factor (a), and oscillate more slowly.

  19. Quasi-normal modes of extremal BTZ black holes in TMG

    NASA Astrophysics Data System (ADS)

    Afshar, Hamid R.; Alishahiha, Mohsen; Mosaffa, Amir E.

    2010-08-01

    We study the spectrum of tensor perturbations on extremal BTZ black holes in topologically massive gravity for arbitrary values of the coefficient of the Chern-Simons term, μ. Imposing proper boundary conditions at the boundary of the space and at the horizon, we find that the spectrum contains quasi-normal modes.

  20. On Quasi-Normal Modes, Area Quantization and Bohr Correspondence Principle

    NASA Astrophysics Data System (ADS)

    Corda, Christian

    2015-10-01

    In (Int. Journ. Mod. Phys. D 14, 181 2005), the author Khriplovich verbatim claims that "the correspondence principle does not dictate any relation between the asymptotics of quasinormal modes and the spectrum of quantized black holes" and that "this belief is in conflict with simple physical arguments". In this paper we analyze Khriplovich's criticisms and realize that they work only for the original proposal by Hod, while they do not work for the improvements suggested by Maggiore and recently finalized by the author and collaborators through a connection between Hawking radiation and black hole (BH) quasi-normal modes (QNMs). This is a model of quantum BH somewhat similar to the historical semi-classical model of the structure of a hydrogen atom introduced by Bohr in 1913. Thus, QNMs can be really interpreted as BH quantum levels (the "electrons" of the "Bohr-like BH model").Our results have also important implications on the BH information puzzle.

  1. Connection between black-hole quasinormal modes and lensing in the strong deflection limit.

    PubMed

    Stefanov, Ivan Zh; Yazadjiev, Stoytcho S; Gyulchev, Galin G

    2010-06-25

    The purpose of the current Letter is to give some relations between gravitational lensing in the strong-deflection limit and the frequencies of the quasinormal modes of spherically symmetric, asymptotically flat black holes. On the one side, the relations obtained can give a physical interpretation of the strong-deflection limit parameters. On the other side, they also give an alternative method for the measurement of the frequencies of the quasinormal modes of spherically symmetric, asymptotically flat black holes. They could be applied to the localization of the sources of gravitational waves and could tell us what frequencies of the gravitational waves we could expect from a black hole acting simultaneously as a gravitational lens and a source of gravitational waves.

  2. Quasinormal modes, scattering, and Hawking radiation of Kerr-Newman black holes in a magnetic field

    SciTech Connect

    Kokkotas, K. D.; Konoplya, R. A.; Zhidenko, A.

    2011-01-15

    We perform a comprehensive analysis of the spectrum of proper oscillations (quasinormal modes), transmission/reflection coefficients, and Hawking radiation for a massive charged scalar field in the background of the Kerr-Newman black hole immersed in an asymptotically homogeneous magnetic field. There are two main effects: the Zeeman shift of the particle energy in the magnetic field and the difference of values of an electromagnetic potential between the horizon and infinity, i.e. the Faraday induction. We have shown that 'turning on' the magnetic field induces a stronger energy-emission rate and leads to 'recharging' of the black hole. Thus, a black hole immersed in a magnetic field evaporates much quicker, achieving thereby an extremal state in a shorter period of time. Quasinormal modes are moderately affected by the presence of a magnetic field which is assumed to be relatively small compared to the gravitational field of the black hole.

  3. Behavior of quasinormal modes and high dimension RN-AdS black hole phase transition

    NASA Astrophysics Data System (ADS)

    Chabab, M.; Moumni, H. El; Iraoui, S.; Masmar, K.

    2016-12-01

    In this work we use the quasinormal frequencies of a massless scalar perturbation to probe the phase transition of the high dimension charged AdS black hole. The signature of the critical behavior of this black hole solution is detected in the isobaric as well as in isothermal process. This paper is a natural generalization of Liu et al. (JHEP 1409:179, 2014) to higher dimensional spacetime. More precisely our study shows a clear signal for any dimension d in the isobaric process. As to the isothermal case, we find that this signature can be affected by other parameters like the pressure and the horizon radius. We conclude that the quasinormal modes can be an efficient tool to investigate the first-order phase transition, but fail to disclose the signature of the second-order phase transition.

  4. Charged scalar quasi-normal modes for linearly charged dilaton-Lifshitz solutions

    NASA Astrophysics Data System (ADS)

    Kord Zangeneh, M.; Wang, B.; Sheykhi, A.; Tang, Z. Y.

    2017-08-01

    Most available studies of quasi-normal modes for Lifshitz black solutions are limited to the neutral scalar perturbations. In this letter, we investigate the wave dynamics of massive charged scalar perturbation in the background of (3 + 1)-dimensional charged dilaton Lifshitz black branes/holes. We disclose the dependence of the quasi-normal modes on the model parameters, such as the Lifshitz exponent z, the mass and charge of the scalar perturbation field and the charge of the Lifshitz configuration. In contrast with neutral perturbations, we observe the possibility to destroy the original Lifshitz background near the extreme value of charge where the temperature is low. We find out that when the Lifshitz exponent deviates more from unity, it is more difficult to break the stability of the configuration. We also study the behavior of the real part of the quasi-normal frequencies. Unlike the neutral scalar perturbation around uncharged black branes where an overdamping was observed to start at z = 2 and independent of the value of scalar mass, our observation discloses that the overdamping starting point is no longer at z = 2 and depends on the mass of scalar field for charged Lifshitz black branes. For charged scalar perturbations, fixing ms, the asymptotic value of ωR for high z is more away from zero when the charge of scalar perturbation qs increases. There does not appear the overdamping.

  5. Linear mode stability of the Kerr-Newman black hole and its quasinormal modes.

    PubMed

    Dias, Óscar J C; Godazgar, Mahdi; Santos, Jorge E

    2015-04-17

    We provide strong evidence that, up to 99.999% of extremality, Kerr-Newman black holes (KNBHs) are linear mode stable within Einstein-Maxwell theory. We derive and solve, numerically, a coupled system of two partial differential equations for two gauge invariant fields that describe the most general linear perturbations of a KNBH. We determine the quasinormal mode (QNM) spectrum of the KNBH as a function of its three parameters and find no unstable modes. In addition, we find that the lowest radial overtone QNMs that are connected continuously to the gravitational ℓ=m=2 Schwarzschild QNM dominate the spectrum for all values of the parameter space (m is the azimuthal number of the wave function and ℓ measures the number of nodes along the polar direction). Furthermore, the (lowest radial overtone) QNMs with ℓ=m approach Reω=mΩH(ext) and Imω=0 at extremality; this is a universal property for any field of arbitrary spin |s|≤2 propagating on a KNBH background (ω is the wave frequency and ΩH(ext) the black hole angular velocity at extremality). We compare our results with available perturbative results in the small charge or small rotation regimes and find good agreement.

  6. Application of the confluent Heun functions for finding the quasinormal modes of nonrotating black holes

    NASA Astrophysics Data System (ADS)

    Fiziev, Plamen; Staicova, Denitsa

    2011-12-01

    Although finding numerically the quasinormal modes of a nonrotating black hole is a well-studied question, the physics of the problem is often hidden behind complicated numerical procedures aimed at avoiding the direct solution of the spectral system in this case. In this article, we use the exact analytical solutions of the Regge-Wheeler equation and the Teukolsky radial equation, written in terms of confluent Heun functions. In both cases, we obtain the quasinormal modes numerically from spectral condition written in terms of the Heun functions. The frequencies are compared with ones already published by Andersson and other authors. A new method of studying the branch cuts in the solutions is presented—the epsilon method. In particular, we prove that the mode n=8 is not algebraically special and find its value with more than 6 firm figures of precision for the first time. The stability of that mode is explored using the ɛ method, and the results show that this new method provides a natural way of studying the behavior of the modes around the branch cut points.

  7. Partition functions in even dimensional AdS via quasinormal mode methods

    NASA Astrophysics Data System (ADS)

    Keeler, Cynthia; Ng, Gim Seng

    2014-06-01

    In this note, we calculate the one-loop determinant for a massive scalar (with conformal dimension Δ) in even-dimensional AdS d+1 space, using the quasinormal mode method developed in [1] by Denef, Hartnoll, and Sachdev. Working first in two dimensions on the related Euclidean hyperbolic plane H 2, we find a series of zero modes for negative real values of Δ whose presence indicates a series of poles in the one-loop partition function Z(Δ) in the Δ complex plane; these poles contribute temperature-independent terms to the thermal AdS partition function computed in [1]. Our results match those in a series of papers by Camporesi and Higuchi, as well as Gopakumar et al. [2] and Banerjee et al. [3]. We additionally examine the meaning of these zero modes, finding that they Wick-rotate to quasinormal modes of the AdS2 black hole. They are also interpretable as matrix elements of the discrete series representations of SO(2, 1) in the space of smooth functions on S 1. We generalize our results to general even dimensional AdS2 n , again finding a series of zero modes which are related to discrete series representations of SO(2 n, 1), the motion group of H 2 n .

  8. Analytical treatment of the interaction between light, plasmonic and quantum resonances: quasi-normal mode expansion

    NASA Astrophysics Data System (ADS)

    Perrin, M.; Yang, J.; Lalanne, P.

    2016-02-01

    We summarize here, and detail with numerical examples, the Quasi-Normal Mode theory which has been developed in a recent series of papers dealing with classical and quantum plasmonics. We present the semi-analytical formalism capable of handling the coupling of electromagnetic sources, such as point dipoles or free-propagating fields, with various kinds of dissipative and dispersive resonators. Due to its analyticity, the approach is very intuitive, and very versatile and can be applied to canonical problems of quantum optics and sensing with nanoresonators.

  9. Highly damped quasinormal modes of generic single-horizon black holes

    NASA Astrophysics Data System (ADS)

    Daghigh, Ramin G.; Kunstatter, Gabor

    2005-10-01

    We calculate analytically the highly damped quasinormal mode spectra of generic single-horizon black holes using the rigorous WKB techniques of Andersson and Howls (2004 Class. Quantum Grav. 21 1623). We thereby provide a firm foundation for previous analysis, and point out some of their possible limitations. The numerical coefficient in the real part of the highly damped frequency is generically determined by the behaviour of coupling of the perturbation to the gravitational field near the origin, as expressed in tortoise coordinates. This fact makes it difficult to understand how the famous ln(3) could be related to the quantum gravitational microstates near the horizon.

  10. Quasinormal modes, bifurcations, and nonuniqueness of charged scalar-tensor black holes

    SciTech Connect

    Doneva, Daniela D.; Yazadjiev, Stoytcho S.; Kokkotas, Kostas D.; Stefanov, Ivan Zh.

    2010-09-15

    In the present paper, we study the scalar sector of the quasinormal modes of charged general relativistic, static, and spherically symmetric black holes coupled to nonlinear electrodynamics and embedded in a class of scalar-tensor theories. We find that for a certain domain of the parametric space, there exists unstable quasinormal modes. The presence of instabilities implies the existence of scalar-tensor black holes with primary hair that bifurcate from the embedded general relativistic black-hole solutions at critical values of the parameters corresponding to the static zero modes. We prove that such scalar-tensor black holes really exist by solving the full system of scalar-tensor field equations for the static, spherically symmetric case. The obtained solutions for the hairy black holes are nonunique, and they are in one-to-one correspondence with the bounded states of the potential governing the linear perturbations of the scalar field. The stability of the nonunique hairy black holes is also examined, and we find that the solutions for which the scalar field has zeros are unstable against radial perturbations. The paper ends with a discussion of possible formulations of a new classification conjecture.

  11. Comment on ''Quasinormal modes in Schwarzschild-de Sitter spacetime: A simple derivation of the level spacing of the frequencies''

    SciTech Connect

    Batic, D.; Kelkar, N. G.; Nowakowski, M.

    2011-05-15

    It is shown here that the extraction of quasinormal modes within the first Born approximation of the scattering amplitude is mathematically not well-founded. Indeed, the constraints on the existence of the scattering amplitude integral lead to inequalities for the imaginary parts of the quasinormal mode frequencies. For instance, in the Schwarzschild case, 0{<=}{omega}{sub I}<{kappa} (where {kappa} is the surface gravity at the horizon) invalidates the poles deduced from the first Born approximation method, namely, {omega}{sub n}=in{kappa}.

  12. Quasinormal modes of self-dual warped AdS{sub 3} black hole in topological massive gravity

    SciTech Connect

    Li Ran; Ren Jirong

    2011-03-15

    We consider the scalar, vector and spinor field perturbations in the background of self-dual warped AdS{sub 3} black hole of topological massive gravity. The corresponding exact expressions for quasinormal modes are obtained by analytically solving the perturbation equations and imposing the vanishing Dirichlet boundary condition at asymptotic infinity. It is expected that the quasinormal modes agree with the poles of retarded Green's functions of the CFT dual to self-dual warped AdS{sub 3} black hole. Our results provide a quantitative test of the warped AdS/CFT correspondence.

  13. Quasinormal modes of a massless charged scalar field on a small Reissner-Nordstroem-anti-de Sitter black hole

    SciTech Connect

    Uchikata, Nami; Yoshida, Shijun

    2011-03-15

    We investigate quasinormal modes of a massless charged scalar field on a small Reissner-Nordstroem-anti-de Sitter (RN-AdS) black hole both with analytical and numerical approaches. In the analytical approach, by using the small black hole approximation (r{sub +}<quasinormal mode frequencies in the limit of r{sub +}/L{yields}0, where r{sub +} and L stand for the black hole event horizon radius and the AdS scale, respectively. We then show that the small RN-AdS black hole is unstable if its quasinormal modes satisfy the superradiance condition and that the instability condition of the RN-AdS black hole in the limit of r{sub +}/L{yields}0 is given by Q>(3/eL)Q{sub c}, where Q, Q{sub c}, and e are the charge of the black hole, the critical (maximum) charge of the black hole, and the charge of the scalar field, respectively. In the numerical approach, we calculate the quasinormal modes for the small RN-AdS black holes with r{sub +}<quasinormal modes satisfy the superradiance condition. Our numerical results show that the RN-AdS black holes with r{sub +}=0.2L, 0.1L, and 0.01L become unstable against scalar perturbations with eL=4 when the charge of the black hole satisfies Q > or approx. 0.8Q{sub c}, 0.78Q{sub c}, and 0.76Q{sub c}, respectively.

  14. Maxwell perturbations on asymptotically anti-de Sitter spacetimes: Generic boundary conditions and a new branch of quasinormal modes

    NASA Astrophysics Data System (ADS)

    Wang, Mengjie; Herdeiro, Carlos; Sampaio, Marco O. P.

    2015-12-01

    Perturbations of asymptotically anti-de-Sitter (AdS) spacetimes are often considered by imposing field vanishing boundary conditions (BCs) at the AdS boundary. Such BCs, of Dirichlet-type, imply a vanishing energy flux at the boundary, but the converse is, generically, not true. Regarding AdS as a gravitational box, we consider vanishing energy flux (VEF) BCs as a more fundamental physical requirement and we show that these BCs can lead to a new branch of modes. As a concrete example, we consider Maxwell perturbations on Kerr-AdS black holes in the Teukolsky formalism, but our formulation applies also for other spin fields. Imposing VEF BCs, we find a set of two Robin BCs, even for Schwarzschild-AdS black holes. The Robin BCs on the Teukolsky variables can be used to study quasinormal modes, superradiant instabilities and vector clouds. As a first application, we consider here the quasinormal modes of Schwarzschild-AdS black holes. We find that one of the Robin BCs yields the quasinormal spectrum reported in the literature, while the other one unveils a new branch for the quasinormal spectrum.

  15. Damped and zero-damped quasinormal modes of charged, nearly extremal black holes

    NASA Astrophysics Data System (ADS)

    Zimmerman, Aaron; Mark, Zachary

    2016-02-01

    Despite recent progress, the complete understanding of the perturbations of charged, rotating black holes as described by the Kerr-Newman metric remains an open and fundamental problem in relativity. In this study, we explore the existence of families of quasinormal modes of Kerr-Newman black holes whose decay rates limit to zero at extremality, called zero-damped modes in past studies. We review the nearly extremal and WKB approximation methods for spin-weighted scalar fields (governed by the Dudley-Finley equation) and give an accounting of the regimes where scalar zero-damped and damped modes exist. Using Leaver's continued fraction method, we verify that these approximations give accurate predictions for the frequencies in their regimes of validity. In the nonrotating limit, we argue that gravito-electromagnetic perturbations of nearly extremal Reissner-Nordström black holes have zero-damped modes in addition to the well-known spectrum of damped modes. We provide an analytic formula for the frequencies of these modes, verify their existence using a numerical search, and demonstrate the accuracy of our formula. These results, along with recent numerical studies, point to the existence of a simple universal equation for the frequencies of zero-damped gravito-electromagnetic modes of Kerr-Newman black holes, whose precise form remains an open question.

  16. Reply to "Comment on `Normalization of quasinormal modes in leaky optical cavities and plasmonic resonators' "

    NASA Astrophysics Data System (ADS)

    Kristensen, Philip Trøst; Ge, Rong-Chun; Hughes, Stephen

    2017-07-01

    We refute all claims of the "Comment on `Normalization of quasinormal modes in leaky optical cavities and plasmonic resonators' " by E. A. Muljarov and W. Langbein. Based entirely on information already contained in our original article [P. T. Kristensen, R.-C. Ge, and S. Hughes, Phys. Rev. A 92, 053810 (2015), 10.1103/PhysRevA.92.053810], we dismiss every point of criticism as being unsupported and point out how important parts of our argumentation appear to have been overlooked by the Comment authors. In addition, we provide additional calculations showing directly the connection between the normalizations by Sauvan et al. and Muljarov et al., which were not included in our original article.

  17. Quasinormal mode approach to modelling light-matter interactions in plasmonic-dielectric cavity systems

    NASA Astrophysics Data System (ADS)

    Kamandar Dezfouli, Mohsen; Axelrod, Simon; Wang, Herman M. K.; Helmy, Amr; Gordon, Reuven; Hughes, Stephen

    2016-09-01

    We describe a powerful quasinormal mode (QNM) approach to characterizing the decay properties of quantum emitters in metal-dielectric resonator systems, including hybrid plasmonic-photonic coupled cavities as well as hyperbolic metamaterial resonators. We quantify both the radiative and non-radiative decay rates in these complex structures using these QNMs and a Green function expansion, which yields an excellent agreement with full-dipole calculations of Maxwell's equations. Using this analytical QNM theory, we can map the Purcell factor for the system over a wide range of frequencies and dipole positions. We further show that how individual QNMs of these systems contribute to the underlying physics, whether it is strong interference effects between the sub-systems, in the case of a hybrid structure, or it is a physically meaningful explanation of very low beta factor for single photon emission in the case of hyperbolic metamaterials.

  18. Thermal transport and quasi-normal modes in Gauss-Bonnet-axions theory

    NASA Astrophysics Data System (ADS)

    Kuang, Xiao-Mei; Wu, Jian-Pin

    2017-07-01

    We obtain the black brane solution in arbitrary dimensional Gauss-Bonnet-axions (GBA) gravity theory. And then the thermal conductivity of the boundary theory dual to this neutral black brane is explored. We find that the momentum dissipation suppresses the DC thermal conductivity while it is enhanced by larger GB parameter. The analytical and numerical results of DC thermal conductivity match very well. Also we study the effect of the momentum dissipation and the GB coupling on the AC thermal conductivity and fit the results by Drude-like behavior for low frequency. Finally, we analytical compute the quasi-normal modes (QNM) frequency of the perturbative master field in large dimensions limit. Our analytical QNM frequencies agree well with the numerical results in large enough finite dimensions.

  19. Partition functions with spin in AdS2 via quasinormal mode methods

    NASA Astrophysics Data System (ADS)

    Keeler, Cynthia; Lisbão, Pedro; Ng, Gim Seng

    2016-10-01

    We extend the results of [1], computing one loop partition functions for massive fields with spin half in AdS2 using the quasinormal mode method proposed by Denef, Hartnoll, and Sachdev [2]. We find the finite representations of SO(2, 1) for spin zero and spin half, consisting of a highest weight state | h> and descendants with non-unitary values of h. These finite representations capture the poles and zeroes of the one loop determinants. Together with the asymptotic behavior of the partition functions (which can be easily computed using a large mass heat kernel expansion), these are sufficient to determine the full answer for the one loop determinants. We also discuss extensions to higher dimensional AdS2 n and higher spins.

  20. The Derivation and Quasinormal Mode Spectrum of Acoustic Anti-de Sitter Black Hole Analogues

    NASA Astrophysics Data System (ADS)

    Babb, James Patrick

    Dumb holes (also known as acoustic black holes) are fluid flows which include an "acoustic horizon": a surface, analogous to a gravitational horizon, beyond which sound may pass but never classically return. Soundwaves in these flows will therefore experience "effective geometries" which are identical to black hole spacetimes up to a conformal factor. By adjusting the parameters of the fluid flow, it is possible to create an effective geometry which is conformal to the Anti-de Sitter black hole spacetime---a geometry which has received a great deal of attention in recent years due to its conjectured holographic duality to Conformal Field Theories. While we would not expect an acoustic analogue of the AdS-CFT correspondence to exist, this dumb hole provides a means, at least in principle, of experimentally testing the theoretical properties of the AdS spacetime. In particular, I have calculated the quasinormal mode spectrum of this acoustic geometry.

  1. Phase transition of charged-AdS black holes and quasinormal modes: A time domain analysis

    NASA Astrophysics Data System (ADS)

    Chabab, M.; El Moumni, H.; Iraoui, S.; Masmar, K.

    2017-10-01

    In this work, we investigate the time evolution of a massless scalar perturbation around small and large RN-AdS4 black holes for the purpose of probing the thermodynamic phase transition. We show that below the critical point the scalar perturbation decays faster with increasing of the black hole size, both for small and large black hole phases. Our analysis of the time profile of quasinormal mode reveals a sharp distinction between the behaviors of both phases, providing a reliable tool to probe the black hole phase transition. However at the critical point P=Pc, as the black hole size extends, we note that the damping time increases and the perturbation decays faster, the oscillation frequencies raise either in small and large black hole phase. In this case the time evolution approach fails to track the AdS4 black hole phase.

  2. Maxwell perturbations on Kerr-anti-de Sitter: quasinormal modes, superradiant instabilities and vector clouds

    NASA Astrophysics Data System (ADS)

    Wang, Mengjie; Herdeiro, Carlos

    2015-12-01

    Scalar and gravitational perturbations on Kerr-anti-de Sitter (Kerr-AdS) black holes have been addressed in the literature and have been shown to exhibit a rich phenomenology. In this paper we complete the analysis of bosonic fields on this background by studying Maxwell perturbations, focusing on superradiant instabilities and vector clouds. For this purpose, we solve the Teukolsky equations numerically, imposing the boundary conditions we have proposed in\\cite{Wang:2015goa} for the radial Teukolsky equation. As found therein, two Robin boundary conditions can be imposed for Maxwell fields on Kerr-AdS black holes, one of which produces a new set of quasinormal modes even for Schwarzschild-AdS black holes. Here, we show these different boundary conditions produce two different sets of superradiant modes. Interestingly the "new modes" may be unstable in a larger parameter space. We then study stationary Maxwell clouds, that exist at the threshold of the superradiant instability, with the two Robin boundary conditions. These clouds, obtained at the linear level, indicate the existence of a new family of black hole solutions at the nonlinear level, within the Einstein-Maxwell-AdS system, branching off from the Kerr-Newman-AdS family. As a comparison with the Maxwell clouds, scalar clouds on Kerr-AdS black holes are also studied, and it is shown there are Kerr-AdS black holes that are stable against scalar, but not vector modes, with the same "quantum numbers".

  3. Analytical description of quasi-normal mode in resonant plasmonic nano cavities

    NASA Astrophysics Data System (ADS)

    Yang, Fan; Liu, Haitao; Jia, Hongwei; Zhong, Ying

    2016-03-01

    We propose an analytical model of quasi-normal mode (QNM) for resonant plasmonic nano cavities formed by sub wavelength grooves in metallic substrate. The QNM has shown great advantages in understanding and calculating the frequency response of resonant nano-structures. With our model we show that the QNM originates from a resonance of the fundamental mode in every individual groove and its interaction via surface waves. Analytical expression for the complex eigenfrequency as well as the field distribution of the QNM can be derived from the model. With the analytical model and a few assumptions on the scattered field, the legitimacy of the expansion of scattered field with QNMs under external illuminations is justified with the Mittag-Leffler's theorem of meromorphic function. The expansion coefficients of QNMs are analytically expressed with a finite set of elementary scattering coefficients, which avoids the calculation of the mode volume of QNMs that have a spatial divergence at infinity. The model clarifies the physical origin of QNMs and drastically reduces the computational load of QNMs, especially for a large ensemble of grooves for which brute-force numerical tools are not available. The validity of the proposed model is tested against fully vectorial numerical results.

  4. A matrix method for quasinormal modes: Schwarzschild black holes in asymptotically flat and (anti-) de Sitter spacetimes

    NASA Astrophysics Data System (ADS)

    Lin, Kai; Qian, Wei-Liang

    2017-05-01

    In this work, we study the quasinormal modes of Schwarzschild and Schwarzschild (Anti-) de Sitter black holes by a matrix method. The proposed method involves discretizing the master field equation and expressing it in the form of a homogeneous system of linear algebraic equations. The resulting homogeneous matrix equation furnishes a non-standard eigenvalue problem, which can then be solved numerically to obtain the quasinormal frequencies. A key feature of the present approach is that the discretization of the wave function and its derivatives is made to be independent of any specific metric through coordinate transformation. In many cases, it can be carried out beforehand, which in turn improves the efficiency and facilitates the numerical implementation. We also analyze the precision and efficiency of the present method as well as compare the results to those obtained by different approaches.

  5. Quasinormal Modes of Charged Dilaton Black Holes and Their Entropy Spectra

    NASA Astrophysics Data System (ADS)

    Sakalli, I.

    2013-08-01

    In this study, we employ the scalar perturbations of the charged dilaton black hole (CDBH) found by Chan, Horne and Mann (CHM), and described with an action which emerges in the low-energy limit of the string theory. A CDBH is neither asymptotically flat (AF) nor non-asymptotically flat (NAF) spacetime. Depending on the value of its dilaton parameter a, it has both Schwarzschild and linear dilaton black hole (LDBH) limits. We compute the complex frequencies of the quasinormal modes (QNMs) of the CDBH by considering small perturbations around its horizon. By using the highly damped QNM in the process prescribed by Maggiore, we obtain the quantum entropy and area spectra of these black holes (BHs). Although the QNM frequencies are tuned by a, we show that the quantum spectra do not depend on a, and they are equally spaced. On the other hand, the obtained value of undetermined dimensionless constant ɛ is the double of Bekenstein's result. The possible reason of this discrepancy is also discussed.

  6. Quasinormal modes as a distinguisher between general relativity and f (R ) gravity

    NASA Astrophysics Data System (ADS)

    Bhattacharyya, Soham; Shankaranarayanan, S.

    2017-09-01

    Quasinormal modes (QNMs) or the ringdown phase of gravitational waves provide critical information about the structure of compact objects like black holes. Thus, QNMs can be a tool to test general relativity (GR) and possible deviations from it. In the case of GR, it has been known for a long time that a relation between two types of black hole perturbations—scalar (Zerilli) and vector (Regge-Wheeler)—leads to an equal share of emitted gravitational energy. With the direct detection of gravitational waves, it is now natural to ask whether the same relation (between scalar and vector perturbations) holds for modified gravity theories, and if not, whether one can use this as a way to probe deviations from general relativity. As a first step, we show explicitly that the above relation between Regge-Wheeler and Zerilli perturbations breaks down for a general f (R ) model and hence the two perturbations do not share equal amounts of emitted gravitational energy. We discuss the implication of this imbalance for observations and the no-hair conjecture.

  7. Existence of Quasinormal Modes for Kerr-AdS Black Holes

    NASA Astrophysics Data System (ADS)

    Gannot, Oran

    2017-08-01

    This paper establishes the existence of quasinormal frequencies converging exponentially to the real axis for the Klein--Gordon equation on a Kerr-AdS spacetime when Dirichlet boundary conditions are imposed at the conformal boundary. The proof is adapted from results in Euclidean scattering about the existence of scattering poles generated by time-periodic approximate solutions to the wave equation.

  8. Quasinormal modes and holographic correlators in a crunching AdS geometry

    NASA Astrophysics Data System (ADS)

    Kumar, S. Prem; Vaganov, Vladislav

    2016-02-01

    We calculate frequency space holographic correlators in an asymptotically AdS crunching background, dual to a relevant deformation of the M2-brane CFT placed in de Sitter spacetime. For massless bulk scalars, exploiting the connection to a solvable supersymmetric quantum mechanical problem, we obtain the exact frequency space correlator for the dual operator in the deformed CFT. Controlling the shape of the crunching surface in the Penrose diagram by smoothly dialling the deformation from zero to infinity, we observe that in the large deformation limit the Penrose diagram becomes a `square', and the exact holographic correlators display striking similarities to their counterparts in the BTZ black hole and its higher dimensional generalisations. We numerically determine quasinormal poles for relevant and irrelevant operators, and find an intricate pattern of these in the complex frequency plane. In the case of relevant operators, the deformation parameter has an infinite sequence of critical values, each one characterised by a pair of poles colliding and moving away from the imaginary frequency axis with increasing deformation. In the limit of infinite deformation all scalar operators have identical quasinormal spectra. We compare and contrast our strongly coupled de Sitter QFT results with strongly coupled thermal correlators from AdS black holes.

  9. Semianalytical quasi-normal mode theory for the local density of states in coupled photonic crystal cavity-waveguide structures.

    PubMed

    de Lasson, Jakob Rosenkrantz; Kristensen, Philip Trøst; Mørk, Jesper; Gregersen, Niels

    2015-12-15

    We present and validate a semianalytical quasi-normal mode (QNM) theory for the local density of states (LDOS) in coupled photonic crystal (PhC) cavity-waveguide structures. By means of an expansion of the Green's function on one or a few QNMs, a closed-form expression for the LDOS is obtained, and for two types of two-dimensional PhCs, with one and two cavities side-coupled to an extended waveguide, the theory is validated against numerically exact computations. For the single cavity, a slightly asymmetric spectrum is found, which the QNM theory reproduces, and for two cavities, a nontrivial spectrum with a peak and a dip is found, which is reproduced only when including both the two relevant QNMs in the theory. In both cases, we find relative errors below 1% in the bandwidth of interest.

  10. Quasinormal modes and thermodynamics of linearly charged BTZ black holes in massive gravity in (anti) de Sitter space-time

    NASA Astrophysics Data System (ADS)

    Prasia, P.; Kuriakose, V. C.

    2017-01-01

    In this work we study the Quasi-Normal Modes (QNMs) under massless scalar perturbations and the thermodynamics of linearly charged BTZ black holes in massive gravity in the (Anti)de Sitter ((A)dS) space-time. It is found that the behavior of QNMs changes with the massive parameter of the graviton and also with the charge of the black hole. The thermodynamics of such black holes in the (A)dS space-time is also analyzed in detail. The behavior of specific heat with temperature for such black holes gives an indication of a phase transition that depends on the massive parameter of the graviton and also on the charge of the black hole.

  11. Gravitational wave quasinormal mode from Population III massive black hole binaries in various models of population synthesis

    NASA Astrophysics Data System (ADS)

    Kinugawa, Tomoya; Nakano, Hiroyuki; Nakamura, Takashi

    2016-10-01

    Focusing on the remnant black holes after merging binary black holes, we show that ringdown gravitational waves of Population III binary black hole mergers can be detected at the rate of 5.9-500 events yr(SFR/(10M yr Mpc))ṡ([f/(1+f)]/0.33) for various parameters and functions. This rate is estimated for events with SNR>8 for second-generation gravitational wave detectors such as KAGRA. Here, SFR and f are the peak value of the Population III star formation rate and the fraction of binaries, respectively. When we consider only events with SNR>35, the event rate becomes 0.046-4.21 events yr(SFR/(10M yr Mpc))ṡ([f/(1+f)]/0.33). This suggest that for a remnant black hole spin of q>0.95 we have an event rate of quasinormal modes with SNR>35 of less than 0.037 events yr(SFR/(10M yr Mpc))ṡ([f/(1+f)]/0.33), while it is 3-30 events yr(SFR/(10M yr Mpc))ṡ([f/(1+f)]/0.33) for third-generation detectors such as the Einstein Telescope. If we detect many Population III binary black hole mergers, it may be possible to constrain the Population III binary evolution paths not only by the mass distribution but also by the spin distribution.

  12. Waveforms produced by a scalar point particle plunging into a Schwarzschild black hole: Excitation of quasinormal modes and quasibound states

    NASA Astrophysics Data System (ADS)

    Décanini, Yves; Folacci, Antoine; Ould El Hadj, Mohamed

    2015-07-01

    With the possibility of testing massive gravity in the context of black hole physics in mind, we consider the radiation produced by a particle plunging from slightly below the innermost stable circular orbit into a Schwarzschild black hole. In order to circumvent the difficulties associated with black hole perturbation theory in massive gravity, we use a toy model in which we replace the graviton field with a massive scalar field and consider a linear coupling between the particle and this field. We compute the waveform generated by the plunging particle and study its spectral content. This permits us to highlight and interpret some important effects occurring in the plunge regime which are not present for massless fields, such as (i) the decreasing and vanishing, as the mass parameter increases, of the signal amplitude generated when the particle moves on quasicircular orbits near the innermost stable circular orbit; and (ii) in addition to the excitation of the quasinormal modes, the excitation of the quasibound states of the black hole.

  13. Behavior of quasinormal modes and Van der Waals-like phase transition of charged AdS black holes in massive gravity

    NASA Astrophysics Data System (ADS)

    Zou, De-Cheng; Liu, Yunqi; Yue, Ruihong

    2017-06-01

    In this work, we utilize the quasinormal modes (QNMs) of a massless scalar perturbation to probe the Van der Waals-like small and large black holes (SBH/LBH) phase transition of charged topological Anti-de Sitter (AdS) black holes in four-dimensional massive gravity. We find that the signature of this SBH/LBH phase transition is detected in the isobaric as well as in the isothermal process. This further supports the idea that the QNMs can be an efficient tool to investigate the thermodynamical phase transition.

  14. Quantum dynamics of two quantum dots coupled through localized plasmons: An intuitive and accurate quantum optics approach using quasinormal modes

    NASA Astrophysics Data System (ADS)

    Ge, Rong-Chun; Hughes, Stephen

    2015-11-01

    We study the quantum dynamics of two quantum dots (QDs) or artificial atoms coupled through the fundamental localized plasmon of a gold nanorod resonator. We derive an intuitive and efficient time-local master equation, in which the effect of the metal nanorod is taken into consideration self-consistently using a quasinormal mode (QNM) expansion technique of the photon Green function. Our efficient QNM technique offers an alternative and more powerful approach over the standard Jaynes-Cummings model, where the radiative decay, nonradiative decay, and spectral reshaping effect of the electromagnetic environment is rigorously included in a clear and transparent way. We also show how one can use our approach to compliment the approximate Jaynes-Cummings model in certain spatial regimes where it is deemed to be valid. We then present a study of the quantum dynamics and photoluminescence spectra of the two plasmon-coupled QDs. We first explore the non-Markovian regime, which is found to be important only on the ultrashort time scale of the plasmon mode which is about 40 fs. For the field free evolution case of excited QDs near the nanorod, we demonstrate how spatially separated QDs can be effectively coupled through the plasmon resonance and we show how frequencies away from the plasmon resonance can be more effective for coherently coupling the QDs. Despite the strong inherent dissipation of gold nanoresonators, we show that qubit entanglements as large as 0.7 can be achieved from an initially separate state, which has been limited to less than 0.5 in previous work for weakly coupled reservoirs. We also study the superradiance and subradiance decay dynamics of the QD pair. Finally, we investigate the rich quantum dynamics of QDs that are incoherently pumped, and study the polarization dependent behavior of the emitted photoluminescence spectrum where a double-resonance structure is observed due to the strong photon exchange interactions. Our general quantum plasmonics

  15. Quasinormal modes of a scalar field in the Einstein-Gauss-Bonnet-AdS black hole background: Perturbative and nonperturbative branches

    NASA Astrophysics Data System (ADS)

    González, P. A.; Konoplya, R. A.; Vásquez, Yerko

    2017-06-01

    It has recently been found that quasinormal modes of asymptotically anti-de Sitter (AdS) black holes in theories with higher curvature corrections may help to describe the regime of intermediate 't Hooft coupling in the dual field theory. Here, we consider quasinormal modes of a scalar field in the background of spherical Gauss-Bonnet-anti-de Sitter (AdS) black holes. In general, the eigenvalues of wave equations are found here numerically, but at a fixed Gauss-Bonnet constant α =R2/2 (where R is the AdS radius), an exact solution of the scalar field equation has been obtained. Remarkably, the purely imaginary modes, which are usually appropriate only to some gravitational perturbations, were found here even for a test scalar field. These purely imaginary modes of the Einstein-Gauss-Bonnet theory do not have the Einsteinian limits, because their damping rates grow, when α is decreasing. Thus, these modes are nonperturbative in α . The real oscillation frequencies of the perturbative branch are linearly related to their Schwarzschild-AdS limits Re (ωG B)=Re (ωSAdS)(1 +K (D )(α /R2)) , where D is the number of spacetime dimensions. Comparison of the analytical formula with the frequencies found by the shooting method allows us to test the latter. In addition, we found exact solutions to the master equations for gravitational perturbations at α =R2/2 and observed that for the scalar type of gravitational perturbations an eikonal instability develops.

  16. Merger of binary neutron stars to a black hole: Disk mass, short gamma-ray bursts, and quasinormal mode ringing

    SciTech Connect

    Shibata, Masaru; Taniguchi, Keisuke

    2006-03-15

    hypermassive neutron star, quasiperiodic gravitational waves of frequency between 3 and 3.5 kHz are emitted irrespective of EOSs. The effective amplitude of gravitational waves can be > or approx. 5x10{sup -21} at a distance of 50 Mpc, and hence, it may be detected by advanced laser-interferometers. For the black hole formation case, the black hole excision technique enables a long-term computation and extraction of ring-down gravitational waves associated with a black hole quasinormal mode. It is found that the frequency and amplitude are {approx_equal}6.5-7 kHz and {approx}10{sup -22} at a distance of 50 Mpc for the binary of mass M{approx_equal}2.7-2.9M{sub {center_dot}}.

  17. Non-extremal Reissner-Nordström black hole: do asymptotic quasi-normal modes carry information about the quantum properties of the black hole?

    NASA Astrophysics Data System (ADS)

    Skákala, Jozef

    2012-01-01

    We analyze the largely accepted formulas for the asymptotic quasi-normal frequencies of the non-extremal Reissner-Nordström black hole, (for the electromagnetic-gravitational/scalar perturbations). We focus on the question of whether the gap in the spacing in the imaginary part of the QNM frequencies has a well defined limit as n goes to infinity and if so, what is the value of the limit. The existence and the value of this limit has a crucial importance from the point of view of the currently popular Maggiore's conjecture, which represents a way of connecting the asymptotic behavior of the quasi-normal frequencies to the black hole thermodynamics. With the help of previous results and insights we will prove that the gap in the imaginary part of the frequencies does not converge to any limit, unless one puts specific constraints on the ratio of the two surface gravities related to the two spacetime horizons. Specifically the constraints are that the ratio of the surface gravities must be rational and such that it is given by two relatively prime integers n ± whose product is an even number. If the constraints are fulfilled the limit of the sequence is still not guaranteed to exist, but if it exists its value is given as the lowest common multiplier of the two surface gravities. At the end of the paper we discuss the possible implications of our results.

  18. Quasinormal ringing on the brane

    NASA Astrophysics Data System (ADS)

    Chung, Hyeyoun; Randall, Lisa; Rodriguez, Maria J.; Varela, Oscar

    2016-12-01

    While the linear behavior of gravity in braneworld models is well understood, much less is known about full nonlinear gravitational effects. Even when they agree at the linear level, these could be expected to distinguish braneworlds from a lower-dimensional theory with no brane. Black holes are a good testing ground for such studies, as they are nonlinear solutions that would be expected to reflect the background geometry. In particular, we assess the role of black hole quasinormal modes (QNMs) in gravitational experiments devised to be sensitive to the existence of the brane, in a lower-dimensional setting where we have analytical control. We compute QNMs of brane-localized black holes and find that they follow the entropy of the corresponding black hole. This observation allows us to conclude that, surprisingly, the scattering problem we consider, at least in some regimes, does not distinguish between nonlinear gravitational effects of black holes in AdS space with a brane and black holes in a spacetime of one lower dimension.

  19. Quasi-normal frequencies: key analytic results

    NASA Astrophysics Data System (ADS)

    Boonserm, Petarpa; Visser, Matt

    2011-03-01

    The study of exact quasi-normal modes [QNMs], and their associated quasi-normal frequencies [QNFs], has had a long and convoluted history — replete with many rediscoveries of previously known results. In this article we shall collect and survey a number of known analytic results, and develop several new analytic results — specifically we shall provide several new QNF results and estimates, in a form amenable for comparison with the extant literature. Apart from their intrinsic interest, these exact and approximate results serve as a backdrop and a consistency check on ongoing efforts to find general model-independent estimates for QNFs, and general model-independent bounds on transmission probabilities. Our calculations also provide yet another physics application of the Lambert W function. These ideas have relevance to fields as diverse as black hole physics, (where they are related to the damped oscillations of astrophysical black holes, to greybody factors for the Hawking radiation, and to more speculative state-counting models for the Bekenstein entropy), to quantum field theory (where they are related to Casimir energies in unbounded systems), through to condensed matter physics, (where one may literally be interested in an electron tunnelling through a physical barrier).

  20. Quasinormal ringing of acoustic black holes in Laval nozzles: Numerical simulations

    NASA Astrophysics Data System (ADS)

    Okuzumi, Satoshi; Sakagami, Masa-Aki

    2007-10-01

    Quasinormal ringing of acoustic black holes in Laval nozzles is discussed. The equation for sounds in a transonic flow is written into a Schrödinger-type equation with a potential barrier, and the quasinormal frequencies are calculated semianalytically. From the results of numerical simulations, it is shown that the quasinormal modes are actually excited when the transonic flow is formed or slightly perturbed, as well as in the real black hole case. In an actual experiment, however, the purely-outgoing boundary condition will not be satisfied at late times due to the wave reflection at the end of the apparatus, and a late-time ringing will be expressed as a superposition of boxed quasinormal modes. It is shown that the late-time ringing damps more slowly than the ordinary quasinormal ringing, while its central frequency is not greatly different from that of the ordinary one. Using this fact, an efficient way for experimentally detecting the quasinormal ringing of an acoustic black hole is discussed.

  1. Quasinormal ringing of acoustic black holes in Laval nozzles: Numerical simulations

    SciTech Connect

    Okuzumi, Satoshi; Sakagami, Masa-aki

    2007-10-15

    Quasinormal ringing of acoustic black holes in Laval nozzles is discussed. The equation for sounds in a transonic flow is written into a Schroedinger-type equation with a potential barrier, and the quasinormal frequencies are calculated semianalytically. From the results of numerical simulations, it is shown that the quasinormal modes are actually excited when the transonic flow is formed or slightly perturbed, as well as in the real black hole case. In an actual experiment, however, the purely-outgoing boundary condition will not be satisfied at late times due to the wave reflection at the end of the apparatus, and a late-time ringing will be expressed as a superposition of boxed quasinormal modes. It is shown that the late-time ringing damps more slowly than the ordinary quasinormal ringing, while its central frequency is not greatly different from that of the ordinary one. Using this fact, an efficient way for experimentally detecting the quasinormal ringing of an acoustic black hole is discussed.

  2. Mode-by-mode optical feedback: cavity ringdown spectroscopy

    NASA Astrophysics Data System (ADS)

    Motto-Ros, V.; Morville, J.; Rairoux, P.

    2007-05-01

    We describe a new continuous wave cavity ringdown spectroscopy (cw-CRDS) approach using an extended cavity diode laser (ECDL) optically self-locked to a high finesse cavity including an intracavity glass plate under the Brewster angle. Low noise, mode-by-mode absorption spectra are recorded at a high acquisition rate (laser frequency scan greater than 400 GHz/s) and covering four orders of magnitude in absorption coefficient. Sampling spectra with the fixed high finesse cavity frequency comb provides high precision frequency markers. An original scheme for the laser beam shut-down, based on signal shape analysis and the diode laser injection current control, is presented. This scheme avoids any supplementary switching device. To retrieve ringdown processing at a kilohertz rate several exponential decay fit algorithms are compared. Performances of this new scheme are demonstrated with the observation of very weak lines of the oxygen B-band around 680 nm. Atmospheric spectra of isolated lines averaged for less than 10 s show a baseline noise of 5×10-10 cm-1 and a single point minimum detectable absorption loss over a one-second measurement interval of 2×10-10 cm/sqrt{text{Hz}} is obtained.

  3. Mode identification from spectroscopy of gravity-mode pulsators

    NASA Astrophysics Data System (ADS)

    Pollard, K. R.; Brunsden, E.; Cottrell, P. L.; Davie, M.; Greenwood, A.; Wright, D. J.; De Cat, P.

    2014-02-01

    The gravity modes present in γ Doradus stars probe the deep stellar interiors and are thus of particular interest in asteroseismology. For the MUSICIAN programme at the University of Canterbury, we obtain extensive high-resolution echelle spectra of γ Dor stars from the Mt John University Observatory in New Zealand. We analyze these to obtain the pulsational frequencies and identify these with the multiple pulsational modes excited in the star. A summary of recent results from our spectroscopic mode-identification programme is given.

  4. Black Hole Spectroscopy with Coherent Mode Stacking

    NASA Astrophysics Data System (ADS)

    Yang, Huan; Yagi, Kent; Blackman, Jonathan; Lehner, Luis; Paschalidis, Vasileios; Pretorius, Frans; Yunes, Nicolás

    2017-04-01

    The measurement of multiple ringdown modes in gravitational waves from binary black hole mergers will allow for testing the fundamental properties of black holes in general relativity and to constrain modified theories of gravity. To enhance the ability of Advanced LIGO/Virgo to perform such tasks, we propose a coherent mode stacking method to search for a chosen target mode within a collection of multiple merger events. We first rescale each signal so that the target mode in each of them has the same frequency and then sum the waveforms constructively. A crucial element to realize this coherent superposition is to make use of a priori information extracted from the inspiral-merger phase of each event. To illustrate the method, we perform a study with simulated events targeting the ℓ=m =3 ringdown mode of the remnant black holes. We show that this method can significantly boost the signal-to-noise ratio of the collective target mode compared to that of the single loudest event. Using current estimates of merger rates, we show that it is likely that advanced-era detectors can measure this collective ringdown mode with one year of coincident data gathered at design sensitivity.

  5. Black Hole Spectroscopy with Coherent Mode Stacking.

    PubMed

    Yang, Huan; Yagi, Kent; Blackman, Jonathan; Lehner, Luis; Paschalidis, Vasileios; Pretorius, Frans; Yunes, Nicolás

    2017-04-21

    The measurement of multiple ringdown modes in gravitational waves from binary black hole mergers will allow for testing the fundamental properties of black holes in general relativity and to constrain modified theories of gravity. To enhance the ability of Advanced LIGO/Virgo to perform such tasks, we propose a coherent mode stacking method to search for a chosen target mode within a collection of multiple merger events. We first rescale each signal so that the target mode in each of them has the same frequency and then sum the waveforms constructively. A crucial element to realize this coherent superposition is to make use of a priori information extracted from the inspiral-merger phase of each event. To illustrate the method, we perform a study with simulated events targeting the ℓ=m=3 ringdown mode of the remnant black holes. We show that this method can significantly boost the signal-to-noise ratio of the collective target mode compared to that of the single loudest event. Using current estimates of merger rates, we show that it is likely that advanced-era detectors can measure this collective ringdown mode with one year of coincident data gathered at design sensitivity.

  6. Mode Selective Excitation Using Coherent Control Spectroscopy

    SciTech Connect

    Singh, Ajay K.; Konradi, Jakow; Materny, Arnulf; Sarkar, Sisir K.

    2008-11-14

    Femtosecond time-resolved coherent anti-Stokes Raman scattering (fs-CARS) gives access to ultrafast molecular dynamics. However, femtosecond laser pulses are spectrally broad and therefore coherently excite several molecular modes. While the temporal resolution is high, usually no mode-selective excitation is possible. This paper demonstrates the feasibility of selectively exciting specific molecular vibrations in solution phase with shaped fs laser excitation using a feedback-controlled optimization technique guided by an evolutionary algorithm. This approach is also used to obtain molecule-specific CARS spectra from a mixture of different substances. The optimized phase structures of the fs pulses are characterized to get insight into the control process. Possible applications of the spectrum control are discussed.

  7. Echelle Spectroscopy of Double-Mode Cepheids

    NASA Astrophysics Data System (ADS)

    Sziládi, K.; Vinkó, J.; Poretti, E.; Szabados, L.; Kun, M.

    2006-04-01

    We have obtained high-resolution (R ˜ 48000) spectra of thirteen southern double-mode Cepheids using the FEROS spectrograph at the 2.20-m telescope on La Silla with a signal-to-noise ratio of about 200 to 350. The aim of the project is to specify physical parameters (chemical abundance, gravity and temperature) and evolutionary status of beat Cepheids. We present the method of the detailed spectroscopic investigation and its application to EY Car. We intend to refine the existing period ratio -- metallicity relations. This new calibration may allow us to determine whether metallicities smaller than the solar value are the actual reasons for the observed period ratios of the galactic Cepheids.

  8. Quasinormal ringing of Kerr black holes. II. Excitation by particles falling radially with arbitrary energy

    NASA Astrophysics Data System (ADS)

    Zhang, Zhongyang; Berti, Emanuele; Cardoso, Vitor

    2013-08-01

    The analytical understanding of quasinormal mode ringing requires an accurate knowledge of the Green’s function describing the response of the black hole to external perturbations. We carry out a comprehensive study of quasinormal mode excitation for Kerr black holes. Relying on the formalism developed by Mano, Suzuki, and Takasugi, we improve and extend previous calculations of the quasinormal mode residues in the complex frequency plane (“excitation factors Bq”). Using these results we compute the “excitation coefficients” Cq (essentially the mode amplitudes) in the special case where the source of the perturbations is a particle falling into the black hole along the symmetry axis. We compare this calculation with numerical integrations of the perturbation equations, and we show quantitatively how the addition of higher overtones improves the agreement with the numerical waveforms. Our results should find applications in models of the ringdown stage and in the construction of semianalytical template banks for gravitational-wave detectors, especially for binaries with large mass ratios and/or fast-spinning black holes.

  9. Massive vector field perturbations in the Schwarzschild background: Stability and quasinormal spectrum

    SciTech Connect

    Konoplya, R. A.

    2006-01-15

    We consider the perturbations of the massive vector field around Schwarzschild, Schwarzschild-de Sitter, and Schwarzschild-anti-de Sitter black holes. Equations for a spherically symmetric massive vector perturbation can be reduced to a single wavelike equation. We have proved the stability against these perturbations and investigated the quasinormal spectrum. The quasinormal behavior for Schwarzschild black hole is quite unexpected: the fundamental mode and higher overtones show totally different dependence on the mass of the field m: as m is increasing, the damping rate of the fundamental mode is decreasing, what results in appearing of the infinitely long living modes, while, on the contrary, damping rate of all higher overtones are increasing, and their real oscillation frequencies gradually go to tiny values. Thereby, for all higher overtones, almost nonoscillatory, damping modes can exist. In the limit of asymptotically high damping, Re{omega} goes to ln3/(8{pi}M), while imaginary part shows equidistant behavior with spacing Im{omega}{sub n+1}-Im{omega}{sub n}=1/4M. In addition, we have found quasinormal spectrum of massive vector field for Schwarzschild-anti-de Sitter black hole.

  10. Whispering Gallery Mode Spectroscopy as a Diagnostic for Dusty Plasmas

    SciTech Connect

    Thieme, G.; Basner, R.; Ehlbeck, J.; Roepcke, J.; Maurer, H.; Kersten, H.; Davies, P. B.

    2008-09-07

    Whispering-gallery-mode spectroscopy is being assessed as a diagnostic method for the characterisation of size and chemical composition of spherical particles levitated in a plasma. With a pulsed laser whispering gallery modes (cavity resonances) are excited in individual microspheres leading to enhanced Raman scattering or fluorescence at characteristic wavelengths. This method can be used to gain specific information from the particle surface and is thus of great interest for the characterisation of layers deposited on microparticles, e.g. in molecular plasmas. We present investigations of different microparticles in air and results from fluorescent particles levitated in an Argon rf plasma.

  11. Multi-mode heterodyned 5th-order infrared spectroscopy

    NASA Astrophysics Data System (ADS)

    Leger, Joel D.; Varner, Clyde; Rubtsov, Igor V.

    2016-10-01

    Fifth-order multidimensional infrared spectroscopy with heterodyned detection was carried out in the three-beam dual-frequency configuration. Numerous 5th-order cross peaks were detected for the 4-azidobutyrate-N-hydroxysuccinimide ester compound in solution involving several vibrational modes ranging in frequency from 1045 to 2100 cm-1. Cross peaks involving overtones (2X/Z) and combination bands (XY/Z) among the tags, modes X and Y excited by the first two mid-IR laser pulses, and the reporter, modes Z excited by the third laser pulse, were acquired and the factors affecting the amplitude of 5th-order cross peaks are discussed. The 5th-order cross peaks were detected among modes that are spatially close (a few bonds apart) as well as for modes spatially separated by ca. 12 Å (eight bonds apart). In both cases, the waiting time dependences for the 3rd and 5th order cross peaks were found to be different. In particular, the waiting time at which the cross-peak maximum is reached, the decay time, and the value of a plateau at large waiting times were all differing strongly. The differences are explained by reduced sensitivity of the 5th-order signals to modes coupled weakly to the reporter mode and different relaxation dynamics involving overtone state of the tag. The ability of the 5th-order peaks to single out the modes coupled strongly to the reporter can help identifying specific energy relaxation and transport pathways, which will be useful for understanding energy transport dynamics in molecules. The absorptive 5th-order cross peaks were constructed which report on three-point correlation functions. It is shown that in addition to the triple-frequency correlation functions, a correlation of the frequencies with the mode coupling (anharmonicity) can be naturally measured by the 5th-order spectroscopy. The current limit for detecting 5th-order signals was estimated at the level of 1 × 10-3 in reduced anharmonicity, which is determined by the corresponding two

  12. Ultrafast terahertz spectroscopy and control of collective modes in semiconductors

    NASA Astrophysics Data System (ADS)

    Seletskiy, Denis V.

    In this dissertation we applied methods of ultrafast terahertz (THz) spectroscopy to study several aspects of semiconductor physics and in particular of collective mode excitations in semiconductors. We detect and analyze THz radiation emitted by these collective modes to reveal the underlying physics of many-body interactions. We review a design, implementation and characterization of our ultrafast terahertz (THz) time-domain spectroscopy setup, with additional features of mid-infrared tunability and coherent as well as incoherent detection capabilities. Temperature characterization of the collective plasmon excitation in indium antimonide (InSb) is presented to reveal the importance of non-parabolicity corrections in quantitative description. We also obtain electronic mobility from the radiation signals, which, once corrected for ultrafast scattering mechanisms, is in good agreement with DC Hall mobility measurements. Exhibited sensitivity to non-parabolicity and electronic mobility is applicable to non-contact characterization of electronic transport in nanostructures. As a first goal of this work, we have addressed the possibility of an all-optical control of the electronic properties of condensed matter systems on an ultrafast time scale. Using femtosecond pulses we have demonstrated an ability to impose a nearly 20% blue-shift of the plasma frequency in InSb. Preliminary investigations of coherent control of the electron dynamics using third-order nonlinearity were also carried out in solid state and gaseous media. In particular, we have experimentally verified the THz coherent control in air-breakdown plasmas and have demonstrated the ability to induce quantum-interference current control in indium arsenide crystals. As a second focus of this dissertation, we have addressed manipulation of the plasmon modes in condensed matter systems. After development of the analytical model of radiation from spatially extended longitudinal modes, we have applied it to

  13. Macromolecule Biosynthesis Assay and Fluorescence Spectroscopy Methods to Explore Antimicrobial Peptide Mode(s) of Action.

    PubMed

    Jana, Bimal; Baker, Kristin Renee; Guardabassi, Luca

    2017-01-01

    Antimicrobial peptides (AMPs) are viable alternatives to the currently available antimicrobials, and numerous studies have investigated their possible use as therapeutic agents for specific clinical applications. AMPs are a diverse class of antimicrobials that often act upon the bacterial cell membrane but may exhibit additional modes of action. Identification of the multiple modes of action requires a comprehensive study at subinhibitory concentrations and careful data analysis since additional modes of action can be eclipsed by AMP action on the cell membrane.Techniques that measure the biosynthesis rate of macromolecules (e.g., DNA, RNA, protein, and cell wall) and the cytoplasmic membrane proton motive force (PMF) energy can help to unravel the diverse modes of action of AMPs. Here, we present an overview of macromolecule biosynthesis rate measurement and fluorescence spectroscopy methods to identify AMP mode(s) of action. Detailed protocols designed to measure inhibition of DNA, RNA, protein, and cell wall synthesis or membrane de-energization are presented and discussed for optimal application of these two techniques as well as to enable accurate interpretation of the experimental findings.

  14. Quasinormal frequencies of self-dual black holes

    NASA Astrophysics Data System (ADS)

    Santos, Victor; Maluf, R. V.; Almeida, C. A. S.

    2016-04-01

    One simplified black hole model constructed from a semiclassical analysis of loop quantum gravity (LQG) is called the self-dual black hole. This black hole solution depends on a free dimensionless parameter P known as the polymeric parameter and also on the a0 area related to the minimum area gap of LQG. In the limit of P and a0 going to zero, the usual Schwarzschild solution is recovered. Here we investigate the quasinormal modes (QNMs) of massless scalar perturbations in the self-dual black hole background. We compute the QN frequencies using the sixth-order WKB approximation method and compare them with numerical solutions of the Regge-Wheeler equation. Our results show that, as the parameter P grows, the real part of the QN frequencies suffers an initial increase and then starts to decrease while the magnitude of the imaginary one decreases for fixed area gap a0. This particular feature means that the damping of scalar perturbations in the self-dual black hole spacetimes is slower, and the oscillations are faster or slower according to the value of P .

  15. Ultrafast spectroscopy of super high frequency mechanical modes of doubly clamped beams

    NASA Astrophysics Data System (ADS)

    Ristow, Oliver; Merklein, Moritz; Grossmann, Martin; Hettich, Mike; Schubert, Martin; Bruchhausen, Axel; Grebing, Jochen; Erbe, Artur; Mounier, Denis; Gusev, Vitalyi; Scheer, Elke; Dekorsy, Thomas; Barretto, Elaine C. S.

    2013-12-01

    We use ultrafast pump-probe spectroscopy to study the mechanical vibrations in the time domain of doubly clamped silicon nitride beams. Beams with two different clamping conditions are investigated. Finite element method calculations are performed to analyse the mode spectra of both structures. By calculating the strain integral on the surface of the resonators, we are able to reproduce the effect of the detection mechanism and identify all the measured modes. We show that our spectroscopy technique combined with our modelling tools allow the investigation of several different modes in the super high frequency range (3-30 GHz) and above, bringing more information about the vibration modes of nanomechanical resonators.

  16. Local observation and spectroscopy of optical modes in an active photonic-crystal microcavity.

    PubMed

    Louvion, N; Gérard, D; Mouette, J; de Fornel, F; Seassal, C; Letartre, X; Rahmani, A; Callard, S

    2005-03-25

    We report the direct, room-temperature, near-field mapping and spectroscopy of the optical modes of a photonic-crystal microcavity containing quantum wells. We use a near-field optical probe to reveal the imprint of the cavity mode structure on the quantum-well emission. Furthermore, near-field spectroscopy allows us to demonstrate the strong spatial and spectral dependence of the coupling between the sources and the microcavity. This knowledge will be essential in devising future nanophotonic devices.

  17. Quartz-enhanced photoacoustic spectroscopy exploiting tuning fork overtone modes

    NASA Astrophysics Data System (ADS)

    Sampaolo, A.; Patimisco, P.; Dong, L.; Geras, A.; Scamarcio, G.; Starecki, T.; Tittel, F. K.; Spagnolo, V.

    2015-12-01

    We report on a quartz-enhanced photoacoustic sensor (QEPAS) based on a custom-made quartz tuning fork (QTF) to operate in both the fundamental and the first overtone vibrational mode resonances. The QTF fundamental mode resonance falls at ˜3 kHz and the first overtone at ˜18 kHz. Electrical tests showed that the first overtone provides a higher quality factor and increased piezoelectric current peak values, with respect to the fundamental flexural mode. To evaluate the QTF acousto-electric energy conversion efficiency, we operated the QEPAS in the near-IR and selected water vapor as the target gas. The first overtone resonance provides a QEPAS signal-to-noise ratio ˜5 times greater with respect to that measured for the fundamental mode. These results open the way to employing QTF overtone vibrational modes for QEPAS based trace gas sensing.

  18. Black hole ringing, quasinormal modes, and light rings

    NASA Astrophysics Data System (ADS)

    Khanna, Gaurav; Price, Richard H.

    2017-04-01

    Modeling of gravitational waves from binary black hole inspiral has played an important role in the recent observations of such signals. The late-stage ringdown phase of the gravitational waveform is often associated with the null particle orbit ("light ring") of the black hole spacetime. With simple models we show that this link between the light ring and spacetime ringing is based more on the history of specific models than on an actual constraining relationship. We also show, in particular, that a better understanding of the dissociation of the two may be relevant to the astrophysically interesting case of rotating (Kerr) black holes.

  19. Vibrationally-resolved polyatomic photoelectron spectroscopy: Mode-specific behavior

    NASA Astrophysics Data System (ADS)

    Rathbone, G. J.; Poliakoff, E. D.; Bozek, J. D.; Lucchese, R. R.

    2002-05-01

    We report the first vibrationally-resolved photoelectron spectra for polyatomic molecules performed over a broad spectral range. Such studies elucidate vibrationally mode-specific aspects of the photoelectron scattering dynamics. Three linear triatomic systems (CO_2, N_2O, and CS_2) are studied, and the results exhibit striking differences for alternative modes. For CO_2^+(C^2Σ_g^+), a continuum resonance results in a 15 eV wide dip for the symmetric stretch branching ratio, while strong peaks are observed for vibrational branching ratios associated with the two symmetry forbidden modes. For CS_2^+(B^2Σ_u^+), mode-specific behavior is displayed, as resonance enhancement of a single quantum excitation is weak for the symmetric stretch, but strong for the bending vibration. For N_2O^+(A^2Σ^+), many vibrational excitations are observed and families of vibrational branching ratio spectra emerge.

  20. Cavity-enhanced ultrafast two-dimensional spectroscopy using higher order modes

    NASA Astrophysics Data System (ADS)

    Allison, Thomas K.

    2017-02-01

    We describe methods using frequency combs and optical resonators for recording two-dimensional (2D) ultrafast spectroscopy signals with high sensitivity. By coupling multiple frequency combs to higher-order modes of one or more optical cavities, background-free, cavity-enhanced 2D spectroscopy signals are naturally generated via phase cycling. As in cavity-enhanced ultrafast transient absorption spectroscopy, the signal to noise is enhanced by a factor proportional to the cavity finesse squared, so even using cavities of modest finesse, a very high sensitivity is expected, enabling ultrafast 2D spectroscopy experiments in dilute molecular beams.

  1. Modes of the Kerr geometry with purely imaginary frequencies

    NASA Astrophysics Data System (ADS)

    Cook, Gregory B.; Zalutskiy, Maxim

    2016-11-01

    In this paper, we examine the behavior of modes of the Kerr geometry when the mode's frequency is purely imaginary. We demonstrate that quasinormal modes must be polynomial in nature if their frequency is purely imaginary, and present a method for computing such modes. The nature of these modes, however, is not always easy to determine. Some of the polynomial modes we compute are quasinormal modes. However, some are simultaneously quasinormal modes and total transmission modes, while others fail to satisfy the requisite boundary conditions for either. This analysis is, in part, an extension of the results known for Schwarzschild black holes, but clarifies misconceptions for the behavior of modes when the black hole has angular momentum. We also show that the algebraically special modes of Kerr with m =0 have an additional branch of solutions not seen before in the literature. All of these results are in precise agreement with new numerical solutions for sequences of gravitational quasinormal modes of Kerr spacetime. However, we show that some prior numerical and analytic results concerning the existence of quasinormal modes of Kerr with purely imaginary frequencies were incorrect.

  2. Thermal Mode Spectroscopy for Thermal Diffusivity of Millimeter-Size Solids

    NASA Astrophysics Data System (ADS)

    Ogi, Hirotsugu; Ishihara, Tatsuya; Ishida, Hideshi; Nagakubo, Akira; Nakamura, Nobutomo; Hirao, Masahiko

    2016-11-01

    Heat conduction possesses (thermal) modes in analogy with acoustics even without oscillation. Here, we establish thermal mode spectroscopy to measure the thermal diffusivity of small specimens. Local heating with a light pulse excites such modes that show antinodes at the heating point, and photothermal detection at another antinode spot allows measuring relaxation behavior of the desired mode selectively: The relaxation time yields thermal diffusivity. The Ritz method is proposed for arbitrary geometry specimens. This method is applicable even to a diamond crystal with ˜1 mm dimensions.

  3. Coherent phonon spectroscopy of non-fully symmetric modes using resonant terahertz excitation

    SciTech Connect

    Huber, T. Huber, L.; Johnson, S. L.; Ranke, M.; Ferrer, A.

    2015-08-31

    We use intense terahertz (THz) frequency electromagnetic pulses generated via optical rectification in an organic crystal to drive vibrational lattice modes in single crystal Tellurium. The coherent modes are detected by measuring the polarization changes of femtosecond laser pulses reflecting from the sample surface, resulting in a phase-resolved detection of the coherent lattice motion. We compare the data to a model of Lorentz oscillators driven by the near-single-cycle broadband THz pulse. The demonstrated technique of optically probed coherent phonon spectroscopy with THz frequency excitation could prove to be a viable alternative to other time-resolved spectroscopic methods like standard THz time domain spectroscopy.

  4. Whispering gallery mode stabilization of quantum cascade lasers for infrared sensing and spectroscopy

    NASA Astrophysics Data System (ADS)

    Borri, Simone; Siciliani de Cumis, Mario; Insero, Giacomo; Santambrogio, G.; Savchenkov, Anatoliy; Eliyahu, Danny; Ilchenko, Vladimir; Matsko, Andrey; Maleki, Lute; De Natale, Paolo

    2017-02-01

    Narrow-linewidth lasers are key elements in optical metrology and spectroscopy. From their spectral purity, the measurements accuracy and the overall quality of collected data critically depend. Crystalline micro-resonators have undergone an impressive development in the last decade, opening new ways to photonics from the mm to the μm scale. Their wide transparency range and high Q-factor make them suitable for integration in compact apparatuses for precision spectroscopy from the visible to the mid-IR. Here, we present our recent results on frequency stabilization and linewidth narrowing of quantum cascade lasers using crystalline Whispering Gallery Mode Resonators for mid-IR precision spectroscopy.

  5. Torsional vibrational modes of tryptophan studied by terahertz time-domain spectroscopy.

    PubMed

    Yu, B; Zeng, F; Yang, Y; Xing, Q; Chechin, A; Xin, X; Zeylikovich, I; Alfano, R R

    2004-03-01

    The low-frequency torsional modes, index of refraction, and absorption of a tryptophan film and pressed powders from 0.2 to 2.0 THz (6.6-66 cm(-1)) were measured by terahertz time-domain spectroscopy at room temperature. It was found that there were two dominated torsional vibrational modes at around 1.435 and 1.842 THz. The associated relaxation lifetimes ( approximately 1 ps) for these modes of the tryptophan molecule were measured. Using a density-functional calculation, the origins of the observed torsional vibrations were assigned to the chain and ring of the tryptophan molecule.

  6. Activated vibrational modes and Fermi resonance in tip-enhanced Raman spectroscopy.

    PubMed

    Sun, Mengtao; Fang, Yurui; Zhang, Zhenyu; Xu, Hongxing

    2013-02-01

    Using p-aminothiophenol (PATP) molecules on a gold substrate and high-vacuum tip-enhanced Raman spectroscopy (HV-TERS), we show that the vibrational spectra of these molecules are distinctly different from those in typical surface-enhanced Raman spectroscopy. Detailed first-principles calculations help to assign the Raman peaks in the TERS measurements as Raman-active and IR-active vibrational modes of dimercaptoazobenzene (DMAB), providing strong spectroscopic evidence for the dimerization of PATP molecules to DMAB under the TERS setup. The activation of the IR-active modes is due to enhanced electromagnetic field gradient effects within the gap region of the highly asymmetric tip-surface geometry. Fermi resonances are also observed in HV-TERS. These findings help to broaden the versatility of TERS as a promising technique for ultrasensitive molecular spectroscopy.

  7. Mapping bright and dark modes in gold nanoparticle chains using electron energy loss spectroscopy.

    PubMed

    Barrow, Steven J; Rossouw, David; Funston, Alison M; Botton, Gianluigi A; Mulvaney, Paul

    2014-07-09

    We present a scanning transmission electron microscopy-electron energy loss spectroscopy (STEM-EELS) investigation of gold nanosphere chains with lengths varying from 1 to 5 particles. We show localized EELS signals from the chains and identify energy-loss peaks arising due to l = 1, 2, 3, 4, and 5 plasmon modes through the use of EELS mapping. We also show the evolution of the energy of these modes as the length of a given chain increases, and we find that a chain containing N particles can accommodate at least N experimentally observable modes, in addition to the transverse mode. As the chain length is increased by the addition of one more gold particle to the chain, the new N + 1 mode becomes the highest energy mode, while the existing modes lower their energy and eventually asymptote as they delocalize along the chain. We also show that modes become increasingly difficult to detect with the EELS technique as l approaches N. The data are compared to numerical simulations.

  8. Polarised spectroscopy of individual single-wall nanotubes: Radial-breathing mode study

    NASA Astrophysics Data System (ADS)

    Azoulay, J.; Débarre, A.; Richard, A.; Tchénio, P.; Bandow, S.; Iijima, S.

    2001-02-01

    Polarised Raman spectroscopy is performed in a randomly distributed single-wall carbon tube (SWNT) sample at the scale of an individual single-wall nanotube. A detailed analysis in the radial-breathing mode (RBM) domain is presented. Selection of either a single tiny rope of SWNTs or of a single SWNT results from the conjugated high spatial selection of confocal microscopy, surface-enhanced Raman spectroscopy (SERS) and sample dilution. The drastic modifications observed in the low-frequency Raman spectra as a function of the polarisation configuration confirm the theoretical results.

  9. Low-Frequency Mode Activity of Heme: Femtosecond Coherence Spectroscopy of Iron Porphine Halides and Nitrophorin

    PubMed Central

    Kubo, Minoru; Gruia, Flaviu; Benabbas, Abdelkrim; Barabanschikov, Alexander; Montfort, William R.; Maes, Estelle M.; Champion, Paul M.

    2009-01-01

    The low-frequency mode activity of metalloporphyrins has been studied for iron porphine-halides (Fe(P)(X), X = Cl, Br) and nitrophorin 4 (NP4) using femtosecond coherence spectroscopy (FCS) in combination with polarized resonance Raman spectroscopy and density functional theory (DFT). It is confirmed that the mode symmetry selection rules for FCS are the same as for Raman scattering and that both Franck-Condon and Jahn-Teller mode activities are observed for Fe(P)(X) under Soret resonance conditions. The DFT-calculated low-frequency (20-400 cm-1) modes, and their frequency shifts upon halide substitution, are in good agreement with experimental Raman and coherence data, so that mode assignments can be made. The doming mode is located at ~80 cm-1 for Fe(P)(Cl) and at ~60 cm-1 for Fe(P)(Br). NP4 is also studied with coherence techniques, and the NO-bound species of ferric and ferrous NP4 display a mode at ~30-40 cm-1 that is associated with transient heme doming motion following NO photolysis. The coherence spectra of three ferric derivatives of NP4 with different degrees of heme ruffling distortion are also investigated. We find a mode at ~60 cm-1 whose relative intensity in the coherence spectra depends quadratically on the magnitude of the ruffling distortion. To quantitatively account for this correlation, a new “distortion-induced” Raman enhancement mechanism is presented. This mechanism is unique to low-frequency “soft modes” of the molecular framework that can be distorted by environmental forces. These results demonstrate the potential of FCS as a sensitive probe of dynamic and functionally important nonplanar heme vibrational excitations that are induced by the protein environmental forces or by the chemical reactions in the aqueous phase. PMID:18597456

  10. Normal mode analysis of Pyrococcus furiosus rubredoxin via nuclear resonance vibrational spectroscopy (NRVS) and resonance raman spectroscopy.

    PubMed

    Xiao, Yuming; Wang, Hongxin; George, Simon J; Smith, Matt C; Adams, Michael W W; Jenney, Francis E; Sturhahn, Wolfgang; Alp, Ercan E; Zhao, Jiyong; Yoda, Y; Dey, Abishek; Solomon, Edward I; Cramer, Stephen P

    2005-10-26

    We have used (57)Fe nuclear resonance vibrational spectroscopy (NRVS) to study the Fe(S(cys))(4) site in reduced and oxidized rubredoxin (Rd) from Pyrococcus furiosus (Pf). The oxidized form has also been investigated by resonance Raman spectroscopy. In the oxidized Rd NRVS, strong asymmetric Fe-S stretching modes are observed between 355 and 375 cm(-1); upon reduction these modes shift to 300-320 cm(-1). This is the first observation of Fe-S stretching modes in a reduced Rd. The peak in S-Fe-S bend mode intensity is at approximately 150 cm(-1) for the oxidized protein and only slightly lower in the reduced case. A third band occurs near 70 cm(-1) for both samples; this is assigned primarily as a collective motion of entire cysteine residues with respect to the central Fe. The (57)Fe partial vibrational density of states (PVDOS) were interpreted by normal mode analysis with optimization of Urey-Bradley force fields. The three main bands were qualitatively reproduced using a D(2)(d) Fe(SC)(4) model. A C(1) Fe(SCC)(4) model based on crystallographic coordinates was then used to simulate the splitting of the asymmetric stretching band into at least 3 components. Finally, a model employing complete cysteines and 2 additional neighboring atoms was used to reproduce the detailed structure of the PVDOS in the Fe-S stretch region. These results confirm the delocalization of the dynamic properties of the redox-active Fe site. Depending on the molecular model employed, the force constant K(Fe-S) for Fe-S stretching modes ranged from 1.24 to 1.32 mdyn/A. K(Fe-S) is clearly diminished in reduced Rd; values from approximately 0.89 to 1.00 mdyn/A were derived from different models. In contrast, in the final models the force constants for S-Fe-S bending motion, H(S-Fe-S), were 0.18 mdyn/A for oxidized Rd and 0.15 mdyn/A for reduced Rd. The NRVS technique demonstrates great promise for the observation and quantitative interpretation of the dynamical properties of Fe-S proteins.

  11. Cavity mode-width spectroscopy with widely tunable ultra narrow laser.

    PubMed

    Cygan, Agata; Lisak, Daniel; Morzyński, Piotr; Bober, Marcin; Zawada, Michał; Pazderski, Eugeniusz; Ciuryło, Roman

    2013-12-02

    We explore a cavity-enhanced spectroscopic technique based on determination of the absorbtion coefficient from direct measurement of spectral width of the mode of the optical cavity filled with absorbing medium. This technique called here the cavity mode-width spectroscopy (CMWS) is complementary to the cavity ring-down spectroscopy (CRDS). While both these techniques use information on interaction time of the light with the cavity to determine absorption coefficient, the CMWS does not require to measure very fast signals at high absorption conditions. Instead the CMWS method require a very narrow line width laser with precise frequency control. As an example a spectral line shape of P7 Q6 O₂ line from the B-band was measured with use of an ultra narrow laser system based on two phase-locked external cavity diode lasers (ECDL) having tunability of ± 20 GHz at wavelength range of 687 to 693 nm.

  12. Probing the Pairing Interaction and Multiple Bardasis-Schrieffer Modes Using Raman Spectroscopy

    SciTech Connect

    Maiti, S.; Maier, T. A.; Böhm, T.; Hackl, R.; Hirschfeld, P. J.

    2016-12-15

    In unconventional superconductors, understanding the form of the pairing interaction is the primary goal. In this regard, Raman spectroscopy is a very useful tool, as it identifies the ground state and also the subleading pairing channels by probing collective modes. We propose a general theory for a multiband Raman response and identify new features in the spectrum that can provide a robust test for a pairing theory. We also identify multiple Bardasis-Schrieffer type collective modes and connect the weights of these modes to the subleading gap structures within a microscopic pairing theory. Furthermore, while our conclusions are completely general, we apply our approach to interpret the specific case of B 1 g Raman scattering in hole-doped BaFe 2 As 2 .

  13. Probing the Pairing Interaction and Multiple Bardasis-Schrieffer Modes Using Raman Spectroscopy

    DOE PAGES

    Maiti, S.; Maier, T. A.; Böhm, T.; ...

    2016-12-15

    In unconventional superconductors, understanding the form of the pairing interaction is the primary goal. In this regard, Raman spectroscopy is a very useful tool, as it identifies the ground state and also the subleading pairing channels by probing collective modes. We propose a general theory for a multiband Raman response and identify new features in the spectrum that can provide a robust test for a pairing theory. We also identify multiple Bardasis-Schrieffer type collective modes and connect the weights of these modes to the subleading gap structures within a microscopic pairing theory. Furthermore, while our conclusions are completely general, wemore » apply our approach to interpret the specific case of B 1 g Raman scattering in hole-doped BaFe 2 As 2 .« less

  14. Probing the Pairing Interaction and Multiple Bardasis-Schrieffer Modes Using Raman Spectroscopy

    NASA Astrophysics Data System (ADS)

    Maiti, S.; Maier, T. A.; Böhm, T.; Hackl, R.; Hirschfeld, P. J.

    2016-12-01

    In unconventional superconductors, understanding the form of the pairing interaction is the primary goal. In this regard, Raman spectroscopy is a very useful tool, as it identifies the ground state and also the subleading pairing channels by probing collective modes. Here, we propose a general theory for a multiband Raman response and identify new features in the spectrum that can provide a robust test for a pairing theory. We identify multiple Bardasis-Schrieffer type collective modes and connect the weights of these modes to the subleading gap structures within a microscopic pairing theory. While our conclusions are completely general, we apply our approach to interpret the specific case of B1 g Raman scattering in hole-doped BaFe2 As2 .

  15. Visualization of Vibrational Modes in Real Space by Tip-Enhanced Non-Resonant Raman Spectroscopy.

    PubMed

    Duan, Sai; Tian, Guangjun; Luo, Yi

    2016-01-18

    We present a general theory to model the spatially resolved non-resonant Raman images of molecules. It is predicted that the vibrational motions of different Raman modes can be fully visualized in real space by tip-enhanced non-resonant Raman scattering. As an example, the non-resonant Raman images of water clusters were simulated by combining the new theory and first-principles calculations. Each individual normal mode gives rise its own distinct Raman image, which resembles the expected vibrational motions of the atoms very well. The characteristics of intermolecular vibrations in supermolecules could also be identified. The effects of the spatial distribution of the plasmon as well as nonlinear scattering processes were also addressed. Our study not only suggests a feasible approach to spatially visualize vibrational modes, but also provides new insights in the field of nonlinear plasmonic spectroscopy.

  16. Collective vibrational modes in biological molecules investigated by terahertz time-domain spectroscopy.

    PubMed

    Walther, M; Plochocka, P; Fischer, B; Helm, H; Uhd Jepsen, P

    2002-01-01

    We present well-resolved absorption spectra of biological molecules in the far-IR (FIR) spectral region recorded by terahertz time-domain spectroscopy (THz-TDS). As an illustrative example we discuss the absorption spectra of benzoic acid, its monosubstitutes salicylic acid (2-hydroxy-benzoic acid), 3- and 4-hydroxybenzoic acid, and aspirin (acetylsalicylic acid) in the spectral region between 18 and 150 cm(-1). The spectra exhibit distinct features originating from low-frequency vibrational modes caused by intra- or intermolecular collective motion and lattice modes. Due to the collective origin of the observed modes the absorption spectra are highly sensitive to the overall structure and configuration of the molecules, as well as their environment. The THz-TDS procedure can provide a direct fingerprint of the molecular structure or conformational state of a compound.

  17. Nonlinear terahertz spectroscopy of Higgs mode in s-wave superconductors

    NASA Astrophysics Data System (ADS)

    Matsunaga, Ryusuke; Shimano, Ryo

    2017-02-01

    We review our recent experiments of ultrafast dynamics in s-wave superconductors Nb1-x Ti x N by using nonlinear terahertz (THz) spectroscopy. The free oscillation of the Higgs mode, i.e. the amplitude mode of the superconducting order parameter, is observed after instantaneous injection of quasiparticles at the superconducting gap edge by an intense monocycle THz pulse. The ultrafast nonequilibrium dynamics of the order parameter under the strong AC driving field with the photon energy tuned below the superconducting gap is also investigated. A resonant nonlinear interaction between the Higgs mode and the electromagnetic field is revealed, as manifested by an efficient THz third-harmonic generation from the superconductor.

  18. Mode operation of inductively-coupled argon plasmas studied by optical emission spectroscopy

    NASA Astrophysics Data System (ADS)

    Iordanova, S.; Koleva, I.

    2007-04-01

    Mode operation of inductively driven plasmas in argon gas at low pressures is studied by optical emission spectroscopy. The plasma source is a tandem type source with a driver and an expansion plasma region. The driver region of the discharge is in the classical form of a cylindrically shaped inductive discharge, with a coil positioned over a gas discharge tube. The inductively coupled plasma discharge is maintained at high frequency f = 27 MHz, applied power varied in the limits P = (20-700) W and gas pressure in the range p = (8-260) mTorr. The Ar line intensity dependencies on the applied power injected into the discharge is analysed. With the power increase a mode transition of the discharge regime is not observed. The investigations on the discharge mode operation are supported by theoretical calculations based on kinetic modelling of main processes contributing to the line intensity behaviour.

  19. [Study on CO2 measurement using tunable multi-mode diode laser absorption spectroscopy].

    PubMed

    Gao, Guang-Zhen; Chen, Bao-Xue; Hu, Bo; Long, Xiu-Hui; Li, Ai-Ping; Li, Rong

    2013-12-01

    Tunable diode laser absorption spectroscopy (TDLAS) technology is a kind of fast time response, large-range, continuous on-line monitoring gas detection technique. It is the mainstream technology of gas detection. In this paper the multimode laser diode was used as light source. Multi-mode laser combined with correlation spectroscopy can improve the test reliability and stability. It can also conquer the problem of the central wavelength change of the single mode diode laser due to thermal or mechanical fluctuations in durable working process. A FP laser was used as the light source in this research. A multi-mode diode laser system based on correlation spectroscopy and wavelength modulation spectroscopy (TMDL-COSPEC-WMS) was used to measure carbon dioxide in ambient air around 1 570 nm. The carbon dioxide concentrations were derived from the relationship between the normalized WMS-2f signal peak heights of the measurement and reference signals which selected based on high signal to noise ratio and correlation coefficient. All measurements were performed with controlled carbon dioxide and nitrogen mixtures in which carbon dioxide concentrations range from 0. 6% to 30%. The calculation results showed that there was a high linear relationship between the measured and actual carbon dioxide concentration, the linearity was 0. 998 7 and the fitted slope was 1. 061+/-0. 016 8 respectively over the tested range. A detection limit of 335 ppm m was achieved. The standard deviation of 0. 036 7% was achieved using 20 successive measurements with each measurement time taking approximately 10 s during 20 minutes, which demonstrated good stability of the system. Good agreements between the measurements of the system and actual values confirm the accuracy and potential utility of the system for carbon dioxide detection.

  20. A study of the eigenvectors of the low-frequency vibrational modes in crystalline adenosine via high pressure Raman spectroscopy.

    PubMed

    Lee, Scott A; Pinnick, David A; Anderson, A

    2014-12-01

    High-pressure Raman spectroscopy has been used to study the eigenvectors and eigenvalues of the vibrational modes of crystalline adenosine at 295 K by evaluating the logarithmic derivative of the vibrational frequency with respect to pressure: [Formula: see text]. Crystalline samples of molecular materials such as adenosine will have vibrational modes that are localized within a molecular unit ("internal" modes) as well as modes in which the molecular units vibrate against each other ("external" modes). The value of the logarithmic derivative is found to be a diagnostic probe of the nature of the eigenvector of the vibrational modes. Stretching modes which are predominantly internal to the molecule have low logarithmic derivatives while external modes have higher logarithmic derivatives. Particular interest is paid to the low-frequency (≤150 cm(-1)) modes. Based on the pressure dependence of its logarithmic derivative, a mode near 49 cm(-1) is identified as internal mode. The other modes below 400 cm(-1) have pressure dependences of their logarithmic derivatives consistent with being either (1) modes which are mainly external, meaning that the molecules of the unit cell vibrate against each other in translational or librational motions (or linear combinations thereof), or (2) torsional or bending modes involving a large number of atoms, mainly within a molecule. The modes above 400 cm(-1) all have pressure dependences of their logarithmic derivatives consistent with being mainly internal modes.

  1. A Geiger-mode avalanche photodiode array for X-ray photon correlation spectroscopy.

    PubMed

    Johnson, I; Sadygov, Z; Bunk, O; Menzel, A; Pfeiffer, F; Renker, D

    2009-01-01

    X-ray photon correlation spectroscopy (XPCS) provides an opportunity to study the dynamics of systems by measuring the temporal fluctuations in a far-field diffraction pattern. A two-dimensional detector system has been developed to investigate fluctuations in the frequency range of several Hz to kHz. The X-ray detector system consists of a thin 100 microm scintillation crystal coupled to a Geiger-mode avalanche photodiode array. In this article the elements of the system are detailed and the detector for XPCS measurements is demonstrated.

  2. Effects of nonlinear forces on dynamic mode atomic force microscopy and spectroscopy.

    PubMed

    Das, Soma; Sreeram, P A; Raychaudhuri, A K

    2007-06-01

    In this paper, we describe the effects of nonlinear tip-sample forces on dynamic mode atomic force microscopy and spectroscopy. The jumps and hysteresis observed in the vibration amplitude (A) versus tip-sample distance (h) curves have been traced to bistability in the resonance curve. A numerical analysis of the basic dynamic equation was used to explain the hysteresis in the experimental curve. It has been found that the location of the hysteresis in the A-h curve depends on the frequency of the forced oscillation relative to the natural frequency of the cantilever.

  3. Characterizing Anharmonic Vibrational Modes of Quinones with Two-Dimensional Infrared Spectroscopy.

    PubMed

    Cyran, Jenée D; Nite, Jacob M; Krummel, Amber T

    2015-07-23

    Two-dimensional infrared (2D IR) spectroscopy was used to study the vibrational modes of three quinones--benzoquinone, naphthoquinone, and anthraquinone. The vibrations of interest were in the spectral range of 1560-1710 cm(-1), corresponding to the in-plane carbonyl and ring stretching vibrations. Coupling between the vibrational modes is indicated by the cross peaks in the 2D IR spectra. The diagonal and off-diagonal anharmonicities range from 4.6 to 17.4 cm(-1) for the quinone series. In addition, there is significant vibrational coupling between the in-plane carbonyl and ring stretching vibrations. The diagonal anharmonicity, off-diagonal anharmonicity, and vibrational coupling constants are reported for benzoquinone, naphthoquinone, and anthraquinone.

  4. A sample holder for soft x-ray absorption spectroscopy of liquids in transmission mode.

    PubMed

    Schreck, Simon; Gavrila, Gianina; Weniger, Christian; Wernet, Philippe

    2011-10-01

    A novel sample holder for soft x-ray absorption spectroscopy of liquids in transmission mode based on sample cells with x-ray transparent silicon nitride membranes is introduced. The sample holder allows for a reliable preparation of ultrathin liquid films with an adjustable thickness in the nm-μm range. This enables measurements of high quality x-ray absorption spectra of liquids in transmission mode, as will be shown for the example of liquid H(2)O, aqueous solutions of 3d-transition metal ions and alcohol-water mixtures. The fine structure of the x-ray absorption spectra is not affected by the sample thickness. No effects of the silicon nitride membranes were observed in the spectra. It is shown how an inhomogeneous thickness of the sample affects the spectra and how this can be avoided.

  5. Resolving fine spectral features in lattice vibrational modes using femtosecond coherent spectroscopy

    NASA Astrophysics Data System (ADS)

    Card, A.; Mokim, M.; Ganikhanov, F.

    2016-02-01

    We show resolution of fine spectral features within several Raman active vibrational modes in potassium titanyl phosphate (KTP) crystal. Measurements are performed using a femtosecond time-domain coherent anti-Stokes Raman scattering spectroscopy technique that is capable of delivering equivalent spectral resolution of 0.1 cm-1. The Raman spectra retrieved from our measurements show several spectral components corresponding to vibrations of different symmetry with distinctly different damping rates. In particular, linewidths for unassigned optical phonon mode triplet centered at around 820 cm-1 are found to be 7.5 ± 0.2 cm-1, 9.1 ± 0.3 cm-1, and 11.2 ± 0.3 cm-1. Results of our experiments will ultimately help to design an all-solid-state source for sub-optical-wavelength waveform generation that is based on stimulated Raman scattering.

  6. Anharmonic vibrational modes of nucleic acid bases revealed by 2D IR spectroscopy.

    PubMed

    Peng, Chunte Sam; Jones, Kevin C; Tokmakoff, Andrei

    2011-10-05

    Polarization-dependent two-dimensional infrared (2D IR) spectra of the purine and pyrimadine base vibrations of five nucleotide monophosphates (NMPs) were acquired in D(2)O at neutral pH in the frequency range 1500-1700 cm(-1). The distinctive cross-peaks between the ring deformations and carbonyl stretches of NMPs indicate that these vibrational modes are highly coupled, in contrast with the traditional peak assignment, which is based on a simple local mode picture such as C═O, C═N, and C═C double bond stretches. A model of multiple anharmonically coupled oscillators was employed to characterize the transition energies, vibrational anharmonicities and couplings, and transition dipole strengths and orientations. No simple or intuitive structural correlations are found to readily assign the spectral features, except in the case of guanine and cytosine, which contain a single local CO stretching mode. To help interpret the nature of these vibrational modes, we performed density functional theory (DFT) calculations and found that multiple ring vibrations are coupled and delocalized over the purine and pyrimidine rings. Generally, there is close correspondence between the experimental and computational results, provided that the DFT calculations include explicit waters solvating hydrogen-bonding sites. These results provide direct experimental evidence of the delocalized nature of the nucleotide base vibrations via a nonperturbative fashion and will serve as building blocks for constructing a structure-based model of DNA and RNA vibrational spectroscopy.

  7. A study of the eigenvectors of the vibrational modes in crystalline cytidine via high-pressure Raman spectroscopy.

    PubMed

    Lee, Scott A; Pinnick, David A; Anderson, A

    2015-01-01

    Raman spectroscopy has been used to study the eigenvectors and eigenvalues of the vibrational modes of crystalline cytidine at 295 K and high pressures by evaluating the logarithmic derivative of the vibrational frequency ω with respect to pressure P: [Formula: see text]. Crystalline samples of molecular materials have strong intramolecular bonds and weak intermolecular bonds. This hierarchy of bonding strengths causes the vibrational optical modes localized within a molecular unit ("internal" modes) to be relatively high in frequency while the modes in which the molecular units vibrate against each other ("external" modes) have relatively low frequencies. The value of the logarithmic derivative is a useful diagnostic probe of the nature of the eigenvector of the vibrational modes because stretching modes (which are predominantly internal to the molecule) have low logarithmic derivatives while external modes have higher logarithmic derivatives. In crystalline cytidine, the modes at 85.8, 101.4, and 110.6 cm(-1) are external in which the molecules of the unit cell vibrate against each other in either translational or librational motions (or some linear combination thereof). All of the modes above 320 cm(-1) are predominantly internal stretching modes. The remaining modes below 320 cm(-1) include external modes and internal modes, mostly involving either torsional or bending motions of groups of atoms within a molecule.

  8. Observation of the low frequency vibrational modes of bacteriophage M13 in water by Raman spectroscopy

    PubMed Central

    Tsen, KT; Dykeman, Eric C; Sankey, Otto F; Lin, Nien-Tsung; Tsen, Shaw-Wei D; Kiang, Juliann G

    2006-01-01

    Background Recently, a technique which departs radically from conventional approaches has been proposed. This novel technique utilizes biological objects such as viruses as nano-templates for the fabrication of nanostructure elements. For example, rod-shaped viruses such as the M13 phage and tobacco mosaic virus have been successfully used as biological templates for the synthesis of semiconductor and metallic nanowires. Results and discussion Low wave number (≤ 20 cm-1) acoustic vibrations of the M13 phage have been studied using Raman spectroscopy. The experimental results are compared with theoretical calculations based on an elastic continuum model and appropriate Raman selection rules derived from a bond polarizability model. The observed Raman mode has been shown to belong to one of the Raman-active axial torsion modes of the M13 phage protein coat. Conclusion It is expected that the detection and characterization of this low frequency vibrational mode can be used for applications in nanotechnology such as for monitoring the process of virus functionalization and self-assembly. For example, the differences in Raman spectra can be used to monitor the coating of virus with some other materials and nano-assembly process, such as attaching a carbon nanotube or quantum dots. PMID:16995944

  9. DNA interaction with DAPI fluorescent dye: Force spectroscopy decouples two different binding modes.

    PubMed

    Reis, L A; Rocha, M S

    2017-05-01

    In this work, we use force spectroscopy to investigate the interaction between the DAPI fluorescent dye and the λ-DNA molecule under high (174 mM) and low (34 mM) ionic strengths. Firstly, we have measured the changes on the mechanical properties (persistence and contour lengths) of the DNA-DAPI complexes as a function of the dye concentration in the sample. Then, we use recently developed models in order to connect the behavior of both mechanical properties to the physical chemistry of the interaction. Such analysis has allowed us to identify and to decouple two main binding modes, determining the relevant physicochemical (binding) parameters for each of these modes: minor groove binding, which saturates at very low DAPI concentrations ( CT ∼ 0.50 μM) and presents equilibrium binding constants of the order of ∼10(7) M(-1) for the two ionic strengths studied; and intercalation, which starts to play a significant role only after the saturation of the first mode, presenting much smaller equilibrium binding constants (∼10(5) M(-1) ).

  10. First laboratory results of SPHERE/IRDIS dual-band imaging and long slit spectroscopy modes

    NASA Astrophysics Data System (ADS)

    Vigan, Arthur; Langlois, Maud; Martinez, Patrice; Le Mignant, David; Dohlen, Kjetil; Moutou, Claire; Gry, Cécile; Madec, Fabrice

    2012-09-01

    IRDIS is one of the science sub-systems of VLT/SPHERE dedicated to the detection and characterization of giant exoplanets at large orbital radii with high-contrast direct imaging. It offers a unique set of observational modes including dual-band imaging (DBI) with very low differential aberrations, and long slit spectroscopy (LSS) coupled with a classical Lyot coronograph that will be used to obtain spectra at low (R = ~50) and medium (R = ~500) resolution. During the past year, IRDIS has been integrated and tested in laboratory in a standalone configuration, and it has recently been integrated on the full SPHERE bench including the calibration unit, the common path optics and the extreme AO system. We present the first analysis of data obtained during laboratory tests of IRDIS in the DBI mode, both in standalone and with the full SPHERE bench, but without simulated seeing and AO correction. We show the first performance estimates of spectral differential imaging with IRDIS in H-band, which is used to attenuate the speckle noise induced by the instrumental aberrations. Similarly, for the LSS mode we present the first application of the spectral deconvolution data analysis method to attenuate the speckle noise on IRDIS data. Finally we compare these results to simulations that were performed during the development phase of the instrument.

  11. Imaging via complete cantilever dynamic detection: General dynamic mode imaging and spectroscopy in scanning probe microscopy

    SciTech Connect

    Somnath, Suhas; Collins, Liam; Matheson, Michael A.; Sukumar, Sreenivas R.; Kalinin, Sergei V.; Jesse, Stephen

    2016-09-08

    We develop and implement a multifrequency spectroscopy and spectroscopic imaging mode, referred to as general dynamic mode (GDM), that captures the complete spatially- and stimulus dependent information on nonlinear cantilever dynamics in scanning probe microscopy (SPM). GDM acquires the cantilever response including harmonics and mode mixing products across the entire broadband cantilever spectrum as a function of excitation frequency. GDM spectra substitute the classical measurements in SPM, e.g. amplitude and phase in lock-in detection. Here, GDM is used to investigate the response of a purely capacitively driven cantilever. We use information theory techniques to mine the data and verify the findings with governing equations and classical lock-in based approaches. We explore the dependence of the cantilever dynamics on the tip–sample distance, AC and DC driving bias. This approach can be applied to investigate the dynamic behavior of other systems within and beyond dynamic SPM. In conclusion, GDM is expected to be useful for separating the contribution of different physical phenomena in the cantilever response and understanding the role of cantilever dynamics in dynamic AFM techniques.

  12. Mode Coupling in Plasmonic Heterodimers Probed with Electron Energy Loss Spectroscopy.

    PubMed

    Flauraud, Valentin; Bernasconi, Gabriel D; Butet, Jérémy; Alexander, Duncan T L; Martin, Olivier J F; Brugger, Juergen

    2017-03-14

    While plasmonic antennas composed of building blocks made of the same material have been thoroughly studied, recent investigations have highlighted the unique opportunities enabled by making compositionally asymmetric plasmonic systems. So far, mainly heterostructures composed of nanospheres and nanodiscs have been investigated, revealing opportunities for the design of Fano resonant nanostructures, directional scattering, sensing and catalytic applications. In this article, an improved fabrication method is reported that enables precise tuning of the heterodimer geometry, with interparticle distances made down to a few nanometers between Au-Ag and Au-Al nanoparticles. A wide range of mode energy detuning and coupling conditions are observed by near field hyperspectral imaging performed with electron energy loss spectroscopy, supported by full wave analysis numerical simulations. These results provide direct insights into the mode hybridization of plasmonic heterodimers, pointing out the influence of each dimer constituent in the overall electromagnetic response. By relating the coupling of non-dipolar modes and plasmon-interband interaction with the dimer geometry, this work facilitates the development of plasmonic heterostructures with tailored responses, beyond the possibilities offered by homodimers.

  13. Imaging via complete cantilever dynamic detection: general dynamic mode imaging and spectroscopy in scanning probe microscopy

    NASA Astrophysics Data System (ADS)

    Somnath, Suhas; Collins, Liam; Matheson, Michael A.; Sukumar, Sreenivas R.; Kalinin, Sergei V.; Jesse, Stephen

    2016-10-01

    We develop and implement a multifrequency spectroscopy and spectroscopic imaging mode, referred to as general dynamic mode (GDM), that captures the complete spatially- and stimulus dependent information on nonlinear cantilever dynamics in scanning probe microscopy (SPM). GDM acquires the cantilever response including harmonics and mode mixing products across the entire broadband cantilever spectrum as a function of excitation frequency. GDM spectra substitute the classical measurements in SPM, e.g. amplitude and phase in lock-in detection. Here, GDM is used to investigate the response of a purely capacitively driven cantilever. We use information theory techniques to mine the data and verify the findings with governing equations and classical lock-in based approaches. We explore the dependence of the cantilever dynamics on the tip–sample distance, AC and DC driving bias. This approach can be applied to investigate the dynamic behavior of other systems within and beyond dynamic SPM. GDM is expected to be useful for separating the contribution of different physical phenomena in the cantilever response and understanding the role of cantilever dynamics in dynamic AFM techniques.

  14. Imaging via complete cantilever dynamic detection: General dynamic mode imaging and spectroscopy in scanning probe microscopy

    SciTech Connect

    Somnath, Suhas; Collins, Liam; Matheson, Michael A.; Sukumar, Sreenivas R.; Kalinin, Sergei V.; Jesse, Stephen

    2016-09-08

    We develop and implement a multifrequency spectroscopy and spectroscopic imaging mode, referred to as general dynamic mode (GDM), that captures the complete spatially- and stimulus dependent information on nonlinear cantilever dynamics in scanning probe microscopy (SPM). GDM acquires the cantilever response including harmonics and mode mixing products across the entire broadband cantilever spectrum as a function of excitation frequency. GDM spectra substitute the classical measurements in SPM, e.g. amplitude and phase in lock-in detection. Here, GDM is used to investigate the response of a purely capacitively driven cantilever. We use information theory techniques to mine the data and verify the findings with governing equations and classical lock-in based approaches. We explore the dependence of the cantilever dynamics on the tip–sample distance, AC and DC driving bias. This approach can be applied to investigate the dynamic behavior of other systems within and beyond dynamic SPM. In conclusion, GDM is expected to be useful for separating the contribution of different physical phenomena in the cantilever response and understanding the role of cantilever dynamics in dynamic AFM techniques.

  15. Imaging via complete cantilever dynamic detection: General dynamic mode imaging and spectroscopy in scanning probe microscopy

    DOE PAGES

    Somnath, Suhas; Collins, Liam; Matheson, Michael A.; ...

    2016-09-08

    We develop and implement a multifrequency spectroscopy and spectroscopic imaging mode, referred to as general dynamic mode (GDM), that captures the complete spatially- and stimulus dependent information on nonlinear cantilever dynamics in scanning probe microscopy (SPM). GDM acquires the cantilever response including harmonics and mode mixing products across the entire broadband cantilever spectrum as a function of excitation frequency. GDM spectra substitute the classical measurements in SPM, e.g. amplitude and phase in lock-in detection. Here, GDM is used to investigate the response of a purely capacitively driven cantilever. We use information theory techniques to mine the data and verify themore » findings with governing equations and classical lock-in based approaches. We explore the dependence of the cantilever dynamics on the tip–sample distance, AC and DC driving bias. This approach can be applied to investigate the dynamic behavior of other systems within and beyond dynamic SPM. In conclusion, GDM is expected to be useful for separating the contribution of different physical phenomena in the cantilever response and understanding the role of cantilever dynamics in dynamic AFM techniques.« less

  16. Wideband Fully-Programmable Dual-Mode CMOS Analogue Front-End for Electrical Impedance Spectroscopy

    PubMed Central

    Valente, Virgilio; Demosthenous, Andreas

    2016-01-01

    This paper presents a multi-channel dual-mode CMOS analogue front-end (AFE) for electrochemical and bioimpedance analysis. Current-mode and voltage-mode readouts, integrated on the same chip, can provide an adaptable platform to correlate single-cell biosensor studies with large-scale tissue or organ analysis for real-time cancer detection, imaging and characterization. The chip, implemented in a 180-nm CMOS technology, combines two current-readout (CR) channels and four voltage-readout (VR) channels suitable for both bipolar and tetrapolar electrical impedance spectroscopy (EIS) analysis. Each VR channel occupies an area of 0.48 mm2, is capable of an operational bandwidth of 8 MHz and a linear gain in the range between −6 dB and 42 dB. The gain of the CR channel can be set to 10 kΩ, 50 kΩ or 100 kΩ and is capable of 80-dB dynamic range, with a very linear response for input currents between 10 nA and 100 μA. Each CR channel occupies an area of 0.21 mm2. The chip consumes between 530 μA and 690 μA per channel and operates from a 1.8-V supply. The chip was used to measure the impedance of capacitive interdigitated electrodes in saline solution. Measurements show close matching with results obtained using a commercial impedance analyser. The chip will be part of a fully flexible and configurable fully-integrated dual-mode EIS system for impedance sensors and bioimpedance analysis. PMID:27463721

  17. Current-mode deep level transient spectroscopy of a semiconductor nanowire field-effect transistor

    NASA Astrophysics Data System (ADS)

    Isakov, Ivan; Sourribes, Marion J. L.; Warburton, Paul A.

    2017-09-01

    One of the main limiting factors in the carrier mobility in semiconductor nanowires is the presence of deep trap levels. While deep-level transient spectroscopy (DLTS) has proved to be a powerful tool in analysing traps in bulk semiconductors, this technique is ineffective for the characterisation of nanowires due to their very small capacitance. Here, we introduce a new technique for measuring the spectrum of deep traps in nanowires. In current-mode DLTS ("I-DLTS"), the temperature-dependence of the transient current through a nanowire field-effect transistor in response to an applied gate voltage pulse is measured. We demonstrate the applicability of I-DLTS to determine the activation energy and capture cross-sections of several deep defect states in zinc oxide nanowires. In addition to characterising deep defect states, we show that I-DLTS can be used to measure the surface barrier height in semiconductor nanowires.

  18. Near gap excitation of a CDW amplitude mode by time-resolved photoelectron spectroscopy

    NASA Astrophysics Data System (ADS)

    Leuenberger, Dominik; Yang, Shuolong; Sobota, Jonathan; Giraldo, Paula; Kirchmann, Patrick; Fisher, Ian; Shen, Zhi-Xun

    2014-03-01

    We present time-, angle- and energy-resolved photoelectron spectroscopy data from the light rear-earth tritelluride compound CeTe3. An in-plane Peierls distortion in the tellurium slabs leads to the formation of an incommensurate Charge Density Wave (CDW), accompanied by a CDW gap at the Fermi level. Ultrafast optical laser excitation and subsequent relaxation by means of electron-phonon coupling can coherently excite a periodic modulation of the CDW band position and the gap size in rear-earth tritellurides. In this work, the use of tuneable near infrared laser pulses allows for optical excitation slightly above and below the measured gap value of 570 meV. The smaller excitation phase space not only leads to cleaner amplitude mode signal but also helps to pin down the optical transitions, which are the driving mechanisms for the transient CDW phase transition. Financial support by the Swiss National Science Foundation is duly acknowledged.

  19. Far-infrared vibrational modes of DNA components studied by terahertz time-domain spectroscopy.

    PubMed

    Fischer, B M; Walther, M; Uhd Jepsen, P

    2002-11-07

    The far-infrared dielectric function of a wide range of organic molecules is dominated by vibrations involving a substantial fraction of the atoms forming the molecule and motion associated with intermolecular hydrogen bond vibrations. Due to their collective nature such modes are highly sensitive to the intra- and intermolecular structure and thus provide a unique fingerprint of the conformational state of the molecule and effects of its environment. We demonstrate the use of terahertz time-domain spectroscopy (THz-TDS) for recording the far-infrared (0.5-4.0 THz) dielectric function of the four nucleobases and corresponding nucleosides forming the building blocks of deoxyribose nucleic acid (DNA). We observe numerous distinct spectral features with large differences between the molecules in both frequency-dependent absorption coefficient and index of refraction. Assisted by results from density-functional calculations we interpret the origin of the observed resonances as vibrations of hydrogen bonds between the molecules.

  20. Assessment of Scanning Tunneling Spectroscopy Modes Inspecting Electron Confinement in Surface-Confined Supramolecular Networks

    PubMed Central

    Krenner, Wolfgang; Kühne, Dirk; Klappenberger, Florian; Barth, Johannes V.

    2013-01-01

    Scanning tunneling spectroscopy (STS) enables the local, energy-resolved investigation of a samples surface density of states (DOS) by measuring the differential conductance (dI/dV) being approximately proportional to the DOS. It is popular to examine the electronic structure of elementary samples by acquiring dI/dV maps under constant current conditions. Here we demonstrate the intricacy of STS mapping of samples exhibiting a strong corrugation originating from electronic density and local work function changes. The confinement of the Ag(111) surface state by a porous organic network is studied with maps obtained under constant-current (CC) as well as open-feedback-loop (OFL) conditions. We show how the CC maps deviate markedly from the physically more meaningful OFL maps. By applying a renormalization procedure to the OFL data we can mimic the spurious effects of the CC mode and thereby rationalize the physical effects evoking the artefacts in the CC maps. PMID:23503526

  1. Mode-dependent dispersion in Raman line shapes: Observation and implications from ultrafast Raman loss spectroscopy

    SciTech Connect

    Umapathy, S.; Mallick, B.; Lakshmanna, A.

    2010-07-14

    Ultrafast Raman loss spectroscopy (URLS) enables one to obtain the vibrational structural information of molecular systems including fluorescent materials. URLS, a nonlinear process analog to stimulated Raman gain, involves a narrow bandwidth picosecond Raman pump pulse and a femtosecond broadband white light continuum. Under nonresonant condition, the Raman response appears as a negative (loss) signal, whereas, on resonance with the electronic transition the line shape changes from a negative to a positive through a dispersive form. The intensities observed and thus, the Franck-Condon activity (coordinate dependent), are sensitive to the wavelength of the white light corresponding to a particular Raman frequency with respect to the Raman pump pulse wavelength, i.e., there is a mode-dependent response in URLS.

  2. Mapping inhibitor binding modes on an active cysteine protease via nuclear magnetic resonance spectroscopy.

    PubMed

    Lee, Gregory M; Balouch, Eaman; Goetz, David H; Lazic, Ana; McKerrow, James H; Craik, Charles S

    2012-12-18

    Cruzain is a member of the papain/cathepsin L family of cysteine proteases, and the major cysteine protease of the protozoan Trypanosoma cruzi, the causative agent of Chagas disease. We report an autoinduction methodology that provides soluble cruzain in high yields (>30 mg/L in minimal medium). These increased yields provide sufficient quantities of active enzyme for use in nuclear magnetic resonance (NMR)-based ligand mapping. Using circular dichroism and NMR spectroscopy, we also examined the solution-state structural dynamics of the enzyme in complex with a covalently bound vinyl sulfone inhibitor (K777). We report the backbone amide and side chain carbon chemical shift assignments of cruzain in complex with K777. These resonance assignments were used to identify and map residues located in the substrate binding pocket, including the catalytic Cys25 and His162. Selective [(15)N]Cys, [(15)N]His, and [(13)C]Met labeling was performed to quickly assess cruzain-ligand interactions for a set of eight low-molecular weight compounds exhibiting micromolar binding or inhibition. Chemical shift perturbation mapping verified that six of the eight compounds bind to cruzain at the active site. Three different binding modes were delineated for the compounds, namely, covalent, noncovalent, and noninteracting. These results provide examples of how NMR spectroscopy can be used to screen compounds for fast evaluation of enzyme-inhibitor interactions to facilitate lead compound identification and subsequent structural studies.

  3. Accurate force spectroscopy in tapping mode atomic force microscopy in liquids

    NASA Astrophysics Data System (ADS)

    Xu, Xin; Melcher, John; Raman, Arvind

    2010-01-01

    Existing force spectroscopy methods in tapping mode atomic force microscopy (AFM) such as higher harmonic inversion [M. Stark, R. W. Stark, W. M. Heckl, and R. Guckenberger, Proc. Natl. Acad. Sci. U.S.A. 99, 8473 (2002)] or scanning probe acceleration microscopy [J. Legleiter, M. Park, B. Cusick, and T. Kowalewski, Proc. Natl. Acad. Sci. U.S.A. 103, 4813 (2006)] or integral relations [M. Lee and W. Jhe, Phys. Rev. Lett. 97, 036104 (2006); S. Hu and A. Raman, Nanotechnology 19, 375704 (2008); H. Hölscher, Appl. Phys. Lett. 89, 123109 (2006); A. J. Katan, Nanotechnology 20, 165703 (2009)] require and assume as an observable the tip dynamics in a single eigenmode of the oscillating microcantilever. We demonstrate that this assumption can distort significantly the extracted tip-sample interaction forces when applied to tapping mode AFM with soft cantilevers in liquid environments. This exception is due to the fact that under these conditions the second eigenmode is momentarily excited and the observed tip dynamics clearly contains contributions from the fundamental and second eigenmodes. To alleviate this problem, a simple experimental method is proposed to screen the second eigenmode contributions in the observed tip deflection signal to allow accurate tip-sample force reconstruction in liquids. The method is implemented experimentally to reconstruct interaction forces on polymer, bacteriorhodopsin membrane, and mica samples in buffer solutions.

  4. Modeling Stretching Modes of Common Organic Molecules with the Quantum Mechanical Harmonic Oscillator: An Undergraduate Vibrational Spectroscopy Laboratory Exercise

    ERIC Educational Resources Information Center

    Parnis, J. Mark; Thompson, Matthew G. K.

    2004-01-01

    An introductory undergraduate physical organic chemistry exercise that introduces the harmonic oscillator's use in vibrational spectroscopy is developed. The analysis and modeling exercise begins with the students calculating the stretching modes of common organic molecules with the help of the quantum mechanical harmonic oscillator (QMHO) model.

  5. Modeling Stretching Modes of Common Organic Molecules with the Quantum Mechanical Harmonic Oscillator: An Undergraduate Vibrational Spectroscopy Laboratory Exercise

    ERIC Educational Resources Information Center

    Parnis, J. Mark; Thompson, Matthew G. K.

    2004-01-01

    An introductory undergraduate physical organic chemistry exercise that introduces the harmonic oscillator's use in vibrational spectroscopy is developed. The analysis and modeling exercise begins with the students calculating the stretching modes of common organic molecules with the help of the quantum mechanical harmonic oscillator (QMHO) model.

  6. Assignment of the Internal Vibrational Modes of C70 by Inelastic Neutron Scattering Spectroscopy and Periodic-DFT.

    PubMed

    Refson, Keith; Parker, Stewart F

    2015-10-01

    The fullerene C70 may be considered as the shortest possible nanotube capped by a hemisphere of C60 at each end. Vibrational spectroscopy is a key tool in characterising fullerenes, and C70 has been studied several times and spectral assignments proposed. Unfortunately, many of the modes are either forbidden or have very low infrared or Raman intensity, even if allowed. Inelastic neutron scattering (INS) spectroscopy is not subject to selection rules, and all the modes are allowed. We have obtained a new INS spectrum from a large sample recorded at the highest resolution available. An advantage of INS spectroscopy is that it is straightforward to calculate the spectral intensity from a model. We demonstrate that all previous assignments are incorrect in at least some respects and propose a new assignment based on periodic density functional theory (DFT) that successfully reproduces the INS, infrared, and Raman spectra.

  7. Optimally designed narrowband guided-mode resonance reflectance filters for mid-infrared spectroscopy

    PubMed Central

    Liu, Jui-Nung; Schulmerich, Matthew V.; Bhargava, Rohit; Cunningham, Brian T.

    2011-01-01

    An alternative to the well-established Fourier transform infrared (FT-IR) spectrometry, termed discrete frequency infrared (DFIR) spectrometry, has recently been proposed. This approach uses narrowband mid-infrared reflectance filters based on guided-mode resonance (GMR) in waveguide gratings, but filters designed and fabricated have not attained the spectral selectivity (≤ 32 cm−1) commonly employed for measurements of condensed matter using FT-IR spectroscopy. With the incorporation of dispersion and optical absorption of materials, we present here optimal design of double-layer surface-relief silicon nitride-based GMR filters in the mid-IR for various narrow bandwidths below 32 cm−1. Both shift of the filter resonance wavelengths arising from the dispersion effect and reduction of peak reflection efficiency and electric field enhancement due to the absorption effect show that the optical characteristics of materials must be taken into consideration rigorously for accurate design of narrowband GMR filters. By incorporating considerations for background reflections, the optimally designed GMR filters can have bandwidth narrower than the designed filter by the antireflection equivalence method based on the same index modulation magnitude, without sacrificing low sideband reflections near resonance. The reported work will enable use of GMR filters-based instrumentation for common measurements of condensed matter, including tissues and polymer samples. PMID:22109445

  8. Optimally designed narrowband guided-mode resonance reflectance filters for mid-infrared spectroscopy.

    PubMed

    Liu, Jui-Nung; Schulmerich, Matthew V; Bhargava, Rohit; Cunningham, Brian T

    2011-11-21

    An alternative to the well-established Fourier transform infrared (FT-IR) spectrometry, termed discrete frequency infrared (DFIR) spectrometry, has recently been proposed. This approach uses narrowband mid-infrared reflectance filters based on guided-mode resonance (GMR) in waveguide gratings, but filters designed and fabricated have not attained the spectral selectivity (≤ 32 cm(-1)) commonly employed for measurements of condensed matter using FT-IR spectroscopy. With the incorporation of dispersion and optical absorption of materials, we present here optimal design of double-layer surface-relief silicon nitride-based GMR filters in the mid-IR for various narrow bandwidths below 32 cm(-1). Both shift of the filter resonance wavelengths arising from the dispersion effect and reduction of peak reflection efficiency and electric field enhancement due to the absorption effect show that the optical characteristics of materials must be taken into consideration rigorously for accurate design of narrowband GMR filters. By incorporating considerations for background reflections, the optimally designed GMR filters can have bandwidth narrower than the designed filter by the antireflection equivalence method based on the same index modulation magnitude, without sacrificing low sideband reflections near resonance. The reported work will enable use of GMR filters-based instrumentation for common measurements of condensed matter, including tissues and polymer samples. © 2011 Optical Society of America

  9. Empirical mode decomposition-based motion artifact correction method for functional near-infrared spectroscopy

    NASA Astrophysics Data System (ADS)

    Gu, Yue; Han, Junxia; Liang, Zhenhu; Yan, Jiaqing; Li, Zheng; Li, Xiaoli

    2016-01-01

    Functional near-infrared spectroscopy (fNIRS) is a promising technique for monitoring brain activity. However, it is sensitive to motion artifacts. Many methods have been developed for motion correction, such as spline interpolation, wavelet filtering, and kurtosis-based wavelet filtering. We propose a motion correction method based on empirical mode decomposition (EMD), which is applied to segments of data identified as having motion artifacts. The EMD method is adaptive, data-driven, and well suited for nonstationary data. To test the performance of the proposed EMD method and to compare it with other motion correction methods, we used simulated hemodynamic responses added to real resting-state fNIRS data. The EMD method reduced mean squared error in 79% of channels and increased signal-to-noise ratio in 78% of channels. Moreover, it produced the highest Pearson's correlation coefficient between the recovered signal and the original signal, significantly better than the comparison methods (p<0.01, paired t-test). These results indicate that the proposed EMD method is a first choice method for motion artifact correction in fNIRS.

  10. Spatially resolved localized vibrational mode spectroscopy of carbon in liquid encapsulated Czochralski grown gallium arsenide wafers

    SciTech Connect

    Yau, Waifan.

    1988-04-01

    Substitutional carbon on an arsenic lattice site is the shallowest and one of the most dominant acceptors in semi-insulating Liquid Encapsulated Czochralski (LEC) GaAs. However, the role of this acceptor in determining the well known W'' shape spatial variation of neutral EL2 concentration along the diameter of a LEC wafer is not known. In this thesis, we attempt to clarify the issue of the carbon acceptor's effect on this W'' shaped variation by measuring spatial profiles of this acceptor along the radius of three different as-grown LEC GaAs wafers. With localized vibrational mode absorption spectroscopy, we find that the profile of the carbon acceptor is relatively constant along the radius of each wafer. Average values of concentration are 8 {times} 10E15 cm{sup -3}, 1.1 {times} 10E15 cm{sup -3}, and 2.2 {times} 10E15 cm{sup -3}, respectively. In addition, these carbon acceptor LVM measurements indicate that a residual donor with concentration comparable to carbon exists in these wafers and it is a good candidate for the observed neutral EL2 concentration variation. 22 refs., 39 figs.

  11. Raman spectroscopy of optical phonon and charge density wave modes in 1T-TiSe2 exfoliated flakes

    NASA Astrophysics Data System (ADS)

    Cui, Lin; He, Rui; Li, Gaomin; Zhang, Yujun; You, Yumeng; Huang, Mingyuan

    2017-10-01

    1T-TiSe2 is a model transition metal dichalcogenide material that develops charge density waves (CDWs). Here we present variable-temperature Raman spectroscopy study on both CDW and optical phonon modes of 1T-TiSe2 thin layers exfoliated onto SiO2 substrate. Raman scattering intensities of all modes reach a maximum when the sample thickness is about 12 nm. This phenomenon can be explained by optical interference effect between the sample and the substrate. The CDW amplitude modes experience redshift and broadening as temperature increases. We extract CDW transition temperature (TCDW) from temperature dependence of the frequency of A1 gCDW mode. We find that TCDW decreases in thinner flakes, which could be due to extrinsic effects.

  12. Raman and surface-enhanced Raman spectroscopy of amino acids and nucleotide bases for target bacterial vibrational mode identification

    NASA Astrophysics Data System (ADS)

    Guicheteau, Jason; Argue, Leanne; Hyre, Aaron; Jacobson, Michele; Christesen, Steven D.

    2006-05-01

    Raman and surface-enhanced Raman spectroscopy (SERS) studies of bacteria have reported a wide range of vibrational mode assignments associated with biological material. We present Raman and SER spectra of the amino acids phenylalanine, tyrosine, tryptophan, glutamine, cysteine, alanine, proline, methionine, asparagine, threonine, valine, glycine, serine, leucine, isoleucine, aspartic acid and glutamic acid and the nucleic acid bases adenosine, guanosine, thymidine, and uridine to better characterize biological vibrational mode assignments for bacterial target identification. We also report spectra of the bacteria Bacillus globigii, Pantoea agglomerans, and Yersinia rhodei along with band assignments determined from the reference spectra obtained.

  13. Mode specific excited state dynamics study of bis(phenylethynyl)benzene from ultrafast Raman loss spectroscopy

    NASA Astrophysics Data System (ADS)

    Roy, Khokan; Kayal, Surajit; Ariese, Freek; Beeby, Andrew; Umapathy, Siva

    2017-02-01

    Femtosecond transient absorption (fs-TA) and Ultrafast Raman Loss Spectroscopy (URLS) have been applied to reveal the excited state dynamics of bis(phenylethynyl)benzene (BPEB), a model system for one-dimensional molecular wires that have numerous applications in opto-electronics. It is known from the literature that in the ground state BPEB has a low torsional barrier, resulting in a mixed population of rotamers in solution at room temperature. For the excited state this torsional barrier had been calculated to be much higher. Our femtosecond TA measurements show a multi-exponential behaviour, related to the complex structural dynamics in the excited electronic state. Time-resolved, excited state URLS studies in different solvents reveal mode-dependent kinetics and picosecond vibrational relaxation dynamics of high frequency vibrations. After excitation, a gradual increase in intensity is observed for all Raman bands, which reflects the structural reorganization of Franck-Condon excited, non-planar rotamers to a planar conformation. It is argued that this excited state planarization is also responsible for its high fluorescence quantum yield. The time dependent peak positions of high frequency vibrations provide additional information: a rapid, sub-picosecond decrease in peak frequency, followed by a slower increase, indicates the extent of conjugation during different phases of excited state relaxation. The CC triple (-C≡C-) bond responds somewhat faster to structural reorganization than the CC double (>C=C<) bonds. This study deepens our understanding of the excited state of BPEB and analogous linear pi-conjugated systems and may thus contribute to the advancement of polymeric "molecular wires."

  14. Sub-Doppler spectroscopy of the trans-HOCO radical in the OH stretching mode.

    PubMed

    Chang, Chih-Hsuan; Buckingham, Grant T; Nesbitt, David J

    2013-12-19

    Rovibrational spectroscopy of the fundamental OH stretching mode of the trans-HOCO radical has been studied via sub-Doppler high-resolution infrared laser absorption in a discharge slit-jet expansion. The trans-HOCO radical is formed by discharge dissociation of H2O to form OH, which then combines with CO and cools in the Ne expansion to a rotational temperature of 13.0(6) K. Rigorous assignment of both a-type and b-type spectral transitions is made possible by two-line combination differences from microwave studies, with full rovibrational analysis of the spectrum based on a Watson asymmetric top Hamiltonian. Additionally, fine structure splittings of each line due to electron spin are completely resolved, thus permitting all three ε(aa), ε(bb), ε(cc) spin-rotation constants to be experimentally determined in the vibrationally excited state. Furthermore, as both a- and b-type transitions for trans-HOCO are observed for the first time, the ratio of transition dipole moment projections along the a and b principal axes is determined to be μ(a)/μ(b) = 1.78(5), which is in close agreement with density functional quantum theoretical predictions (B3LYP/6-311++g(3df,3pd), μ(a)/μ(b) = 1.85). Finally, we note the energetic possibility in the excited OH stretch state for predissociation dynamics (i.e., trans-HOCO → H + CO2), with the present sub-Doppler line widths providing a rigorous upper limit of >2.7 ns for the predissociation lifetime.

  15. Mode specific excited state dynamics study of bis(phenylethynyl)benzene from ultrafast Raman loss spectroscopy.

    PubMed

    Roy, Khokan; Kayal, Surajit; Ariese, Freek; Beeby, Andrew; Umapathy, Siva

    2017-02-14

    Femtosecond transient absorption (fs-TA) and Ultrafast Raman Loss Spectroscopy (URLS) have been applied to reveal the excited state dynamics of bis(phenylethynyl)benzene (BPEB), a model system for one-dimensional molecular wires that have numerous applications in opto-electronics. It is known from the literature that in the ground state BPEB has a low torsional barrier, resulting in a mixed population of rotamers in solution at room temperature. For the excited state this torsional barrier had been calculated to be much higher. Our femtosecond TA measurements show a multi-exponential behaviour, related to the complex structural dynamics in the excited electronic state. Time-resolved, excited state URLS studies in different solvents reveal mode-dependent kinetics and picosecond vibrational relaxation dynamics of high frequency vibrations. After excitation, a gradual increase in intensity is observed for all Raman bands, which reflects the structural reorganization of Franck-Condon excited, non-planar rotamers to a planar conformation. It is argued that this excited state planarization is also responsible for its high fluorescence quantum yield. The time dependent peak positions of high frequency vibrations provide additional information: a rapid, sub-picosecond decrease in peak frequency, followed by a slower increase, indicates the extent of conjugation during different phases of excited state relaxation. The CC triple (-C≡C-) bond responds somewhat faster to structural reorganization than the CC double (>C=C<) bonds. This study deepens our understanding of the excited state of BPEB and analogous linear pi-conjugated systems and may thus contribute to the advancement of polymeric "molecular wires."

  16. Optical Dark-Field and Electron Energy Loss Imaging and Spectroscopy of Symmetry-Forbidden Modes in Loaded Nanogap Antennas.

    PubMed

    Brintlinger, Todd; Herzing, Andrew A; Long, James P; Vurgaftman, Igor; Stroud, Rhonda; Simpkins, B S

    2015-06-23

    We have produced large numbers of hybrid metal-semiconductor nanogap antennas using a scalable electrochemical approach and systematically characterized the spectral and spatial character of their plasmonic modes with optical dark-field scattering, electron energy loss spectroscopy with principal component analysis, and full wave simulations. The coordination of these techniques reveal that these nanostructures support degenerate transverse modes which split due to substrate interactions, a longitudinal mode which scales with antenna length, and a symmetry-forbidden gap-localized transverse mode. This gap-localized transverse mode arises from mode splitting of transverse resonances supported on both antenna arms and is confined to the gap load enabling (i) delivery of substantial energy to the gap material and (ii) the possibility of tuning the antenna resonance via active modulation of the gap material's optical properties. The resonant position of this symmetry-forbidden mode is sensitive to gap size, dielectric strength of the gap material, and is highly suppressed in air-gapped structures which may explain its absence from the literature to date. Understanding the complex modal structure supported on hybrid nanosystems is necessary to enable the multifunctional components many seek.

  17. High Resolution Spectroscopy of 1,2-Difluoroethane in a Molecular Beam: A Case Study of Vibrational Mode-Coupling

    DTIC Science & Technology

    1992-05-29

    excited electronic potential surfaces. Pyrazine , for example, has been studied extensively using rotationally resolved electronic spectroscopy, providing...parameters were varied to optimize the fit of the calculated spectrum to the experimental spectrum. A modified simulated annealing algorithm was employed... simulate vibrational mode coupling from a degenerate bright state to a split dark state in 15 ==..==, .asl lailml t ia m m . M Mi an effort to reproduce

  18. Understanding the vibrational mode-specific polarization effects in femtosecond Raman-induced Kerr-effect spectroscopy.

    PubMed

    McAnally, Michael O; Guo, Yinsheng; Balakrishnan, Gurusamy; Schatz, George C; Van Duyne, Richard P

    2016-11-15

    Optically heterodyne-detected femtosecond Raman-induced Kerr-effect spectroscopy (OHD-FRIKES) was observed in neat cyclohexane. In this Letter, an examination of the effect of the Raman pump ellipticity on the multiplex OHD-FRIKES spectra is discussed. The Raman pump ellipticity scanned OHD-FRIKES results reproduce anomalous observables from previous OHD-FRIKES experiments and suggest new methods of tracking transient vibrational mode polarization in complex systems.

  19. Infrared Spectroscopy of the Transiting Exoplanets HD189733b and XO-1 Using Hubble WFC3 in Spatial Scan Mode

    NASA Astrophysics Data System (ADS)

    Deming, Drake; Wilkins, A.; McCullough, P.; Madhusudhan, N.; Agol, E.; Burrows, A.; Charbonneau, D.; Clampin, M.; Desert, J.; Gilliland, R.; Knutson, H.; Mandell, A.; Ranjan, S.; Seager, S.; Showman, A.

    2012-01-01

    Infrared transmission spectroscopy of the exoplanets HD189733b and XO-1 has been previously reported by Swain et al. and Tinetti et al. based on observations using the NICMOS instrument on the Hubble Space Telescope. The robustness of those results has been questioned, because derivation of the exoplanetary spectrum required decorrelating strong instrumental systematic effects in the NICMOS data. We here discuss results from HST/WFC3 grism 1.1-1.7 micron spectroscopy of these planets during transit. WFC3 instrumental signatures are smaller in both amplitude and complexity as compared to NICMOS. Moreover, we use a new spatial scan mode to trail the stars perpendicular to the dispersion direction during WFC3 exposures, and this increases the efficiency of the observations and reduces persistence effects in the detector. We derive the 1.4-micron water absorption spectrum of these planets during transit, discuss implications for these exoplanetary atmospheres, and compare our results to the NICMOS spectroscopy.

  20. SPHERE/IRDIS: final performance assessment of the dual-band imaging and long slit spectroscopy modes

    NASA Astrophysics Data System (ADS)

    Vigan, A.; Langlois, M.; Dohlen, K.; Zurlo, A.; Moutou, C.; Costille, A.; Gry, C.; Madec, F.; Le Mignant, D.; Gluck, Laurence; Sauvage, J.-F.

    2014-07-01

    The near-infrared imager and spectrograph IRDIS is one of the three science sub-systems of VLT/SPHERE dedicated to the detection and characterization of giant exoplanets at large orbital radii. It offers a wide range of observational modes including dual-band imaging (DBI) with very low differential aberrations, and long slit spectroscopy (LSS) coupled with a classical Lyot coronagraph at low (R = ~50) and medium (R = ~330) resolution. Over the course of 2012 and 2013, IRDIS has been extensively tested in laboratory during the integration and optimization of the SPHERE system. At the beginning of 2014, the instrument has been shipped to Chile and has been reintegrated at the Paranal observatory. We present here a detailed summary of the performance of the DBI and LSS modes obtained in laboratory. We provide a wide range of results covering different observing conditions and setups for the DBI mode, and we show that the instrument reaches the technical specifications in terms of contrast. We also identify some of the limitations that prevent going down much further in contrast while testing in the laboratory. For the LSS mode, we present results obtained both at low and medium resolution in the main setups that will be offered to future users. We demonstrate that the LSS mode will provide a useful characterization tool for the planets detected in DBI mode. Finally, we present the first results obtained on-sky during the first commissioning run of SPHERE at the VLT.

  1. Tunable single-longitudinal-mode operation of an injection-locked TEA CO2 laser. [ozone absorption spectroscopy

    NASA Technical Reports Server (NTRS)

    Megie, G.; Menzies, R. T.

    1979-01-01

    The tunable single-longitudinal-mode operation of a TEA CO2 laser by an injection technique using a CW waveguide laser as the master oscillator is reported. With the experimental arrangement described, in which the waveguide laser frequency is tuned to correspond to one of the oscillating longitudinal modes of the TEA laser, single-longitudinal-mode operation was achieved with no apparent reduction in the TEA output energy, on various CO2 lines with frequency offsets from the line center as large as 300 MHz. The capability of this technique for high-resolution spectroscopy or atmospheric lidar studies is demonstrated by the recording of the absorption spectrum of a strong ozone line.

  2. Spectroscopy of the Schwarzschild black hole at arbitrary frequencies.

    PubMed

    Casals, Marc; Ottewill, Adrian

    2012-09-14

    Linear field perturbations of a black hole are described by the Green function of the wave equation that they obey. After Fourier decomposing the Green function, its two natural contributions are given by poles (quasinormal modes) and a largely unexplored branch cut in the complex frequency plane. We present new analytic methods for calculating the branch cut on a Schwarzschild black hole for arbitrary values of the frequency. The branch cut yields a power-law tail decay for late times in the response of a black hole to an initial perturbation. We determine explicitly the first three orders in the power-law and show that the branch cut also yields a new logarithmic behavior T(-2ℓ-5)lnT for late times. Before the tail sets in, the quasinormal modes dominate the black hole response. For electromagnetic perturbations, the quasinormal mode frequencies approach the branch cut at large overtone index n. We determine these frequencies up to n(-5/2) and, formally, to arbitrary order. Highly damped quasinormal modes are of particular interest in that they have been linked to quantum properties of black holes.

  3. Fourier Transform Absorption Spectroscopy of C_3 in the ν_3 Antisymmetric Stretch Mode Region

    NASA Astrophysics Data System (ADS)

    Vervloet, Michel; Martin-Drumel, Marie-Aline; Tokaryk, Dennis W.; Pirali, Olivier

    2017-06-01

    The C_3 molecule has been detected in a variety of astrophysical objects thanks to the well-known 4050 Å (A^1Π_u-X^1Σ ^+ _g) electronic transition as well as the two IR active modes of the electronic ground state: ν_2 (˜ 63.42 cm^{-1}) and ν_3 (˜ 2040.02 cm^{-1}). Previous laboratory data in the ν_3 region, obtained using diode laser spectroscopy and the photolysis of allene to produce C_3, permitted measurement of the fundamental (0,0,1)Σ-(0,0,0)Σ as well as the hot bands: (0,1,1)Π-(0,1,0)Π; (0,2,1)Σ-(0,2,0)Σ; (0,2,1)Δ-(0,2,0)Δ and provided insights on the anharmonicity of the (0,nν_2,1) vibrational pattern. We have recorded the absorption spectrum of C_3 in the 1800-2100 cm^{-1} region (at a resolution of 0.003 cm^{-1}) using the Bruker IFS 125 Fourier Transform spectrometer at the AILES beamline of Synchrotron SOLEIL. C_3 was produced in a DC discharge of methane heavily diluted in helium. The rovibrational temperature of C_3 produced in our discharge is noticeably higher than in Ref. [4], which allowed us to extend measurements to higher J values. More interestingly, we assigned new hot bands involving higher quanta of the ν_2 bending states: (0,nν_2,1) with n ranging from 0 to 5. Despite the absence of Q branches for these bands, which results in a possible ambiguous J-assignment of P and R lines, the large variety of data considered in this work, in addition to our experimental data and including observations of comet spectra, allows confident assignments. L. Gausset, G. Herzberg, A. Lagerqvist, B. Rosen, Astrophysical Journal, 45-81 (1965); T. F. Giesen et al., The Astrophysical Journal, 551, L181-L184 (2001) K. W. Hinkle, J. J. Keady, P. F. Bernath, Science, 241, 1319-1322 (1988) K. Kawaguchi et al., J. Chem. Phys., 91, 1953-1957 (1989)

  4. Edge mode spectroscopy and imaging for film edge properties in magnetic nanostructures

    NASA Astrophysics Data System (ADS)

    McMichael, Robert

    2014-03-01

    Lithography is an act of violence. Often, films are almost entirely obliterated by patterning, leaving only nanostructures behind with film edges that have borne the brunt of the damage, edges that carry with them the scars of energetic ion bombardment, reactive ions, liftoff and exposure to ambient conditions. In this talk, I will present a variation on ferromagnetic resonance force microscopy that can provide insight into the magnetic properties of film edges in magnetic nanostructures. The method relies on the non-uniformity of the magnetic field in patterned-film nanostructures that are magnetized in-plane, specifically, the low-field regions that form near where the magnetization is directed normal to the edge. In these regions, localized precession forms as trapped spin wave modes, and the resonance condition of these modes serves as an indicator of the edge properties. I will present modeling and measurements on a 500 nm diameter, 25 nm thick Permalloy disk to illustrate the method. Micromagnetic modeling of this disk predicts a main mode that is nearly uniform across the sample and three localized edge modes with higher resonance fields. The spectra measured with various tip positions and mode imaging are consistent with the modeling results. In addition to a strong center mode, three distinct edge modes are observed when the tip is near the disk edge. For a symmetric disk, the modeling predicts that the edge mode resonances are identical on the two opposite edges. However, the measured edge mode resonances on opposite edges of the disk are detected at different resonance fields, suggesting inhomogeneity of the edge properties. By rotating the applied field, we control the position of the localized edge mode along the edge of the disk and confirm that the edge mode resonance field has a strong angular dependence, showing that edge mode properties can vary significantly in a nominally circular disk.

  5. Two-dimensional photon-echo spectroscopy at a conical intersection: A two-mode pyrazine model with dissipation

    NASA Astrophysics Data System (ADS)

    Sala, Matthieu; Egorova, Dassia

    2016-12-01

    The multi-dimensional electronic spectroscopy of ultrafast nuclear dynamics at conical intersections (CI) is an emerging field of investigation, which profits also from the recent extension of the techniques to the UV domain. We present a detailed computational study of oscillatory signatures in two-dimensional (2D) photon-echo spectroscopy (also known as 2D electronic spectroscopy, 2DES) for the two-mode pyrazine model with dissipation. Conventional 2D signals as well as the resulting beating maps are considered. Although of a reduced character, the model captures quite well all the main signatures of the excited-state dynamics of the molecule. Due to the ultrafast relaxation via the CI and no excited-state absorption from the low-lying dark state, the oscillatory components of the signal are found to be predominantly determined by the ground state bleach contribution. They reflect, therefore, the ground-state vibrational coherence induced in the Raman active mode. Beating maps provide a way to experimentally differentiate between ground state bleach and stimulated emission oscillatory components. The ultrafast decay of the latter constitutes a clear indirect signature of the CI. In the considered model, because of the sign properties of the involved transition dipole moments, the dominance of the ground-state coherence leads to anti-correlated oscillations of cross peaks located at symmetric positions with respect to the main diagonal.

  6. Multi-species sensing using multi-mode absorption spectroscopy with mid-infrared interband cascade lasers

    NASA Astrophysics Data System (ADS)

    O'Hagan, S.; Northern, J. H.; Gras, B.; Ewart, P.; Kim, C. S.; Kim, M.; Merritt, C. D.; Bewley, W. W.; Canedy, C. L.; Vurgaftman, I.; Meyer, J. R.

    2016-06-01

    The application of an interband cascade laser, ICL, to multi-mode absorption spectroscopy, MUMAS, in the mid-infrared region is reported. Measurements of individual mode linewidths of the ICL, derived from the pressure dependence of lineshapes in MUMAS signatures of single, isolated, lines in the spectrum of HCl, were found to be in the range 10-80 MHz. Multi-line spectra of methane were recorded using spectrally limited bandwidths, of approximate width 27 cm-1, defined by an interference filter, and consist of approximately 80 modes at spectral locations spanning the 100 cm-1 bandwidth of the ICL output. Calibration of the methane pressures derived from MUMAS data using a capacitance manometer provided measurements with an uncertainty of 1.1 %. Multi-species sensing is demonstrated by the simultaneous detection of methane, acetylene and formaldehyde in a gas mixture. Individual partial pressures of the three gases are derived from best fits of model MUMAS signatures to the data with an experimental error of 10 %. Using an ICL, with an inter-mode interval of ~10 GHz, MUMAS spectra were recorded at pressures in the range 1-10 mbar, and, based on the data, a potential minimum detection limit of the order of 100 ppmv is estimated for MUMAS at atmospheric pressure using an inter-mode interval of 80 GHz.

  7. Dispersive Fourier transform using few-mode fibers for real-time and high-speed spectroscopy

    NASA Astrophysics Data System (ADS)

    Qiu, Yi; Zhang, Chi; Wong, Kenneth K. Y.; Tsia, Kevin K.

    2012-01-01

    Dispersive Fourier Transform (DFT) is a powerful technique for real-time and high-speed spectroscopy. In DFT, the spectral information of an optical pulse is mapped into time using group velocity dispersion (GVD) in the dispersive fibers with an ultrafast real-time spectral acquisition rate (>10 MHz). Typically, multi-mode fiber (MMF) is not recommended for performing DFT because the modal dispersion, which occurs simultaneously with GVD, introduces the ambiguity in the wavelength-to-time mapping during DFT. Nevertheless, we here demonstrate that a clear wavelength-to-time mapping in DFT can be achieved by using the few-mode fibers (FMFs) which, instead of having hundreds of propagation modes, support only a few modes. FMF-based DFT becomes appealing when it operates at the shorter wavelengths e.g. 1-μm range, a favorable spectral window for biomedical diagnostics, where low-cost single mode fibers (SMFs) and high-performance dispersion-engineered fibers are not readily available for DFT. By employing the telecommunication SMFs (e.g. SMF28), which are in effect FMFs in the 1-μm range as their cut-off wavelength is ~1260 nm, we observe that a 3nm wide spectrum can be clearly mapped into time with a GVD as high as -72ps/nm and a loss of 5 dB/km at a spectral acquisition rate of 20 MHz. Moreover, its larger core size than the high-cost 1-μm SMFs renders FMFs to exhibit less nonlinearity, especially high-power amplification is implemented during DFT to enhance the detection sensitivity without compromising the speed. Hence, FMF-based DFT represents a cost-effective approach to realize high-speed DFT-based spectroscopy particularly in the biomedical diagnostics spectral window.

  8. Zero-mode clad waveguides for performing spectroscopy with confined effective observation volumes

    DOEpatents

    Levene, Michael J.; Korlach, Jonas; Turner, Stephen W.; Craighead, Harold G.; Webb, Watt W.

    2005-07-12

    The present invention is directed to a method and an apparatus for analysis of an analyte. The method involves providing a zero-mode waveguide which includes a cladding surrounding a core where the cladding is configured to preclude propagation of electromagnetic energy of a frequency less than a cutoff frequency longitudinally through the core of the zero-mode waveguide. The analyte is positioned in the core of the zero-mode waveguide and is then subjected, in the core of the zero-mode waveguide, to activating electromagnetic radiation of a frequency less than the cut-off frequency under conditions effective to permit analysis of the analyte in an effective observation volume which is more compact than if the analysis were carried out in the absence of the zero-mode waveguide.

  9. Surface vibrational modes of the topological insulator Bi2Se3 observed by Raman spectroscopy

    NASA Astrophysics Data System (ADS)

    Kung, H.-H.; Salehi, M.; Boulares, I.; Kemper, A. F.; Koirala, N.; Brahlek, M.; LošÅ¥ák, P.; Uher, C.; Merlin, R.; Wang, X.; Cheong, S.-W.; Oh, S.; Blumberg, G.

    2017-06-01

    We present a polarization resolved Raman scattering study of surface vibration modes in the topological insulator Bi2Se3 single crystal and thick films. Besides the four Raman active bulk phonons, we observed four additional modes with much weaker intensity and slightly lower energy than the bulk counterparts. Using symmetry analysis, we assigned these additional modes to out-of-plane surface phonons. Comparing with first-principle calculations, we conclude that the appearance of these modes is due to c -axis lattice distortion and van der Waals gap expansion near the crystal surface. Two of the surface modes at 60 and 173 cm-1 are associated with Raman active A1 g bulk phonon modes, the other two at 136 and 158 cm-1 are associated with infrared active bulk phonons with A2 u symmetry. The latter become Raman allowed due to reduction of crystalline symmetry from D3 d in the bulk to C3 v on the crystal surface. In particular, the 158 cm-1 surface phonon mode shows a Fano line shape under resonant excitation, suggesting interference in the presence of electron-phonon coupling of the surface excitations.

  10. XAFS data acquisition with 2D-detectors: Transmission mode XAFS and grazing incidence EXAFS spectroscopy

    NASA Astrophysics Data System (ADS)

    Lützenkirchen-Hecht, D.; Gasse, J.-C.; Bögel, R.; Wagner, R.; Frahm, R.

    2016-05-01

    XAFS-experiments in transmission and reflection modes have been performed using a Pilatus 100K pixel detector. Transmission mode XAFS spectra from a Co metal foil and Co3O4 were recorded to evaluate the data quality offered by this 2D-detector. Furthermore, the pixel detector was also used to measure reflection mode grazing incidence EXAFS data. Using different regions of interest in the collected scattering patterns, we will show that the diffuse scattering can be separated for the different contributing surfaces and interfaces, allowing simultaneous investigations of surfaces and buried interfaces within multi-layered samples.

  11. Effect of multipole excitations in electron energy-loss spectroscopy of surface plasmon modes in silver nanowires

    SciTech Connect

    Zhou, Xiuli; Norris, Theodore B.; Hörl, Anton; Trügler, Andreas; Hohenester, Ulrich; Herzing, Andrew A.

    2014-12-14

    We have characterized the surface plasmon resonance (SPR) in silver nanowires using spatially resolved electron energy loss spectroscopy (EELS) in the scanning transmission electron microscope. Non-symmetric EELS spectra due to high-k SPR propagation along the nanowire and spectral shifts due to higher-order mode excitation are observed when the beam is positioned near the tip of the nanowire. When the beam is far from the tip region and on the side of nanowire, no spectral shifts are observed as the beam is scanned in the radial direction of the nanowire. The experimental spectra are compared with three different theoretical approaches: direct numerical calculation of the energy loss, analytical models for energy loss, and numerical simulations using an optical model. All three models reproduce the spectral shifts as the electron beam approaches the cap of the nanowire. The analytical model reveals the origin of the shifts in high-order plasmon mode excitation.

  12. Efficient anharmonic vibrational spectroscopy for large molecules using local-mode coordinates

    NASA Astrophysics Data System (ADS)

    Cheng, Xiaolu; Steele, Ryan P.

    2014-09-01

    This article presents a general computational approach for efficient simulations of anharmonic vibrational spectra in chemical systems. An automated local-mode vibrational approach is presented, which borrows techniques from localized molecular orbitals in electronic structure theory. This approach generates spatially localized vibrational modes, in contrast to the delocalization exhibited by canonical normal modes. The method is rigorously tested across a series of chemical systems, ranging from small molecules to large water clusters and a protonated dipeptide. It is interfaced with exact, grid-based approaches, as well as vibrational self-consistent field methods. Most significantly, this new set of reference coordinates exhibits a well-behaved spatial decay of mode couplings, which allows for a systematic, a priori truncation of mode couplings and increased computational efficiency. Convergence can typically be reached by including modes within only about 4 Å. The local nature of this truncation suggests particular promise for the ab initio simulation of anharmonic vibrational motion in large systems, where connection to experimental spectra is currently most challenging.

  13. Efficient anharmonic vibrational spectroscopy for large molecules using local-mode coordinates.

    PubMed

    Cheng, Xiaolu; Steele, Ryan P

    2014-09-14

    This article presents a general computational approach for efficient simulations of anharmonic vibrational spectra in chemical systems. An automated local-mode vibrational approach is presented, which borrows techniques from localized molecular orbitals in electronic structure theory. This approach generates spatially localized vibrational modes, in contrast to the delocalization exhibited by canonical normal modes. The method is rigorously tested across a series of chemical systems, ranging from small molecules to large water clusters and a protonated dipeptide. It is interfaced with exact, grid-based approaches, as well as vibrational self-consistent field methods. Most significantly, this new set of reference coordinates exhibits a well-behaved spatial decay of mode couplings, which allows for a systematic, a priori truncation of mode couplings and increased computational efficiency. Convergence can typically be reached by including modes within only about 4 Å. The local nature of this truncation suggests particular promise for the ab initio simulation of anharmonic vibrational motion in large systems, where connection to experimental spectra is currently most challenging.

  14. Efficient anharmonic vibrational spectroscopy for large molecules using local-mode coordinates

    SciTech Connect

    Cheng, Xiaolu; Steele, Ryan P.

    2014-09-14

    This article presents a general computational approach for efficient simulations of anharmonic vibrational spectra in chemical systems. An automated local-mode vibrational approach is presented, which borrows techniques from localized molecular orbitals in electronic structure theory. This approach generates spatially localized vibrational modes, in contrast to the delocalization exhibited by canonical normal modes. The method is rigorously tested across a series of chemical systems, ranging from small molecules to large water clusters and a protonated dipeptide. It is interfaced with exact, grid-based approaches, as well as vibrational self-consistent field methods. Most significantly, this new set of reference coordinates exhibits a well-behaved spatial decay of mode couplings, which allows for a systematic, a priori truncation of mode couplings and increased computational efficiency. Convergence can typically be reached by including modes within only about 4 Å. The local nature of this truncation suggests particular promise for the ab initio simulation of anharmonic vibrational motion in large systems, where connection to experimental spectra is currently most challenging.

  15. Low-frequency vibrational modes of benzoic acid investigated by terahertz time-domain spectroscopy and theoretical simulations

    NASA Astrophysics Data System (ADS)

    Yan, Hui; Fan, Wen-hui; Zheng, Zhuan-ping

    2011-08-01

    In this paper, the low-frequency vibrational modes of crystalline benzoic acid (BA) have been investigated by terahertz time-domain spectroscopy (THz-TDS) and theoretical simulations based on the linearity combination of atomic orbital within the Density Functional Theory (DFT) as well as ab initio molecular orbital method at second-order Moller-Plesset Perturbation Theory (MP2) level for single molecule and dimer. Experimentally, a series of prominent absorption features of pure benzoic acid relevant to intra- and inter-molecular vibrational modes have been obtained below 4 THz at room temperature. For the theoretical simulations, geometry-optimization results of bond lengths and dihedral angles in both BA monomer and dimer are very close to experimental neutron diffraction measurements. Furthermore, the simulation results demonstrate absorption profile centered at 1.89 THz contains low-frequency modes of Ph-COOH twisting due to intramolecular motion and cogwheel owing to intermolecular motion. All the intra- and inter-molecular vibrational modes measured have also been assigned.

  16. Prediction of olive quality using FT-NIR spectroscopy in reflectance and transmittance modes

    USDA-ARS?s Scientific Manuscript database

    The objective of this research was to use FT-NIR spectroscopy to predict the firmness, oil content and color of two olive (Olea europaea L) varieties (‘Ayvalik’ and ‘Gemlik’). Spectral measurements were performed on the intact olives for the wavelengths of 780-2500 nm in reflectance and for 800-1725...

  17. Nondestructive Olive Quality Detection Using FT-NIR Spectroscopy in Reflectance Mode

    USDA-ARS?s Scientific Manuscript database

    Quality features (firmness, oil content and color in terms of hue and chroma) of two olive (Olea europaea L) varieties (‘Ayvalik’ and ‘Gemlik’) were predicted using Fourier transform near-infrared (FT-NIR) spectroscopy. Reflectance measurements of intact olives were performed using a bifurcated fibe...

  18. Qualitative analysis of collective mode frequency shifts in L-alanine using terahertz spectroscopy.

    PubMed

    Taulbee, Anita R; Heuser, Justin A; Spendel, Wolfgang U; Pacey, Gilbert E

    2009-04-01

    We have observed collective mode frequency shifts in deuterium-substituted L-alanine, three of which have previously only been calculated. Terahertz (THz) absorbance spectra were acquired at room temperature in the spectral range of 66-90 cm(-1), or 2.0-2.7 THz, for L-alanine (L-Ala) and four L-Ala compounds in which hydrogen atoms (atomic mass = 1 amu) were substituted with deuterium atoms (atomic mass = 2 amu): L-Ala-2-d, L-Ala-3,3,3-d(3), L-Ala-2,3,3,3-d(4), and L-Ala-d(7). The absorbance maxima of two L-Ala collective modes in this spectral range were recorded for multiple spectral measurements of each compound, and the magnitude of each collective mode frequency shift due to increased mass of these specific atoms was evaluated for statistical significance. Calculations were performed which predict the THz absorbance frequencies based on the estimated reduced mass of the modes. The shifts in absorbance maxima were correlated with the location(s) of the substituted deuterium atom(s) in the L-alanine molecule, and the atoms contributing to the absorbing delocalized mode in the crystal structure were deduced using statistics described herein. The statistical analyses presented also indicate that the precision of the method allows reproducible frequency shifts as small as 1 cm(-1) or 0.03 THz to be observed and that these shifts are not random error in the measurement.

  19. Gravitational quasi-normal modes of static R 2 Anti-de Sitter black holes

    NASA Astrophysics Data System (ADS)

    Ma, Hong; Li, Jin

    2017-06-01

    Not Available Project supported by the National Natural Science Foundation of China (Grant Nos. 11205254, 11178018, 11375279, and 11605015), the Fundamental Research Funds for the Central Universities, China (Grant Nos. 106112016CDJXY300002 and CDJRC10300003), the Chinese State Scholarship Fund, FAPESP (Grant No. 2012/08934-0), and the Natural Science Foundation Project of CQ CSTC (Grant No. 2011BB0052).

  20. Investigation of the binding modes between AIE-active molecules and dsDNA by single molecule force spectroscopy

    NASA Astrophysics Data System (ADS)

    Chen, Ying; Ma, Ke; Hu, Ting; Jiang, Bo; Xu, Bin; Tian, Wenjing; Sun, Jing Zhi; Zhang, Wenke

    2015-05-01

    AIE (aggregation-induced emission)-active molecules hold promise for the labeling of biomolecules as well as living cells. The study of the binding modes of such molecules to biomolecules, such as nucleic acids and proteins, will shed light on a deeper understanding of the mechanisms of molecular interactions and eventually facilitate the design/preparation of new AIE-active bioprobes. Herein, we studied the binding modes of double-stranded DNA (dsDNA) with two types of synthetic AIE-active molecules, namely, tetraphenylethene-derived dicationic compounds (cis-TPEDPy and trans-TPEDPy) and anthracene-derived dicationic compounds (DSAI and DSABr-C6) using single molecule force spectroscopy (SMFS) and circular dichroism (CD) spectroscopy. The experimental data indicate that DSAI can strongly intercalate into DNA base pairs, while DSABr-C6 is unable to intercalate into DNA due to the steric hindrance of the alkyl side chains. Cis-TPEDPy and trans-TPEDPy can also intercalate into DNA base pairs, but the binding shows strong ionic strength dependence. Multiple binding modes of TPEDPy with dsDNA have been discussed. In addition, the electrostatic interaction enhanced intercalation of cis-TPEDPy with dsDNA has also been revealed.AIE (aggregation-induced emission)-active molecules hold promise for the labeling of biomolecules as well as living cells. The study of the binding modes of such molecules to biomolecules, such as nucleic acids and proteins, will shed light on a deeper understanding of the mechanisms of molecular interactions and eventually facilitate the design/preparation of new AIE-active bioprobes. Herein, we studied the binding modes of double-stranded DNA (dsDNA) with two types of synthetic AIE-active molecules, namely, tetraphenylethene-derived dicationic compounds (cis-TPEDPy and trans-TPEDPy) and anthracene-derived dicationic compounds (DSAI and DSABr-C6) using single molecule force spectroscopy (SMFS) and circular dichroism (CD) spectroscopy. The

  1. Soft-mode spectroscopy in cubic BaTiO3 by hyper-Raman scattering

    NASA Astrophysics Data System (ADS)

    Vogt, H.; Sanjurjo, J. A.; Rossbroich, G.

    1982-11-01

    Hyper-Raman scattering from cubic BaTiO3 is studied to clarify the controversies about the low-frequency dielectric response in this material. Applying the fluctuation-dissipation theorem, we obtain the imaginary part ɛ''(Ω) of the dielectric function in the wave-number range from 3 to 150 cm-1. ɛ''(Ω) can be adequately described by a classical single-oscillator dispersion formula. In approaching the Curie temperature, we find a continuous decrease of the mode frequency Ω0. The relative damping constant γΩ0 exceeds 2, so that the mode may be referred to as intermediate between oscillator and relaxator. Because of the high damping ɛ''(Ω) can be formally written as the sum of two overdamped oscillator contributions. This would lead to the concept of a soft-mode saturation and an extra dispersion mechanism as has been recently inferred from the far-infrared reflectivity spectrum. However, we do not find any evidence for this mode splitting and, so far, regard it as artificial.

  2. Coherent spectroscopy of rare-earth-metal-ion-doped whispering-gallery-mode resonators

    SciTech Connect

    McAuslan, D. L.; Korystov, D.; Longdell, J. J.

    2011-06-15

    We perform an investigation into the properties of Pr{sup 3+}:Y{sub 2}SiO{sub 5} whispering-gallery-mode resonators as a first step toward achieving the strong coupling regime of cavity QED with rare-earth-metal-ion-doped crystals. Direct measurement of cavity QED parameters are made using photon echoes, giving good agreement with theoretical predictions. By comparing the ions at the surface of the resonator to those in the center, it is determined that the physical process of making the resonator does not negatively affect the properties of the ions. Coupling between the ions and resonator is analyzed through the observation of optical bistability and normal-mode splitting.

  3. Precision single mode fibre integral field spectroscopy with the RHEA spectrograph

    NASA Astrophysics Data System (ADS)

    Rains, Adam D.; Ireland, Michael J.; Jovanovic, Nemanja; Feger, Tobias; Bento, Joao; Schwab, Christian; Coutts, David W.; Guyon, Olivier; Arriola, Alexander; Gross, Simon

    2016-08-01

    The RHEA Spectrograph is a single-mode echelle spectrograph designed to be a replicable and cost effective method of undertaking precision radial velocity measurements. Two versions of RHEA currently exist, one located at the Australian National University in Canberra, Australia (450 - 600nm wavelength range), and another located at the Subaru Telescope in Hawaii, USA (600 - 800 nm wavelength range). Both instruments have a novel fibre feed consisting of an integral field unit injecting light into a 2D grid of single mode fibres. This grid of fibres is then reformatted into a 1D array at the input of the spectrograph (consisting of the science fibres and a reference fibre capable of receiving a white-light or xenon reference source for simultaneous calibration). The use of single mode fibres frees RHEA from the issue of modal noise and significantly reduces the size of the optics used. In addition to increasing the overall light throughput of the system, the integral field unit allows for cutting edge science goals to be achieved when operating behind the 8.2m Subaru Telescope and the SCExAO adaptive optics system. These include, but are not limited to: resolved stellar photospheres; resolved protoplanetary disk structures; resolved Mira shocks, dust and winds; and sub-arcsecond companions. We present details and results of early tests of RHEA@Subaru and progress towards the stated science goals.

  4. Libration induced stretching mode excitation for pump-probe spectroscopy in pure liquid water.

    PubMed

    Amir, Wafa; Gallot, Guilhem; Hache, François

    2004-10-22

    We developed an experimental approach to study pure liquid water in the infrared and avoid thermal effects. This technique is based on libration induced stretching excitation of water molecules. A direct correspondence between frequencies within the libration and OH stretching bands is demonstrated. Energy diffusion is studied in pure liquid water by measuring wave packet dynamics of OH stretching vibrator with infrared femtosecond spectroscopy. Wave packet dynamics reveals ultrafast energy dynamics and reflects 130 fs intermolecular energy transfer between water vibrators. Energy diffusion is almost two orders of magnitude faster than self diffusion in water.

  5. Asymptotic quasinormal frequencies of different spin fields in spherically symmetric black holes

    SciTech Connect

    Cho, H. T.

    2006-01-15

    We consider the asymptotic quasinormal frequencies of various spin fields in Schwarzschild and Reissner-Nordstroem black holes. In the Schwarzschild case, the real part of the asymptotic frequency is ln3 for the spin 0 and the spin 2 fields, while for the spin 1/2, the spin 1, and the spin 3/2 fields it is zero. For the nonextreme charged black holes, the spin 3/2 Rarita-Schwinger field has the same asymptotic frequency as that of the integral spin fields. However, the asymptotic frequency of the Dirac field is different, and its real part is zero. For the extremal case, which is relevant to the supersymmetric consideration, all the spin fields have the same asymptotic frequency, the real part of which is zero. For the imaginary parts of the asymptotic frequencies, it is interesting to see that it has a universal spacing of 1/4M for all the spin fields in the single-horizon cases of the Schwarzschild and the extreme Reissner-Nordstroem black holes. The implications of these results to the universality of the asymptotic quasinormal frequencies are discussed.

  6. Key hydride vibrational modes in [NiFe] hydrogenase model compounds studied by resonance Raman spectroscopy and density functional calculations.

    PubMed

    Shafaat, Hannah S; Weber, Katharina; Petrenko, Taras; Neese, Frank; Lubitz, Wolfgang

    2012-11-05

    Hydrogenase proteins catalyze the reversible conversion of molecular hydrogen to protons and electrons. While many enzymatic states of the [NiFe] hydrogenase have been studied extensively, there are multiple catalytically relevant EPR-silent states that remain poorly characterized. Analysis of model compounds using new spectroscopic techniques can provide a framework for the study of these elusive states within the protein. We obtained optical absorption and resonance Raman (RR) spectra of (dppe)Ni(μ-pdt)Fe(CO)(3) and [(dppe)Ni(μ-pdt)(μ-H)Fe(CO)(3)][BF(4)], which are structural and functional model compounds for the EPR-silent Ni-SI and Ni-R states of the [NiFe] hydrogenase active site. The studies presented here use RR spectroscopy to probe vibrational modes of the active site, including metal-hydride stretching vibrations along with bridging ligand-metal and Fe-CO bending vibrations, with isotopic substitution used to identify key metal-hydride modes. The metal-hydride vibrations are essentially uncoupled and represent isolated, localized stretching modes; the iron-hydride vibration occurs at 1530 cm(-1), while the nickel-hydride vibration is observed at 945 cm(-1). The significant discrepancy between the metal-hydride vibrational frequencies reflects the slight asymmetry in the metal-hydride bond lengths. Additionally, time-dependent density functional theory (TD-DFT) calculations were carried out to obtain theoretical RR spectra of these compounds. On the basis of the detailed comparison of theory and experiment, the dominant electronic transitions and significant normal modes probed in the RR experiments were assigned; the primary transitions in the visible wavelengths represent metal-to-metal and metal-to-ligand charge transfer bands. Inherent properties of metal-hydride vibrational modes in resonance Raman spectra and DFT calculations are discussed together with the prospects of observing such vibrational modes in metal-hydride-containing proteins. Such a

  7. Orientations of nonlocal vibrational modes from combined experimental and theoretical sum frequency spectroscopy

    NASA Astrophysics Data System (ADS)

    Chase, Hilary M.; Chen, Shunli; Fu, Li; Upshur, Mary Alice; Rudshteyn, Benjamin; Thomson, Regan J.; Wang, Hong-Fei; Batista, Victor S.; Geiger, Franz M.

    2017-09-01

    Inferring molecular orientations from vibrational sum frequency generation (SFG) spectra is challenging in polarization combinations that result in low signal intensities, or when the local point group symmetry approximation fails. While combining experiments with density functional theory (DFT) could overcome this problem, the scope of the combined method has yet to be established. Here, we assess its feasibility of determining the distributions of molecular orientations for one monobasic ester, two epoxides and three alcohols at the vapor/fused silica interface. We find that molecular orientations of nonlocal vibrational modes cannot be determined using polarization-resolved SFG measurements alone.

  8. High resolution main-ion charge exchange spectroscopy in the DIII-D H-mode pedestal

    SciTech Connect

    Grierson, B. A.; Burrell, K. H.; Chrystal, C.; Groebner, R. J.; Haskey, S. R.; Kaplan, D. H.

    2016-09-12

    A new high spatial resolution main-ion (deuterium) charge-exchange spectroscopy system covering the tokamak boundary region has been installed on the DIII-D tokamak. Sixteen new edge main-ion charge-exchange recombination sightlines have been combined with nineteen impurity sightlines in a tangentially viewing geometry on the DIII-D midplane with an interleaving design that achieves 8 mm inter-channel radial resolution for detailed profiles of main-ion temperature, velocity, charge-exchange emission, and neutral beam emission. At the plasma boundary, we find a strong enhancement of the main-ion toroidal velocity that exceeds the impurity velocity by a factor of two. Furthermore, the unique combination of experimentally measured main-ion and impurity profiles provides a powerful quasi-neutrality constraint for reconstruction of tokamak H-mode pedestals.

  9. Reflectance-mode interferometric near-infrared spectroscopy quantifies brain absorption, scattering, and blood flow index in vivo.

    PubMed

    Borycki, Dawid; Kholiqov, Oybek; Srinivasan, Vivek J

    2017-02-01

    Interferometric near-infrared spectroscopy (iNIRS) is a new technique that measures time-of-flight- (TOF-) resolved autocorrelations in turbid media, enabling simultaneous estimation of optical and dynamical properties. Here, we demonstrate reflectance-mode iNIRS for noninvasive monitoring of a mouse brain in vivo. A method for more precise quantification with less static interference from superficial layers, based on separating static and dynamic components of the optical field autocorrelation, is presented. Absolute values of absorption, reduced scattering, and blood flow index (BFI) are measured, and changes in BFI and absorption are monitored during a hypercapnic challenge. Absorption changes from TOF-resolved iNIRS agree with absorption changes from continuous wave NIRS analysis, based on TOF-integrated light intensity changes, an effective path length, and the modified Beer-Lambert Law. Thus, iNIRS is a promising approach for quantitative and noninvasive monitoring of perfusion and optical properties in vivo.

  10. Complete assignment of the vibrational modes of C60 by inelastic neutron scattering spectroscopy and periodic-DFT.

    PubMed

    Parker, Stewart F; Bennington, Stephen M; Taylor, Jon W; Herman, Henryk; Silverwood, Ian; Albers, Peter; Refson, Keith

    2011-05-07

    In this paper we exploit the complementarity of inelastic neutron scattering (INS), infrared and Raman spectroscopies with ab initio calculations to generate an updated assignment of the vibrational modes of C(60). We have carried out periodic-DFT calculations of the high temperature face centred cubic phase modelled as the standard structure and also of the low temperature simple cubic phase, the latter for the first time. Our assignment differs from all previous work, however, it is the only one that is able to successfully reproduce the INS spectrum in terms of both transition energies and intensities. In addition to the INS spectrum we are also able to quantitatively simulate the major features of the infrared and Raman spectra in the high temperature phase and the infrared spectrum in the low temperature phase.

  11. Terahertz imaging of composite materials in reflection and transmission mode with a time-domain spectroscopy system

    NASA Astrophysics Data System (ADS)

    Sørgârd, Trygve R.; van Rheenen, Arthur D.; Haakestad, Magnus W.

    2016-02-01

    A fiber-coupled Terahertz time domain spectroscopy (THz-TDS) system based on photoconductive antennas, pumped by a 100-fs fiber laser, has been used to characterize materials in transmission and reflection mode. THz images are acquired by mounting the samples under investigation on an x-y stage, which is stepped through the beam while the transmitted or reflected THz waveform is captured. The samples include a carbon fiber epoxy composite and a sandwich-structured composite panel with an aramid fiber honeycomb core in between two skin layers of fiberglass reinforced plastic. The former has an artificially induced void, and from a comparison of recorded reflected time-domain signals, with and without the void, a simple model for the structure of the composite is proposed that describes the time-domain signals reasonably well.

  12. High resolution main-ion charge exchange spectroscopy in the DIII-D H-mode pedestal

    DOE PAGES

    Grierson, B. A.; Burrell, K. H.; Chrystal, C.; ...

    2016-09-12

    A new high spatial resolution main-ion (deuterium) charge-exchange spectroscopy system covering the tokamak boundary region has been installed on the DIII-D tokamak. Sixteen new edge main-ion charge-exchange recombination sightlines have been combined with nineteen impurity sightlines in a tangentially viewing geometry on the DIII-D midplane with an interleaving design that achieves 8 mm inter-channel radial resolution for detailed profiles of main-ion temperature, velocity, charge-exchange emission, and neutral beam emission. At the plasma boundary, we find a strong enhancement of the main-ion toroidal velocity that exceeds the impurity velocity by a factor of two. Furthermore, the unique combination of experimentally measuredmore » main-ion and impurity profiles provides a powerful quasi-neutrality constraint for reconstruction of tokamak H-mode pedestals.« less

  13. High resolution main-ion charge exchange spectroscopy in the DIII-D H-mode pedestal

    SciTech Connect

    Grierson, B. A.; Burrell, K. H.; Chrystal, C.; Groebner, R. J.; Haskey, S. R.; Kaplan, D. H.

    2016-09-12

    A new high spatial resolution main-ion (deuterium) charge-exchange spectroscopy system covering the tokamak boundary region has been installed on the DIII-D tokamak. Sixteen new edge main-ion charge-exchange recombination sightlines have been combined with nineteen impurity sightlines in a tangentially viewing geometry on the DIII-D midplane with an interleaving design that achieves 8 mm inter-channel radial resolution for detailed profiles of main-ion temperature, velocity, charge-exchange emission, and neutral beam emission. At the plasma boundary, we find a strong enhancement of the main-ion toroidal velocity that exceeds the impurity velocity by a factor of two. Furthermore, the unique combination of experimentally measured main-ion and impurity profiles provides a powerful quasi-neutrality constraint for reconstruction of tokamak H-mode pedestals.

  14. High resolution main-ion charge exchange spectroscopy in the DIII-D H-mode pedestal

    NASA Astrophysics Data System (ADS)

    Grierson, B. A.; Burrell, K. H.; Chrystal, C.; Groebner, R. J.; Haskey, S. R.; Kaplan, D. H.

    2016-11-01

    A new high spatial resolution main-ion (deuterium) charge-exchange spectroscopy system covering the tokamak boundary region has been installed on the DIII-D tokamak. Sixteen new edge main-ion charge-exchange recombination sightlines have been combined with nineteen impurity sightlines in a tangentially viewing geometry on the DIII-D midplane with an interleaving design that achieves 8 mm inter-channel radial resolution for detailed profiles of main-ion temperature, velocity, charge-exchange emission, and neutral beam emission. At the plasma boundary, we find a strong enhancement of the main-ion toroidal velocity that exceeds the impurity velocity by a factor of two. The unique combination of experimentally measured main-ion and impurity profiles provides a powerful quasi-neutrality constraint for reconstruction of tokamak H-mode pedestals.

  15. An Analytical Model for Top-Hat Long Transient Mode-Mismatched Thermal Lens Spectroscopy

    NASA Astrophysics Data System (ADS)

    Sabaeian, M.; Rezaei, H.

    2016-02-01

    It has been shown that a top-hat excitation beam gives rise to a more sensitive signal for the thermal lens spectroscopy (TLS). Recently, a numerical model has been presented for a top- hat excitation beam in a dual-beam mod-mismatched TLS [Opt. Lett. 33(13), 1464-1466 (2008)]. In this work, we present a full analytical version of this model. Our model was based on a new solution of time-dependent heat equation for a finite radius cylindrical sample exposed to a top-hat excitation laser beam. The Fresnel diffraction integration method was then used to calculate on-axis probe-beam intensity variations due to thermal lensing by taking the aberrant nature of the thermal lens into account. The model was confirmed with experimental data of LSCAS-2 with an excellent agreement.

  16. Rapid quantification of phenolic acids in radix Salvia miltiorrhiza extract solutions by FT-NIR spectroscopy in transflective mode.

    PubMed

    Li, Wenlong; Qu, Haibin

    2010-08-01

    A rapid method for simultaneous determination of main phenolic acids in Radix Salvia Miltrorrhiza extract solutions was developed using Fourier transform near infrared spectroscopy in transflective mode and multivariate calibration and HPLC-UV as the reference method. Partial least squares (PLS) algorithm was conducted on the calibration of regression models. The multiplicative scatter correction, Norris derivative and second derivative were adopted for the spectral pre-processing, and the number of PLS factors were optimized by leave-one-out cross-validation. The performance of the final model was evaluated according to root mean square error of prediction (RMSEP) and correlation coefficient (R). The R values achieved in the prediction set were above 0.93. The developed models were used for analysis of unknown samples and routine monitoring with satisfactory results. This work demonstrated that NIR spectroscopy combined with PLS algorithm could be used for the rapid determination of the main phenolic acids of Salvia Miltrorrhiza extract solutions. Copyright (c) 2010 Elsevier B.V. All rights reserved.

  17. Automation and heat transfer characterization of immersion mode spectroscopy for analysis of ice nucleating particles

    NASA Astrophysics Data System (ADS)

    Beall, Charlotte M.; Stokes, M. Dale; Hill, Thomas C.; DeMott, Paul J.; DeWald, Jesse T.; Prather, Kimberly A.

    2017-07-01

    Ice nucleating particles (INPs) influence cloud properties and can affect the overall precipitation efficiency. Developing a parameterization of INPs in global climate models has proven challenging. More INP measurements - including studies of their spatial distribution, sources and sinks, and fundamental freezing mechanisms - must be conducted in order to further improve INP parameterizations. In this paper, an immersion mode INP measurement technique is modified and automated using a software-controlled, real-time image stream designed to leverage optical changes of water droplets to detect freezing events. For the first time, heat transfer properties of the INP measurement technique are characterized using a finite-element-analysis-based heat transfer simulation to improve accuracy of INP freezing temperature measurement. The heat transfer simulation is proposed as a tool that could be used to explain the sources of bias in temperature measurements in INP measurement techniques and ultimately explain the observed discrepancies in measured INP freezing temperatures between different instruments. The simulation results show that a difference of +8.4 °C between the well base temperature and the headspace gas results in an up to 0.6 °C stratification of the aliquot, whereas a difference of +4.2 °C or less results in a thermally homogenous water volume within the error of the thermal probe, ±0.2 °C. The results also show that there is a strong temperature gradient in the immediate vicinity of the aliquot, such that without careful placement of temperature probes, or characterization of heat transfer properties of the water and cooling environment, INP measurements can be biased toward colder temperatures. Based on a modified immersion mode technique, the Automated Ice Spectrometer (AIS), measurements of the standard test dust illite NX are reported and compared against six other immersion mode droplet assay techniques featured in Hiranuma et al. (2015) that used

  18. High-resolution spectroscopy and mode identification in non-radially pulsating stars

    NASA Astrophysics Data System (ADS)

    Pollard, K. R.; Wright, D. J.; Zima, W.; Cottrell, P. L.; De Cat, P.

    2008-12-01

    We have obtained high-resolution spectroscopic data of a sample of non-radially pulsating stars with the HERCULES spectrograph on the 1.0-m telescope at the Mt John University Observatory in New Zealand. We have developed and used a new technique which cross- correlates stellar spectra with scaled delta function templates to obtain high signal-to-noise representative spectral line profiles for further analysis. Using these profiles, and employing the Fourier Parameter Fit method, we have been able to place constraints on the degree, ℓ, and azimuthal order, m, of the non-radial pulsation modes in one β Cephei star, V2052 Oph and two γ Doradus stars, QW Pup and HD 139095.

  19. a Study of Vibrational Mode Coupling in 2-FLUOROETHANOL and 1,2-DIFLUOROETHANE Using High-Resolution Infrared Spectroscopy.

    NASA Astrophysics Data System (ADS)

    Mork, Steven Wayne

    High resolution infrared spectroscopy was used to examine intramolecular vibrational interactions in 2 -fluoroethanol (2FE) and 1,2-difluoroethane (DFE). A high resolution infrared spectrophotometer capable of better than 10 MHz spectral resolution was designed and constructed. The excitation source consists of three lasers: an argon-ion pumped dye laser which pumps a color -center laser. The infrared beam from the color-center laser is used to excite sample molecules which are rotationally and vibrationally cooled in a supersonic molecular beam. Rovibrational excitation of the sample molecules is detected by monitoring the kinetic energy of the molecular beam with a bolometer. The high resolution infrared spectrum of 2FE was collected and analyzed over the 2977-2990 cm^ {-1}^ectral region. This region contains the asymmetric CH stretch on the fluorinated carbon. The spectrum revealed extensive perturbations in the rotational fine structure. Analysis of these perturbations has provided a quantitative measure of selective vibrational mode coupling between the C-H stretch and its many neighboring dark vibrational modes. Interestingly, excitation of the C-H stretch is known to induce a photoisomerization reaction between 2FE's Gg^' and Tt conformers. Implications of the role of mode coupling in the reaction mechanism are also addressed. Similarly, the high resolution infrared spectrum of DFE was collected and analyzed over the 2978-2996 cm ^{-1}^ectral region. This region contains the symmetric combination of asymmetric C-H stretches in DFE. Perturbations in the rotational fine structure indicate vibrational mode coupling to a single dark vibrational state. The dark state is split by approximately 19 cm^{-1} due to tunneling between two identical gauche conformers. The coupling mechanism is largely anharmonic with a minor component of B/C-plane Coriolis coupling. Effects of centrifugal distortion along the molecular A-axis are also observed. The coupled vibrational

  20. Whispering Gallery mode ESR spectroscopy and parameters measurement in single crystal SrLaAlO4 at millikelvin temperature

    NASA Astrophysics Data System (ADS)

    Hosain, M. A.; Le Floch, J.-M.; Krupka, J.; Tobar, M. E.

    2017-08-01

    A cylindrical single crystal SrLaAlO4 Whispering Gallery mode dielectric resonator was cooled to millikelvin temperature using a dilution refrigerator. By controlling a DC-magnetic field, impurity ions' spins were coupled to a variety of modes allowing the measurement of hybrid spin-photon systems. This Electron Spin Resonance mapping technique allowed us to detect Cu2+,Fe3+ and Mn4+ impurity ions (at the level of parts per million (ppm) to parts per billion (ppb)), verified by the measurement of the spin parameters along with their site symmetry. Whispering Gallery modes exhibited Q-factors ⩾105 at a temperature less than 20mK , allowing sensitive spectroscopy with high precision. Measured hyperfine line constants of the Cu2+ ion shows different parallel g-factors, g‖Cu , of 2.526, 2.375, 2.246 and 2.142 . The spin-orbit coupling constant of the Cu2+ ion was determined to be λ ≃ - 635cm-1 . The low-spin state Fe3+ ion's measured parallel g-factor, g‖Fe , of 2.028 reveals tetragonal anisotropy. The Mn4+ ion is identified in the lattice, producing hyperfine structure with high-valued g-factors,g‖Mn , of 7.789, 7.745, 7.688, 7.613, 7.5304 and 7.446 . The hyperfine structures of the Cu2+ and Mn4+ ions show broadening of about 79G between 9.072GHz and 10.631GHz , and 24.5G broadening between 9.072GHz and 14.871GHz , respectively.

  1. CVD Diamond Detectors for Current Mode Neutron Time-of-Flight Spectroscopy at OMEGA/NIF

    SciTech Connect

    G. J. Schmid; V. Yu. Glebov; A. V. Friensehner; D. R. Hargrove; S. P. Hatchett; N. Izumi; R. A. Lerche; T. W. Phillips; T. C. Sangster; C. Silbernagel; C. Stoecki

    2001-07-01

    We have performed pulsed neutron and pulsed laser tests of a CVD diamond detector manufactured from DIAFILM, a commercial grade of CVD diamond. The laser tests were performed at the short pulse UV laser at Bechtel Nevada in Livermore, CA. The pulsed neutrons were provided by DT capsule implosions at the OMEGA laser fusion facility in Rochester, NY. From these tests, we have determined the impulse response to be 250 ps fwhm for an applied E-field of 500 V/mm. Additionally, we have determined the sensitivity to be 2.4 mA/W at 500 V/mm and 4.0 mA/W at 1000 V/mm. These values are approximately 2 to 5x times higher than those reported for natural Type IIa diamond at similar E-field and thickness (1mm). These characteristics allow us to conceive of a neutron time-of-flight current mode spectrometer based on CVD diamond. Such an instrument would sit inside the laser fusion target chamber close to target chamber center (TCC), and would record neutron spectra fast enough such that backscattered neutrons and x-rays from the target chamber wall would not be a concern. The acquired neutron spectra could then be used to extract DD fuel areal density from the downscattered secondary to secondary ratio.

  2. Synchrotron far-infrared spectroscopy of the two lowest fundamental modes of 1,1-difluoroethane

    NASA Astrophysics Data System (ADS)

    Wong, Andy; Thompson, Christopher D.; Appadoo, Dominique R. T.; Plathe, Ruth; Roy, Pascale; Manceron, Laurent; Barros, Joanna; McNaughton, Don

    2013-08-01

    The far-infrared (FIR) spectrum (50-600 cm-1) of 1,1-difluoroethane was recorded using the high-resolution infrared AILES beamline at the Soleil synchrotron. A ro-vibrational assignment was performed on the lowest wavenumber, low intensity 181 0 and 171 0 modes, yielding band centres of 224.241903 (10) cm-1 and 384.252538 (13) cm-1, respectively. A total of 965 and 2031 FIR transitions were assigned to the 181 0 and 171 0 fundamentals, respectively. Previously measured pure rotational transitions from the upper states were included into the respective fits to yield improved rotational and centrifugal distortion constants. The 182 1 hot band was observed within the fundamental band, with 369 FIR transitions assigned and co-fitted with the fundamental to give a band centre of 431.956502 (39) cm-1 for ν 18 = 2. The 182 0 overtone was observed with 586 transitions assigned and fitted to give a band centre of 431.952763 (23) cm-1 for ν 18 = 2. The difference in energy is attributed to a torsional splitting of 0.003740 (45) cm-1 in the ν 18 = 2 state. Two hot bands originating from the ν 18 = 1 and ν 17 = 1 states were observed within the 171 0 fundamental.

  3. CVD Diamond Detectors for Current Mode Neutron Time-of-Flight Spectroscopy at OMEGA/NIF

    SciTech Connect

    Schmid, G J; Friensehner, A F; Glebov, V Y; Hargrove, D R; Hatchett, S P; Izumi, N; Lerche, R A; Phillips, T W; Sangster, T C; Sibernagel, C; Stoeckl, C

    2001-06-19

    As part of a laser fusion diagnostic development program, we have performed pulsed neutron and pulsed laser tests of a CVD diamond detector manufactured from DIAFILM, a commercial grade of CVD diamond. The laser tests were performed at the short pulse UV laser at Bechtel Nevada in Livermore, CA. The pulsed neutrons were provided by DT capsule implosions at the OMEGA laser fusion facility in Rochester, NY. From these tests, we have determined the impulse response to be 250 ps fwhm for an applied E-field of 500 V/mm. Additionally, we have determined the sensitivity to be 2.8 mA/W at 500 V/mm and 4.5 mA/W at 1000 V/mm (2 to 6x times higher than reported values for natural Type IIa diamond). These detector characteristics allow us to conceive of a neutron time-of-flight current mode spectrometer based on CVD diamond. Such an instrument would sit inside the laser fusion target chamber close to TCC, and would record neutron spectra fast enough such that backscattered neutrons and y rays from the target chamber wall would not be a concern. However, the data we have taken show that the Electromagnetic Pulse (EMP) noise could be a limiting factor in performance. Determining the degree to which this noise can be shielded will be an important subject of future tests.

  4. Far Infrared High Resolution Synchrotron FTIR Spectroscopy of the Low Frequency Bending Modes of Dmso

    NASA Astrophysics Data System (ADS)

    Cuisset, Arnaud; Smirnova, Irina; Bocquet, Robin; Hindle, Francis; Mouret, Gael; Sadovskii, Dmitrii A.; Pirali, Olivier; Roy, Pascale

    2010-06-01

    In addition to its importance for industrial and environmental studies, the monitoring of DiMethylSulfOxyde (DMSO, (CH_3)_2SO) concentrations is of considerable interest for civil protection. The existing high resolution gas phase spectroscopic data of DMSO only concerned the pure rotational transitions in the ground state. In the Far-IR domain, the low-frequency rovibrational transitions have never previously resolved. The high brightness of the AILES beamline of the synchrotron SOLEIL and the instrumental sensitivity provided by the multipass cell allowed to measure for the first time these transitions. 1581 A-type and C-type transitions in the ν11 band have been assigned and 25 molecular constants of Watson's s-form hamiltonian developed to degree 8 have been fitted within the experimental accuracy. The use of then synchrotron radiation has opened many possibilities for new spectroscopic studies. Together with several other recent studies, our successful measurement and analysis of DMSO convincingly demonstrates the potential of the AILES beamline for high resolution FIR spectroscopy. Thus our present work is just at the beginning of unraveling the rovibrational structure of low frequency bending and torsional vibrational states of DMSO and yielding important comprehensive structural and spectroscopic information on this molecule. L. Margules, R. A. Motienko, E. A. Alekseev, J. Demaison, J. Molec. Spectrosc., 260(23),2009 V. Typke, M. Dakkouri, J. Molec. Struct., 599(177),2001 A. Cuisset, L. Nanobashvili, I. Smirnova, R. Bocquet, F. Hindle, G. Mouret, O. Pirali, P. Roy, D. Sadovskii, Chem. Phys. Lett., accepted for publication

  5. Inspiral-merger-ringdown (2, 0) mode waveforms for aligned-spin black-hole binaries

    NASA Astrophysics Data System (ADS)

    Cao, Zhoujian; Han, Wen-Biao

    2016-08-01

    Based on spin weighted spherical harmonic decomposition, the (2,+/- 2) modes dominate the gravitational waveforms generated by binary black holes. Several recent works found that other modes including (l,0) ones are also important to gravitational wave data analysis. For aligned-spin binaries, these (l,0) modes are related to the memory effect of gravitational wave. Based on the post-Newtonian analysis, quasi-normal modes analysis and the results of numerical relativity simulations, we present a full inspiral-merger-ringdown gravitational waveform model for the (2,0) mode generated by binary black holes. Our model includes the quasinormal ringing part and includes the effect of a black hole’s spin. It is complementary to the previous results.

  6. Optical spectroscopy with a near-single-mode fiber-feed and adaptive optics

    NASA Astrophysics Data System (ADS)

    Ge, Jian; Angel, J. Roger P.; Shelton, J. Christopher

    1998-07-01

    We report on first astronomical results with a cross-dispersed optical echelle spectrograph fed by a near single-mode fiber. We also present on a novel design of a new adaptive optics (AO) optimized fiber-fed cross-dispersed echelle spectrograph. The spectrograph is designed to match with AO corrected images in the optical bands provided by such as the Mt. Wilson 100 inch, Starfire Optical Range 3.5 m AO telescopes. Ultimately, it will be installed at the 6.5 m MMT, when this has high resolution AO correcting the optical spectrum. The spectrograph, fed by a 10 micron fused silica fiber, is unique in that the entire spectrum from 0.4 micron to 1.0 micron will be almost completely covered at resolution 200,000 in one exposure. The detector is a 2k X 4k AR coated back illuminated CCD with 15 micron pixel size. The close order spacing allowed by the sharp AO image makes the full cover possible. A 250 X 125 mm(superscript 2) Milton Roy R2 echelle grating with 23.2 grooves mm(superscript -1) and a blaze angle of 63.5 deg provides main dispersion. A double pass BK7 prism with 21 deg wedge angle provides cross dispersion, covering the spectrum from order 193 to 77. The spectrograph is used in the quasi- Littrow configuration with an off-axis Maksutov collimator/camera. The fiber feeds the AO corrected beams from the telescope Cassegrain focus to the spectrograph, which is set up on an optical bench. The spectrograph will be used mainly to study line profiles of solar type stars, to explore problems of indirect detection of planets and also study interstellar medium, circumstellar medium and metal abundance and isotopic ratios of extremely metal-poor stars.

  7. Magnetic-dipolar-mode Fano resonances for microwave spectroscopy of high absorption matter

    NASA Astrophysics Data System (ADS)

    Vaisman, G.; Kamenetskii, E. O.; Shavit, R.

    2015-03-01

    The interaction between high absorption matter and microwave radiated energy is a subject of great importance. In particular, this concerns the microwave spectroscopic characterization of biological liquids. The use of effective testing methods to obtain information about physical properties of different liquids on the molecular level is one of the most important problems in biophysics. However, the standard methods based on microwave resonant techniques are not sufficiently suitable for biological liquids because the resonance peak in a resonator with high-loss liquids is so broad that the material parameters cannot be measured correctly. Although molecular vibrations of biomolecules may have microwave frequencies, it is not thought that such resonant coupling is significant due to their low energy compared with thermal energy and the strongly dampening aqueous environment. This paper presents an innovative microwave sensing technique for different types of lossy materials, including biological liquids. The technique is based on the combination of the microwave perturbation method and the Fano resonance effects observed recently in microwave structures with embedded magnetic-dipolar quantum dots. When the frequency of the magnetic dipolar mode (MDM) resonance is not equal to the cavity resonance frequency, one gets Fano transmission intensity. When the MDM resonance frequency is tuned to the cavity resonance frequency, by a bias magnetic field, one observes a Lorentzian line shape. Use of an extremely narrow Lorentzian peak allows exact probing of the resonant frequency of a cavity loaded by a highly lossy material sample. For different kinds of samples, one has different frequencies of Lorentzian peaks. This presents a picture of precise spectroscopic characterization of high absorption matter in microwaves.

  8. High-Resolution Infrared Spectroscopy Slit-Jet Cooled Hydroxymethyl Radical (CH_2OH): CH Symmetric Stretching Mode

    NASA Astrophysics Data System (ADS)

    Wang, Fang; Chang, Chih-Hsuan; Nesbitt, David

    2014-06-01

    Hydroxymethyl radical (CH_2OH) plays an important role in combustion and environmental chemistry as a reactive intermediate. Reisler's group published the first rotationally resolved spectroscopy of CH_2OH with determined band origins for fundamental CH symmetric stretch state, CH asymmetric stretch state and OH stretch state, respectively. Here CH_2OH was first studied via sub-Doppler infrared spectroscopy in a slit-jet supersonic discharge expansion source. Rotationally resolved direct absorption spectra in the CH symmetric stretching mode were recorded. As a result of the low rotational temperature and sub-Doppler linewidths, the tunneling splittings due to the large amplitude of COH torsion slightly complicate the spectra. Each of the ground vibration state and the CH symmetric stretch state includes two levels. One level, with a 3:1 nuclear spin statistic ratio for Ka=0+/Ka=1+, is labeled as ``+". The other tunneling level, labeled as ``-", has Ka=0-/Ka=1- states with 1:3 nuclear spin statistics. Except for the Ka=0+ ← 0+ band published before, more bands (Ka=1+ ← 1+, Ka=0- ← 0- and Ka=1- ← 1-) were identified. The assigned transitions were fit to a Watson A-reduced symmetric top Hamiltonian to improve the accuracy of the band origin of CH symmetric state. The rotational parameters for both ground and CH symmetric stretch state were well determined. L. Feng, J. Wei and H. Reisler, J. Phys. Chem. A, Vol. 108. M. A. Roberts, E. N. Sharp-Williams and D. J. Nesbitt, J. Phys. Chem. A 2013, 117, 7042-7049

  9. Nonequilibrium molecular dynamics simulations with a backward-forward trajectories sampling for multidimensional infrared spectroscopy of molecular vibrational modes

    NASA Astrophysics Data System (ADS)

    Hasegawa, Taisuke; Tanimura, Yoshitaka

    2008-02-01

    A full molecular dynamics (MD) simulation approach to calculate multidimensional third-order infrared (IR) signals of molecular vibrational modes is proposed. Third-order IR spectroscopy involves three-time intervals between three excitation and one probe pulses. The nonequilibrium MD (NEMD) simulation allows us to calculate molecular dipoles from nonequilibrium MD trajectories for different pulse configurations and sequences. While the conventional NEMD approach utilizes MD trajectories started from the initial equilibrium state, our approach does from the intermediate state of the third-order optical process, which leads to the doorway-window decomposition of nonlinear response functions. The decomposition is made before the second pump excitation for a two-dimensional case of IR photon echo measurement, while it is made after the second pump excitation for a three-dimensional case of three-pulse IR photon echo measurement. We show that the three-dimensional IR signals are efficiently calculated by using the MD trajectories backward and forward in time for the doorway and window functions, respectively. We examined the capability of the present approach by evaluating the signals of two- and three-dimensional IR vibrational spectroscopies for liquid hydrogen fluoride. The calculated signals might be explained by anharmonic Brownian model with the linear-linear and square-linear system-bath couplings which was used to discuss the inhomogeneous broadening and dephasing mechanism of vibrational motions. The predicted intermolecular librational spectra clearly reveal the unusually narrow inhomogeneous linewidth due to the one-dimensional character of HF molecule and the strong hydrogen bond network.

  10. Hydrodynamic modes of a holographic p-wave superfluid

    NASA Astrophysics Data System (ADS)

    Arias, Raúl E.; Landea, Ignacio Salazar

    2014-11-01

    In this work we analyze the hydrodynamics of a p- wave superfluid on its strongly coupled regime by considering its holographic description. We obtain the poles of the retarded Green function through the computation of the quasi-normal modes of the dual AdS black hole background finding diffusive, pseudo-diffusive and sound modes. For the sound modes we compute the speed of sound and its attenuation as function of the temperature. For the diffusive and pseudo-diffusive modes we find that they acquire a non-zero real part at certain finite momentum.

  11. Isotope effects in liquid water probed by transmission mode x-ray absorption spectroscopy at the oxygen K-edge

    NASA Astrophysics Data System (ADS)

    Schreck, Simon; Wernet, Philippe

    2016-09-01

    The effects of isotope substitution in liquid water are probed by x-ray absorption spectroscopy at the O K-edge as measured in transmission mode. Confirming earlier x-ray Raman scattering experiments, the D2O spectrum is found to be blue shifted with respect to H2O, and the D2O spectrum to be less broadened. Following the earlier interpretations of UV and x-ray Raman spectra, the shift is related to the difference in ground-state zero-point energies between D2O and H2O, while the difference in broadening is related to the difference in ground-state vibrational zero-point distributions. We demonstrate that the transmission-mode measurements allow for determining the spectral shapes with unprecedented accuracy. Owing in addition to the increased spectral resolution and signal to noise ratio compared to the earlier measurements, the new data enable the stringent determination of blue shift and broadening in the O K-edge x-ray absorption spectrum of liquid water upon isotope substitution. The results are compared to UV absorption data, and it is discussed to which extent they reflect the differences in zero-point energies and vibrational zero-point distributions in the ground-states of the liquids. The influence of the shape of the final-state potential, inclusion of the Franck-Condon structure, and differences between liquid H2O and D2O resulting from different hydrogen-bond environments in the liquids are addressed. The differences between the O K-edge absorption spectra of water from our transmission-mode measurements and from the state-of-the-art x-ray Raman scattering experiments are discussed in addition. The experimentally extracted values of blue shift and broadening are proposed to serve as a test for calculations of ground-state zero-point energies and vibrational zero-point distributions in liquid H2O and D2O. This clearly motivates the need for new calculations of the O K-edge x-ray absorption spectrum of liquid water.

  12. Isotope effects in liquid water probed by transmission mode x-ray absorption spectroscopy at the oxygen K-edge.

    PubMed

    Schreck, Simon; Wernet, Philippe

    2016-09-14

    The effects of isotope substitution in liquid water are probed by x-ray absorption spectroscopy at the O K-edge as measured in transmission mode. Confirming earlier x-ray Raman scattering experiments, the D2O spectrum is found to be blue shifted with respect to H2O, and the D2O spectrum to be less broadened. Following the earlier interpretations of UV and x-ray Raman spectra, the shift is related to the difference in ground-state zero-point energies between D2O and H2O, while the difference in broadening is related to the difference in ground-state vibrational zero-point distributions. We demonstrate that the transmission-mode measurements allow for determining the spectral shapes with unprecedented accuracy. Owing in addition to the increased spectral resolution and signal to noise ratio compared to the earlier measurements, the new data enable the stringent determination of blue shift and broadening in the O K-edge x-ray absorption spectrum of liquid water upon isotope substitution. The results are compared to UV absorption data, and it is discussed to which extent they reflect the differences in zero-point energies and vibrational zero-point distributions in the ground-states of the liquids. The influence of the shape of the final-state potential, inclusion of the Franck-Condon structure, and differences between liquid H2O and D2O resulting from different hydrogen-bond environments in the liquids are addressed. The differences between the O K-edge absorption spectra of water from our transmission-mode measurements and from the state-of-the-art x-ray Raman scattering experiments are discussed in addition. The experimentally extracted values of blue shift and broadening are proposed to serve as a test for calculations of ground-state zero-point energies and vibrational zero-point distributions in liquid H2O and D2O. This clearly motivates the need for new calculations of the O K-edge x-ray absorption spectrum of liquid water.

  13. Resolving the build-up of femtosecond mode-locking with single-shot spectroscopy at 90 MHz frame rate

    NASA Astrophysics Data System (ADS)

    Herink, G.; Jalali, B.; Ropers, C.; Solli, D. R.

    2016-05-01

    Mode-locked lasers have enabled some of the most precise measurements ever performed, from attosecond time-domain spectroscopy to metrology with frequency combs. However, such extreme precision belies the complexity of the underlying mode-locking dynamics. This complexity is particularly evident in the emergence of the mode-locked state, an intrinsically singular, non-repetitive transition. Many details of mode-locking are well understood, yet conventional spectroscopy cannot resolve the nascent dynamics in passive mode-locking on their natural nanosecond timescale, the single pulse period. Here, we capture the pulse-resolved spectral evolution of a femtosecond pulse train from the initial fluctuations, recording ∼900,000 consecutive periods. We directly observe critical phenomena on timescales from tens to thousands of roundtrips, including the birth of the broadband spectrum, accompanying wavelength shifts and transient interference dynamics described as auxiliary-pulse mode-locking. Enabled by the time-stretch transform, the results may impact laser design, ultrafast diagnostics and nonlinear optics.

  14. Tuning the instability in static mode atomic force spectroscopy as obtained in an AFM by applying an electric field between the tip and the substrate.

    PubMed

    Biswas, Soma; Raychaudhuri, A K; Sreeram, P A; Dietzel, Dirk

    2012-11-01

    We have investigated experimentally the role of cantilever instabilities in determination of the static mode force-distance curves in presence of a dc electric field. The electric field has been applied between the tip and the sample in an atomic force microscope working in ultra-high vacuum. We have shown how an electric field modifies the observed force (or cantilever deflection)-vs-distance curves, commonly referred to as the static mode force spectroscopy curves, taken using an atomic force microscope. The electric field induced instabilities shift the jump-into-contact and jump-off-contact points and also the deflection at these instability points. We explained the experimental results using a model of the tip-sample interaction and quantitatively established a relation between the observed static mode force spectroscopy curves and the applied electric field which modifies the effective tip-sample interaction in a controlled manner. The investigation establishes a way to quantitatively evaluate the electrostatic force in an atomic force microscope using the static mode force spectroscopy curves.

  15. Softening of infrared-active mode of perovskite BaZrO{sub 3} proved by terahertz time-domain spectroscopy

    SciTech Connect

    Helal, M. A.; Mori, T.; Kojima, S.

    2015-05-04

    The low-frequency infrared-active optical modes were studied in a barium zirconate, BaZrO{sub 3}, single crystal with the perovskite structure using terahertz (THz) time-domain spectroscopy (TDS). The real and imaginary parts of the dielectric constants were accurately determined in the frequency range between 0.2 and 2.7 THz. Upon cooling from room temperature to 8 K, the lowest-frequency TO1 mode at 2.32 THz showed a pronounced softening to 1.94 THz. The real part of the dielectric constant at 0.5 THz determined by THz-TDS obeys Barrett's relation, and the existence of a plateau confirms that the quantum effects lead to saturation of the soft mode frequencies of the TO1 and TO2 modes below ≈20 K. This is reminiscent of incipient ferroelectrics with the perovskite structure such as CaTiO{sub 3}.

  16. Broadband Spectroscopy of CO_2 Bands Near 2 μm Using a Femtosecond Mode-Locked Laser

    NASA Astrophysics Data System (ADS)

    Klose, Andrew; Maser, Daniel L.; Ycas, Gabriel; Diddams, Scott; Newbury, Nathan R.; Coddington, Ian

    2014-06-01

    The optical frequency comb provided in the output of a femtosecond, mode-locked laser has been employed for many applications, including broadband spectroscopic measurements of trace gases using a variety of detection techniques. One environmentally significant trace gas is CO_2, which has characteristic absorption bands near 1.6 μm and 2.0 μm. Continuous wave (cw) lasers have typically been used to measure CO_2 at atmospheric-level concentrations. However, a broadband frequency comb source can provide rapid, simultaneous and accurate measurements of multiple transitions without the need for mechanical scanning or frequency tuning. Previously, precision broadband spectroscopy was performed on CO_2 bands near 1.6 μm. However, the CO_2 absorption bands near 2 μm have nearly a ten-fold increase in line strength compared to the bands near 1.6 μm, making the 2 μm bands attractive candidates for precision measurements of CO_2 with improved signal-to-noise and reduced uncertainty. Here, broadband quantitative spectroscopy of CO_2 bands near 2 μm is pursued. The source that was developed consists of an Er:fiber oscillator, Er:doped fiber amplifier, and highly nonlinear optical fiber, which generates a broadband spectrum spanning from 1 to 2.2 μm with an average power of 270 mW. Over 70 mW of the optical power is contained in the 1.8-2.2 μm region relevant to the CO_2 measurement. After generation, the laser light is passed through laboratory gas cells or open air where the absorption features from the sample gas are imprinted onto the laser light. Initial detection efforts involve a virtually imaged phased array- (VIPA-)based spectrometer whose output is subsequently imaged on a InSb array detector. The bandwidth of the measured spectrum is 50 nm, limited by the size of the detector array. The characteristics of the spectrometer, including the detection limits and temporal resolution, will be presented. In addition, the progress towards the use of the present

  17. Mode-Locked Multichromatic X-Rays in a Seeded Free-Electron Laser for Single-Shot X-Ray Spectroscopy

    SciTech Connect

    Xiang, Dao; Ding, Yuantao; Raubenheimer, Tor; Wu, Juhao; /SLAC

    2012-05-10

    We present the promise of generating gigawatt mode-locked multichromatic x rays in a seeded free-electron laser (FEL). We show that, by using a laser to imprint periodic modulation in electron beam phase space, a single-frequency coherent seed can be amplified and further translated to a mode-locked multichromatic output in an FEL. With this configuration the FEL output consists of a train of mode-locked ultrashort pulses which span a wide frequency gap with a series of equally spaced sharp lines. These gigawatt multichromatic x rays may potentially allow one to explore the structure and dynamics of a large number of atomic states simultaneously. The feasibility of generating mode-locked x rays ranging from carbon K edge ({approx}284 eV) to copper L{sub 3} edge ({approx}931 eV) is confirmed with numerical simulation using the realistic parameters of the linac coherent light source (LCLS) and LCLS-II. We anticipate that the mode-locked multichromatic x rays in FELs may open up new opportunities in x-ray spectroscopy (i.e. resonant inelastic x-ray scattering, time-resolved scattering and spectroscopy, etc.).

  18. Spectroscopy of Kerr black holes with Earth- and space-based interferometers

    NASA Astrophysics Data System (ADS)

    Berti, Emanuele; Sesana, Alberto; Barausse, Enrico; Cardoso, Vitor; Belczynski, Krzysztof

    2017-01-01

    We estimate the potential of present and future interferometric gravitational-wave detectors to test the Kerr nature of black holes through ``gravitational spectroscopy,'' i.e. the measurement of multiple quasinormal mode frequencies from the remnant of a black hole merger. Using population synthesis models of the formation and evolution of stellar-mass black hole binaries, we find that Voyager-class interferometers will be necessary to perform these tests. Gravitational spectroscopy in the local Universe may become routine with the Einstein Telescope, but a 40-km facility like Cosmic Explorer is necessary to go beyond z 3 . In contrast, eLISA-like detectors should carry out a few - or even hundreds - of these tests every year, depending on uncertainties in massive black hole formation models. Many space-based spectroscopical measurements will occur at high redshift, testing the strong gravity dynamics of Kerr black holes in domains where cosmological corrections to general relativity (if they occur in nature) must be significant. NSF CAREER Grant No. PHY-1055103, NSF Grant No. PHY-1607130, FCT contract IF/00797/2014/CP1214/CT0012.

  19. Spectroscopy of Kerr Black Holes with Earth- and Space-Based Interferometers

    NASA Astrophysics Data System (ADS)

    Berti, Emanuele; Sesana, Alberto; Barausse, Enrico; Cardoso, Vitor; Belczynski, Krzysztof

    2016-09-01

    We estimate the potential of present and future interferometric gravitational-wave detectors to test the Kerr nature of black holes through "gravitational spectroscopy," i.e., the measurement of multiple quasinormal mode frequencies from the remnant of a black hole merger. Using population synthesis models of the formation and evolution of stellar-mass black hole binaries, we find that Voyager-class interferometers will be necessary to perform these tests. Gravitational spectroscopy in the local Universe may become routine with the Einstein Telescope, but a 40-km facility like Cosmic Explorer is necessary to go beyond z ˜3 . In contrast, detectors like eLISA (evolved Laser Interferometer Space Antenna) should carry out a few—or even hundreds—of these tests every year, depending on uncertainties in massive black hole formation models. Many space-based spectroscopical measurements will occur at high redshift, testing the strong gravity dynamics of Kerr black holes in domains where cosmological corrections to general relativity (if they occur in nature) must be significant.

  20. Spectroscopy of Kerr Black Holes with Earth- and Space-Based Interferometers.

    PubMed

    Berti, Emanuele; Sesana, Alberto; Barausse, Enrico; Cardoso, Vitor; Belczynski, Krzysztof

    2016-09-02

    We estimate the potential of present and future interferometric gravitational-wave detectors to test the Kerr nature of black holes through "gravitational spectroscopy," i.e., the measurement of multiple quasinormal mode frequencies from the remnant of a black hole merger. Using population synthesis models of the formation and evolution of stellar-mass black hole binaries, we find that Voyager-class interferometers will be necessary to perform these tests. Gravitational spectroscopy in the local Universe may become routine with the Einstein Telescope, but a 40-km facility like Cosmic Explorer is necessary to go beyond z∼3. In contrast, detectors like eLISA (evolved Laser Interferometer Space Antenna) should carry out a few-or even hundreds-of these tests every year, depending on uncertainties in massive black hole formation models. Many space-based spectroscopical measurements will occur at high redshift, testing the strong gravity dynamics of Kerr black holes in domains where cosmological corrections to general relativity (if they occur in nature) must be significant.

  1. Evidence of a spin resonance mode in the iron-based superconductor Ba(0.6)K(0.4)Fe2As2 from scanning tunneling spectroscopy.

    PubMed

    Shan, Lei; Gong, Jing; Wang, Yong-Lei; Shen, Bing; Hou, Xingyuan; Ren, Cong; Li, Chunhong; Yang, Huan; Wen, Hai-Hu; Li, Shiliang; Dai, Pengcheng

    2012-06-01

    We used high-resolution scanning tunneling spectroscopy to study the hole-doped iron pnictide superconductor Ba(0.6)K(0.4)Fe(2)As(2) (T(c)=38 K). Features of a bosonic excitation (mode) are observed in the measured quasiparticle density of states. The bosonic features are intimately associated with the superconducting order parameter and have a mode energy of ~14 meV, similar to the spin resonance measured by inelastic neutron scattering. These results indicate a strong electron-spin excitation coupling in iron pnictide superconductors, similar to that in high-T(c) copper oxide superconductors.

  2. Detection of OH stretching mode of CH3OH chemisorbed on Ni3+ and Ni4+ by infrared photodissociation spectroscopy.

    PubMed

    Hirabayashi, Shinichi; Okawa, Ryuji; Ichihashi, Masahiko; Kondow, Tamotsu; Kawazoe, Yoshiyuki

    2007-08-09

    Structures of nickel cluster ions adsorbed with methanol, Ni3+ (CH3OH)m (m = 1-3) and Ni4+ (CH3OH)m (m = 1-4) were investigated by using infrared photodissociation (IR-PD) spectroscopy based on a tandem-type mass spectrometer, where they were produced by passing Ni3,4+ through methanol vapor under a multiple collision condition. The IR-PD spectra were measured in the wavenumber region between 3100 and 3900 cm-1. In each IR-PD spectrum, a single peak was observed at a wavenumber lower by approximately 40 cm-1 than that of the OH stretching vibration of a free methanol molecule and was assigned to the OH stretching vibrations of the methanol molecules in Ni3,4+ (CH3OH)m. The photodissociation was analyzed by assuming that Ni3,4+ (CH3OH)m dissociate unimolecularly after the photon energy absorbed by them is statistically distributed among the accessible modes of Ni3,4+ (CH3OH)m. In comparison with the calculations performed by the density functional theory, it is concluded that (1) the oxygen atom of each methanol molecule is bound to one of the nickel atoms in Ni3,4+ (defined as molecular chemisorption), (2) the methanol molecules in Ni3,4+ (CH3OH)m do not form any hydrogen bonds, and (3) the cross section for demethanation [CH4 detachment from Nin+ (CH3OH)] is related to the electron density distribution inside the methanol molecule.

  3. Decoding Mode-mixing in Black-hole Merger Ringdown

    NASA Technical Reports Server (NTRS)

    Kelly, Bernard J.; Baker, John G.

    2013-01-01

    Optimal extraction of information from gravitational-wave observations of binary black-hole coalescences requires detailed knowledge of the waveforms. Current approaches for representing waveform information are based on spin-weighted spherical harmonic decomposition. Higher-order harmonic modes carrying a few percent of the total power output near merger can supply information critical to determining intrinsic and extrinsic parameters of the binary. One obstacle to constructing a full multi-mode template of merger waveforms is the apparently complicated behavior of some of these modes; instead of settling down to a simple quasinormal frequency with decaying amplitude, some |m| = modes show periodic bumps characteristic of mode-mixing. We analyze the strongest of these modes the anomalous (3, 2) harmonic mode measured in a set of binary black-hole merger waveform simulations, and show that to leading order, they are due to a mismatch between the spherical harmonic basis used for extraction in 3D numerical relativity simulations, and the spheroidal harmonics adapted to the perturbation theory of Kerr black holes. Other causes of mode-mixing arising from gauge ambiguities and physical properties of the quasinormal ringdown modes are also considered and found to be small for the waveforms studied here.

  4. Real-time bilinear rotation decoupling in absorptive mode J-spectroscopy: Detecting low-intensity metabolite peak close to high-intensity metabolite peak with convenience

    NASA Astrophysics Data System (ADS)

    Verma, Ajay; Baishya, Bikash

    2016-05-01

    "Pure shift" NMR spectra display singlet peak per chemical site. Thus, high resolution is offered at the cost of valuable J-coupling information. In the present work, real-time BIRD (BIlinear Rotation Decoupling) is applied to the absorptive-mode 2D J-spectroscopy to provide pure shift spectrum in the direct dimension and J-coupling information in the indirect dimension. Quite often in metabolomics, proton NMR spectra from complex bio-fluids display tremendous signal overlap. Although conventional J-spectroscopy in principle overcomes this problem by separating the multiplet information from chemical shift information, however, only magnitude mode of the experiment is practical, sacrificing much of the potential high resolution that could be achieved. Few J-spectroscopy methods have been reported so far that produce high-resolution pure shift spectrum along with J-coupling information for crowded spectral regions. In the present work, high-quality J-resolved spectrum from important metabolomic mixture such as tissue extract from rat cortex is demonstrated. Many low-intensity metabolite peaks which are obscured by the broad dispersive tails from high-intensity metabolite peaks in regular magnitude mode J-spectrum can be clearly identified in real-time BIRD J-resolved spectrum. The general practice of removing such spectral overlap is tedious and time-consuming as it involves repeated sample preparation to change the pH of the tissue extract sample and subsequent spectra recording.

  5. Real-time bilinear rotation decoupling in absorptive mode J-spectroscopy: Detecting low-intensity metabolite peak close to high-intensity metabolite peak with convenience.

    PubMed

    Verma, Ajay; Baishya, Bikash

    2016-05-01

    "Pure shift" NMR spectra display singlet peak per chemical site. Thus, high resolution is offered at the cost of valuable J-coupling information. In the present work, real-time BIRD (BIlinear Rotation Decoupling) is applied to the absorptive-mode 2D J-spectroscopy to provide pure shift spectrum in the direct dimension and J-coupling information in the indirect dimension. Quite often in metabolomics, proton NMR spectra from complex bio-fluids display tremendous signal overlap. Although conventional J-spectroscopy in principle overcomes this problem by separating the multiplet information from chemical shift information, however, only magnitude mode of the experiment is practical, sacrificing much of the potential high resolution that could be achieved. Few J-spectroscopy methods have been reported so far that produce high-resolution pure shift spectrum along with J-coupling information for crowded spectral regions. In the present work, high-quality J-resolved spectrum from important metabolomic mixture such as tissue extract from rat cortex is demonstrated. Many low-intensity metabolite peaks which are obscured by the broad dispersive tails from high-intensity metabolite peaks in regular magnitude mode J-spectrum can be clearly identified in real-time BIRD J-resolved spectrum. The general practice of removing such spectral overlap is tedious and time-consuming as it involves repeated sample preparation to change the pH of the tissue extract sample and subsequent spectra recording.

  6. Vibrational Spectroscopy of the CCl[subscript 4] v[subscript 1] Mode: Theoretical Prediction of Isotopic Effects

    ERIC Educational Resources Information Center

    Gaynor, James D.; Wetterer, Anna M.; Cochran, Rea M.; Valente, Edward J.; Mayer, Steven G.

    2015-01-01

    Raman spectroscopy is a powerful experimental technique, yet it is often missing from the undergraduate physical chemistry laboratory curriculum. Tetrachloromethane (CCl[subscript 4]) is the ideal molecule for an introductory vibrational spectroscopy experiment and the symmetric stretch vibration contains fine structure due to isotopic variations…

  7. Vibrational Spectroscopy of the CCl[subscript 4] v[subscript 1] Mode: Theoretical Prediction of Isotopic Effects

    ERIC Educational Resources Information Center

    Gaynor, James D.; Wetterer, Anna M.; Cochran, Rea M.; Valente, Edward J.; Mayer, Steven G.

    2015-01-01

    Raman spectroscopy is a powerful experimental technique, yet it is often missing from the undergraduate physical chemistry laboratory curriculum. Tetrachloromethane (CCl[subscript 4]) is the ideal molecule for an introductory vibrational spectroscopy experiment and the symmetric stretch vibration contains fine structure due to isotopic variations…

  8. Size and environment dependence of surface phonon modes of gallium arsenide nanowires as measured by Raman spectroscopy.

    PubMed

    Spirkoska, D; Abstreiter, G; Fontcuberta I Morral, A

    2008-10-29

    Gallium arsenide nanowires were synthesized by gallium-assisted molecular beam epitaxy. By varying the growth time, nanowires with diameters ranging from 30 to 160 nm were obtained. Raman spectra of the nanowire ensembles were measured. The small linewidth of the optical phonon modes agree with an excellent crystalline quality. A surface phonon mode was also revealed, as a shoulder at lower frequencies of the longitudinal optical mode. In agreement with the theory, the surface mode shifts to lower wavenumbers when the diameter of the nanowires is decreased or the environment dielectric constant increased.

  9. Coupling of multi-vibrational modes in bacteriochlorophyll a in solution observed with 2D electronic spectroscopy

    NASA Astrophysics Data System (ADS)

    Yue, Shuai; Wang, Zhuan; Leng, Xuan; Zhu, Rui-Dan; Chen, Hai-Long; Weng, Yu-Xiang

    2017-09-01

    Low vibrational modes in a range of 80-400 cm-1 for bacteriochlorophyll a are excited and observed as beating dynamics in two-dimensional electronic spectra. A coupled multi-vibrational mode displaced oscillator model is proposed to account for the vibronic coherence. We found that these low frequency vibrational modes are coupled. By comparing the fitted lifetime of the vibrational modes appearing in the beating dynamics for bacteriochlorophyll a and a protein-bound bacteriochlorophyll a dimer B820 probed by transient grating method, it is suggested that the protein scaffold provides a protection effect on the vibronic coherence where no excitonic coherence has be excited.

  10. Study of collective radial breathing-like modes in double-walled carbon nanotubes: combination of continuous two-dimensional membrane theory and Raman spectroscopy

    NASA Astrophysics Data System (ADS)

    Levshov, Dmitry I.; Avramenko, Marina V.; Than, Xuan-Tinh; Michel, Thierry; Arenal, Raul; Paillet, Matthieu; Rybkovskiy, Dmitry V.; Osadchy, Alexander V.; Rochal, Sergei B.; Yuzyuk, Yuri I.; Sauvajol, Jean-Louis

    2016-01-01

    Radial breathing modes (RBMs) are widely used for the atomic structure characterization and index assignment of single-walled carbon nanotubes (SWNTs) from resonant Raman spectroscopy. However, for double-walled carbon nanotubes (DWNTs), the use of conventional ωRBM(d) formulas is complicated due to the van der Waals interaction between the layers, which strongly affects the frequencies of radial modes and leads to new collective vibrations. This paper presents an alternative way to theoretically study the collective radial breathing-like modes (RBLMs) of DWNTs and to account for interlayer interaction, namely the continuous two-dimensional membrane theory. We obtain an analytical ωRBLM(do,di) relation, being the equivalent of the conventional ωRBM(d) expressions, established for SWNTs. We compare our theoretical predictions with Raman data, measured on individual index-identified suspended DWNTs, and find a good agreement between experiment and theory. Moreover, we show that the interlayer coupling in individual DWNTs strongly depends on the interlayer distance, which is manifested in the frequency shifts of the RBLMs with respect to the RBMs of the individual inner and outer tubes. In terms of characterization, this means that the combination of Raman spectroscopy data and predictions of continuous membrane theory may give additional criteria for the index identification of DWNTs, namely the interlayer distance.

  11. Observations of a mode transition in a hydrogen hollow cathode discharge using phase resolved optical emission spectroscopy

    SciTech Connect

    Dixon, Sam Charles, Christine; Dedrick, James; Boswell, Rod; Gans, Timo; O'Connell, Deborah

    2014-07-07

    Two distinct operational modes are observed in a radio frequency (rf) low pressure hydrogen hollow cathode discharge. The mode transition is characterised by a change in total light emission and differing expansion structures. An intensified CCD camera is used to make phase resolved images of Balmer α emission from the discharge. The low emission mode is consistent with a typical γ discharge, and appears to be driven by secondary electrons ejected from the cathode surface. The bright mode displays characteristics common to an inductive discharge, including increased optical emission, power factor, and temperature of the H{sub 2} gas. The bright mode precipitates the formation of a stationary shock in the expansion, observed as a dark region adjacent to the source-chamber interface.

  12. Summary statistics of neonatal intensive care unit network neurobehavioral scale scores from the maternal lifestyle study: a quasinormative sample.

    PubMed

    Lester, Barry M; Tronick, Edward Z; LaGasse, Linda; Seifer, Ronald; Bauer, Charles R; Shankaran, Seetha; Bada, Henrietta S; Wright, Linda L; Smeriglio, Vincent L; Lu, Jing

    2004-03-01

    Descriptive statistics for the Neonatal Intensive Care Unit Network Neurobehavioral Scale summary scores are provided based on data from 1388 1-month-old infants in the Maternal Lifestyle Study (MLS) of prenatal drug exposure and child outcome. The multisite MLS is described, followed by tables with descriptive statistics and percentile for the Neonatal Intensive Care Unit Network Neurobehavioral Scale summary scores. The tables include data for the entire MLS sample as well as tables by drug exposure status, gestational age, poverty status, sex, race and ethnicity, and MLS study site. These tables can be used as quasinorms for comparison with other infants of this age.

  13. Inelastic X-ray scattering of a transition-metal complex (FeCl4(-)): vibrational spectroscopy for all normal modes.

    PubMed

    Dong, Weibing; Wang, Hongxin; Olmstead, Marilyn M; Fettinger, James C; Nix, Jay; Uchiyama, Hiroshi; Tsutsui, Satoshi; Baron, Alfred Q R; Dowty, Eric; Cramer, Stephen P

    2013-06-17

    The tetraethylammonium salt of the transition-metal complex FeCl4(-) has been examined using inelastic X-ray scattering (IXS) with 1.5 meV resolution (12 cm(-1)) at 21.747 keV. This sample serves as a feasibility test for more elaborate transition-metal complexes. The IXS spectra were compared with previously recorded IR, Raman, and nuclear resonant vibrational spectroscopy (NRVS) spectra, revealing the same normal modes but with less strict selection rules. Calculations with a previously derived Urey-Bradley force field were used to simulate the expected Q and orientation dependence of the IXS intensities. The relative merits of IXS, compared to other photon-based vibrational spectroscopies such as NRVS, Raman, and IR, are discussed.

  14. A dual-mode microwave resonator for double electron-electron spin resonance spectroscopy at W-band microwave frequencies

    NASA Astrophysics Data System (ADS)

    Tkach, Igor; Sicoli, Giuseppe; Höbartner, Claudia; Bennati, Marina

    2011-04-01

    We present a dual-mode resonator operating at/near 94 GHz (W-band) microwave frequencies and supporting two microwave modes with the same field polarization at the sample position. Numerical analysis shows that the frequencies of both modes as well as their frequency separation can be tuned in a broad range up to GHz. The resonator was constructed to perform pulsed ELDOR experiments with a variable separation of "pump" and "detection" frequencies up to Δ ν = 350 MHz. To examine its performance, test ESE/PELDOR experiments were performed on a representative biradical system.

  15. Noninvasive Vibrational Mode Spectroscopy of Ion Coulomb Crystals through Resonant Collective Coupling to an Optical Cavity Field

    SciTech Connect

    Dantan, A.; Marler, J. P.; Albert, M.; Guenot, D.; Drewsen, M.

    2010-09-03

    We report on a novel noninvasive method to determine the normal mode frequencies of ion Coulomb crystals in traps based on the resonance enhanced collective coupling between the electronic states of the ions and an optical cavity field at the single photon level. Excitations of the normal modes are observed through a Doppler broadening of the resonance. An excellent agreement with the predictions of a zero-temperature uniformly charged liquid plasma model is found. The technique opens up for investigations of the heating and damping of cold plasma modes, as well as the coupling between them.

  16. Efficiently feeding single-mode fiber photonic spectrographs with an extreme adaptive optics system: on-sky characterization and preliminary spectroscopy

    NASA Astrophysics Data System (ADS)

    Jovanovic, N.; Cvetojevic, N.; Schwab, C.; Norris, B.; Lozi, J.; Gross, S.; Betters, C.; Singh, G.; Guyon, O.; Martinache, F.; Doughty, D.; Tuthill, P.

    2016-08-01

    High-order wavefront correction is not only beneficial for high-contrast imaging, but also spectroscopy. The size of a spectrograph can be decoupled from the size of the telescope aperture by moving to the diffraction limit which has strong implications for ELT based instrument design. Here we present the construction and characterization of an extremely efficient single-mode fiber feed behind an extreme adaptive optics system (SCExAO). We show that this feed can indeed be utilized to great success by photonic-based spectrographs. We present metrics to quantify the system performance and some preliminary spectra delivered by the compact spectrograph.

  17. Off-beam quartz-enhanced photoacoustic spectroscopy-based sensor for hydrogen sulfide trace gas detection using a mode-hop-free external cavity quantum cascade laser

    NASA Astrophysics Data System (ADS)

    Helman, Marek; Moser, Harald; Dudkowiak, Alina; Lendl, Bernhard

    2017-05-01

    Hydrogen sulfide (H2S) trace gas detection based on off-beam quartz-enhanced photoacoustic spectroscopy using a continuous wave (CW), mode-hop-free external cavity (EC) quantum cascade laser tunable from 1310 to 1210 cm-1 was performed. A 1 σ minimum detection limit of 492 parts per billion by volume (ppbv) using a 1 s lock-in time constant was obtained by targeting the line centered at 1234.58 cm-1. This value corresponds to a normalized noise equivalent absorption coefficient for H2S of 3.05 × 10-9 W cm-1 Hz-1/2.

  18. Material/element-dependent fluorescence-yield modes on soft X-ray absorption spectroscopy of cathode materials for Li-ion batteries

    DOE PAGES

    Asakura, Daisuke; Hosono, Eiji; Nanba, Yusuke; ...

    2016-03-07

    Here, we evaluate the utilities of fluorescence-yield (FY) modes in soft X-ray absorption spectroscopy (XAS) of several cathodematerials for Li-ion batteries. In the case of total-FY (TFY) XAS for LiNi0.5Mn1.5O4, the line shape of the Mn L3-edge XAS was largely distorted by the self-absorption and saturation effects, while the distortions were less pronounced at the NiL3 edge. The distortions were suppressed for the inverse-partial-FY (IPFY) spectra. We found that, in the cathodematerials, the IPFY XAS is highly effective for the Cr, Mn, and Fe L edges and the TFY and PFY modes are useful enough for the NiL edge whichmore » is far from the O K edge.« less

  19. Measurement of deuterium density profiles in the H-mode steep gradient region using charge exchange recombination spectroscopy on DIII-D

    NASA Astrophysics Data System (ADS)

    Haskey, S. R.; Grierson, B. A.; Burrell, K. H.; Chrystal, C.; Groebner, R. J.; Kaplan, D. H.; Pablant, N. A.; Stagner, L.

    2016-11-01

    Recent completion of a thirty two channel main-ion (deuterium) charge exchange recombination spectroscopy (CER) diagnostic on the DIII-D tokamak [J. L. Luxon, Nucl. Fusion 42, 614 (2002)] enables detailed comparisons between impurity and main-ion temperature, density, and toroidal rotation. In a H-mode DIII-D discharge, these new measurement capabilities are used to provide the deuterium density profile, demonstrate the importance of profile alignment between Thomson scattering and CER diagnostics, and aid in determining the electron temperature at the separatrix. Sixteen sightlines cover the core of the plasma and another sixteen are densely packed towards the plasma edge, providing high resolution measurements across the pedestal and steep gradient region in H-mode plasmas. Extracting useful physical quantities such as deuterium density is challenging due to multiple photoemission processes. These challenges are overcome using a detailed fitting model and by forward modeling the photoemission using the FIDASIM code, which implements a comprehensive collisional radiative model.

  20. Material/element-dependent fluorescence-yield modes on soft X-ray absorption spectroscopy of cathode materials for Li-ion batteries

    NASA Astrophysics Data System (ADS)

    Asakura, Daisuke; Hosono, Eiji; Nanba, Yusuke; Zhou, Haoshen; Okabayashi, Jun; Ban, Chunmei; Glans, Per-Anders; Guo, Jinghua; Mizokawa, Takashi; Chen, Gang; Achkar, Andrew J.; Hawthron, David G.; Regier, Thomas Z.; Wadati, Hiroki

    2016-03-01

    We evaluate the utilities of fluorescence-yield (FY) modes in soft X-ray absorption spectroscopy (XAS) of several cathode materials for Li-ion batteries. In the case of total-FY (TFY) XAS for LiNi0.5Mn1.5O4, the line shape of the Mn L3-edge XAS was largely distorted by the self-absorption and saturation effects, while the distortions were less pronounced at the Ni L3 edge. The distortions were suppressed for the inverse-partial-FY (IPFY) spectra. We found that, in the cathode materials, the IPFY XAS is highly effective for the Cr, Mn, and Fe L edges and the TFY and PFY modes are useful enough for the Ni L edge which is far from the O K edge.

  1. Measurement of deuterium density profiles in the H-mode steep gradient region using charge exchange recombination spectroscopy on DIII-D

    SciTech Connect

    Haskey, S. R.; Grierson, B. A.; Burrell, K. H.; Chrystal, C.; Groebner, R. J.; Kaplan, D. H.; Pablant, N. A.; Stagner, L.

    2016-09-26

    Recent completion of a thirty two channel main-ion (deuterium) charge exchange recombination spectroscopy (CER) diagnostic on the DIII-D tokamak enables detailed comparisons between impurity and main-ion temperature, density, and toroidal rotation. In a H-mode DIII-D discharge, these new measurement capabilities are used to provide the deuterium density profile, demonstrate the importance of profile alignment between Thomson scattering and CER diagnostics, and aid in determining the electron temperature at the separatrix. Sixteen sightlines cover the core of the plasma and another sixteen are densely packed towards the plasma edge, providing high resolution measurements across the pedestal and steep gradient region in H-mode plasmas. Extracting useful physical quantities such as deuterium density is challenging due to multiple photoemission processes. Finally, these challenges are overcome using a detailed fitting model and by forward modeling the photoemission using the FIDASIM code, which implements a comprehensive collisional radiative model. Published by AIP Publishing.

  2. Measurement of deuterium density profiles in the H-mode steep gradient region using charge exchange recombination spectroscopy on DIII-D

    SciTech Connect

    Haskey, S. R.; Grierson, B. A.; Burrell, K. H.; Chrystal, C.; Groebner, R. J.; Kaplan, D. H.; Pablant, N. A.; Stagner, L.

    2016-09-26

    Recent completion of a thirty two channel main-ion (deuterium) charge exchange recombination spectroscopy (CER) diagnostic on the DIII-D tokamak enables detailed comparisons between impurity and main-ion temperature, density, and toroidal rotation. In a H-mode DIII-D discharge, these new measurement capabilities are used to provide the deuterium density profile, demonstrate the importance of profile alignment between Thomson scattering and CER diagnostics, and aid in determining the electron temperature at the separatrix. Sixteen sightlines cover the core of the plasma and another sixteen are densely packed towards the plasma edge, providing high resolution measurements across the pedestal and steep gradient region in H-mode plasmas. Extracting useful physical quantities such as deuterium density is challenging due to multiple photoemission processes. Finally, these challenges are overcome using a detailed fitting model and by forward modeling the photoemission using the FIDASIM code, which implements a comprehensive collisional radiative model. Published by AIP Publishing.

  3. Cubic-tetragonal transition in KMnF3: IR hard-mode spectroscopy and the temperature evolution of the (precursor) order parameter

    NASA Astrophysics Data System (ADS)

    Salje, Ekhard K. H.; Zhang, Ming; Zhang, Huali

    2009-08-01

    Precursor effects were observed in KMnF3 using infrared hard-mode spectroscopy. The intensity of the infrared-active mode near 265 cm-1 follows the thermodynamic order parameter, Q, in the tetragonal phase (I4/mcm). An additional weak signal is found in the cubic phase (Pm\\bar {3}m ). The order parameter step at To = 185.95 K (L = 0.129 J g-1) is smeared with excess intensity due to the tetragonal short range order extending to T>215 K. The intensity follows the predictions of Landau theory with a defect field Gdefect = -hQ, h = 6 J mol-1. The observed excess intensities are compared with the appearance of precursor elastic softening. It is concluded that the precursor softening and the local tetragonal short range order are likely to be related to an extended defect structure, such as a tweed pattern, which may be stabilized by extrinsic defects.

  4. Investigation of the terahertz vibrational modes of ZIF-8 and ZIF-90 with terahertz time-domain spectroscopy.

    PubMed

    Tan, Nicholas Y; Ruggiero, Michael T; Orellana-Tavra, Claudia; Tian, Tian; Bond, Andrew D; Korter, Timothy M; Fairen-Jimenez, David; Zeitler, J Axel

    2015-11-18

    We present experimental and computational evidence that gate-opening modes for zeolitic imidazole frameworks can be observed at terahertz frequencies. Our work highlights the critical importance to correctly optimise the crystal structure prior to computational lattice dynamics analysis. The results support the hypothesis that the low energy vibrational modes do indeed play a significant role in host-guest interactions for ZIFs, such as gas loading.

  5. Infrared and Raman Spectroscopy from Ab Initio Molecular Dynamics and Static Normal Mode Analysis: The C–H Region of DMSO as a Case Study

    DOE PAGES

    Fischer, Sean A.; Ueltschi, Tyler W.; El-Khoury, Patrick Z.; ...

    2015-07-29

    Carbon-hydrogen (C-H) vibration modes serve as key probes in the chemical identification of hydrocarbons and in vibrational sum-frequency generation (SFG) spectroscopy of hydrocarbons at the liquid/gas interface. Their assignments pose a challenge from a theoretical viewpoint. Here in this work, we present a detailed study of the C-H stretching region of dimethyl sulfoxide (DMSO) using a new Gaussian basis set- based ab initio molecular dynamics (AIMD) module that we have implemented in the NWChem computational chemistry program. By combining AIMD simulations and static normal mode analysis, we interpret experimental infrared and Raman spectra and explore the role of anharmonic effectsmore » in this system. Our anharmonic normal mode analysis of the in-phase and out-of-phase symmetric C-H stretching modes challenges the previous experimental assignment of the shoulder in the symmetric C-H stretching peak as an overtone or Fermi resonance. In addition, our AIMD simulations also show significant broadening of the in-phase symmetric C-H stretching resonance, which suggests that the experimentally observed shoulder is due to thermal broadening of the symmetric stretching resonance.« less

  6. Infrared and Raman Spectroscopy from Ab Initio Molecular Dynamics and Static Normal Mode Analysis: The C–H Region of DMSO as a Case Study

    SciTech Connect

    Fischer, Sean A.; Ueltschi, Tyler W.; El-Khoury, Patrick Z.; Mifflin, Amanda L.; Hess, Wayne P.; Wang, Hong-Fei; Cramer, Christopher J.; Govind, Niranjan

    2015-07-29

    Carbon-hydrogen (C-H) vibration modes serve as key probes in the chemical identification of hydrocarbons and in vibrational sum-frequency generation (SFG) spectroscopy of hydrocarbons at the liquid/gas interface. Their assignments pose a challenge from a theoretical viewpoint. Here in this work, we present a detailed study of the C-H stretching region of dimethyl sulfoxide (DMSO) using a new Gaussian basis set- based ab initio molecular dynamics (AIMD) module that we have implemented in the NWChem computational chemistry program. By combining AIMD simulations and static normal mode analysis, we interpret experimental infrared and Raman spectra and explore the role of anharmonic effects in this system. Our anharmonic normal mode analysis of the in-phase and out-of-phase symmetric C-H stretching modes challenges the previous experimental assignment of the shoulder in the symmetric C-H stretching peak as an overtone or Fermi resonance. In addition, our AIMD simulations also show significant broadening of the in-phase symmetric C-H stretching resonance, which suggests that the experimentally observed shoulder is due to thermal broadening of the symmetric stretching resonance.

  7. Optical Emission Spectroscopy of a 150kW DC Arc Torch: A Comparison of Transferred vs. Non-Transferred Modes

    NASA Astrophysics Data System (ADS)

    Counts, D. A.; Giuliani, J. L.; Peterson, S. H.; Han, Q. Y.; Sartwell, B. D.

    1997-04-01

    DC arc torches are proposed or in use for solid waste remediation at several sites. However, there is no consensus on the optimal mode of operation: transferred or non-transferred arc. As part of a project to investigate plasma treatment of shipboard waste, we have been investigating both modes at atmospheric pressure. This paper reports on the use of visible optical emission spectroscopy to determine the electron temperature, T_e, in the arc discharge for both the transferred and non transferred mode. In each case three industrial gases are compared, nitrogen, air and oxygen, at different flow rates and currents. Te is determined from the Balmer line ratio, wherein 5% hydrogen gas is added to the working gas in the torch flow. Variation of the emission with torch height and across the arc radius will be discussed. Recently, free arcs have shown evidence of non-LTE behavior in the arc mantle. Comparison of arc emission spectra as a function of radius for the transferred vs. non-transferred modes will be reported. Calorimetry results for the chamber walls, exhaust, and waste crucible will be correlated with the spectral results. This work was supported by the Office of Naval Research.

  8. Influence of surface hydroxylation on 3-aminopropyltriethoxysilane growth mode during chemical functionalization of GaN Surfaces: an angle-resolved X-ray photoelectron spectroscopy Study.

    PubMed

    Arranz, A; Palacio, C; García-Fresnadillo, D; Orellana, G; Navarro, A; Muñoz, E

    2008-08-19

    A comparative study of the chemical functionalization of undoped, n- and p-type GaN layers grown on sapphire substrates by metal-organic chemical vapor deposition was carried out. Both types of samples were chemically functionalized with 3-aminopropyltriethoxysilane (APTES) using a well-established silane-based approach for functionalizing hydroxylated surfaces. The untreated surfaces as well as those modified by hydroxylation and APTES deposition were analyzed using angle-resolved X-ray photoelectron spectroscopy. Strong differences were found between the APTES growth modes on n- and p-GaN surfaces that can be associated with the number of available hydroxyl groups on the GaN surface of each sample. Depending on the density of surface hydroxyl groups, different mechanisms of APTES attachment to the GaN surface take place in such a way that the APTES growth mode changes from a monolayer to a multilayer growth mode when the number of surface hydroxyl groups is decreased. Specifically, a monolayer growth mode with a surface coverage of approximately 78% was found on p-GaN, whereas the formation of a dense film, approximately 3 monolayers thick, was observed on n-GaN.

  9. Mode coupling of Schwarzschild perturbations: Ringdown frequencies

    NASA Astrophysics Data System (ADS)

    Pazos, Enrique; Brizuela, David; Martín-García, José M.; Tiglio, Manuel

    2010-11-01

    Within linearized perturbation theory, black holes decay to their final stationary state through the well-known spectrum of quasinormal modes. Here we numerically study whether nonlinearities change this picture. For that purpose we study the ringdown frequencies of gauge-invariant second-order gravitational perturbations induced by self-coupling of linearized perturbations of Schwarzschild black holes. We do so through high-accuracy simulations in the time domain of first and second-order Regge-Wheeler-Zerilli type equations, for a variety of initial data sets. We consider first-order even-parity (ℓ=2, m=±2) perturbations and odd-parity (ℓ=2, m=0) ones, and all the multipoles that they generate through self-coupling. For all of them and all the initial data sets considered we find that—in contrast to previous predictions in the literature—the numerical decay frequencies of second-order perturbations are the same ones of linearized theory, and we explain the observed behavior. This would indicate, in particular, that when modeling or searching for ringdown gravitational waves, appropriately including the standard quasinormal modes already takes into account nonlinear effects.

  10. Terahertz spectroscopy and solid-state density functional theory calculation of anthracene: effect of dispersion force on the vibrational modes.

    PubMed

    Zhang, Feng; Hayashi, Michitoshi; Wang, Houng-Wei; Tominaga, Keisuke; Kambara, Ohki; Nishizawa, Jun-ichi; Sasaki, Tetsuo

    2014-05-07

    The phonon modes of molecular crystals in the terahertz frequency region often feature delicately coupled inter- and intra-molecular vibrations. Recent advances in density functional theory such as DFT-D(*) have enabled accurate frequency calculation. However, the nature of normal modes has not been quantitatively discussed against experimental criteria such as isotope shift (IS) and correlation field splitting (CFS). Here, we report an analytical mode-decoupling method that allows for the decomposition of a normal mode of interest into intermolecular translation, libration, and intramolecular vibrational motions. We show an application of this method using the crystalline anthracene system as an example. The relationship between the experimentally obtained IS and the IS obtained by PBE-D(*) simulation indicates that two distinctive regions exist. Region I is associated with a pure intermolecular translation, whereas region II features coupled intramolecular vibrations that are further coupled by a weak intermolecular translation. We find that the PBE-D(*) data show excellent agreement with the experimental data in terms of IS and CFS in region II; however, PBE-D(*) produces significant deviations in IS in region I where strong coupling between inter- and intra-molecular vibrations contributes to normal modes. The result of this analysis is expected to facilitate future improvement of DFT-D(*).

  11. Terahertz spectroscopy and solid-state density functional theory calculation of anthracene: Effect of dispersion force on the vibrational modes

    NASA Astrophysics Data System (ADS)

    Zhang, Feng; Hayashi, Michitoshi; Wang, Houng-Wei; Tominaga, Keisuke; Kambara, Ohki; Nishizawa, Jun-ichi; Sasaki, Tetsuo

    2014-05-01

    The phonon modes of molecular crystals in the terahertz frequency region often feature delicately coupled inter- and intra-molecular vibrations. Recent advances in density functional theory such as DFT-D* have enabled accurate frequency calculation. However, the nature of normal modes has not been quantitatively discussed against experimental criteria such as isotope shift (IS) and correlation field splitting (CFS). Here, we report an analytical mode-decoupling method that allows for the decomposition of a normal mode of interest into intermolecular translation, libration, and intramolecular vibrational motions. We show an application of this method using the crystalline anthracene system as an example. The relationship between the experimentally obtained IS and the IS obtained by PBE-D* simulation indicates that two distinctive regions exist. Region I is associated with a pure intermolecular translation, whereas region II features coupled intramolecular vibrations that are further coupled by a weak intermolecular translation. We find that the PBE-D* data show excellent agreement with the experimental data in terms of IS and CFS in region II; however, PBE-D* produces significant deviations in IS in region I where strong coupling between inter- and intra-molecular vibrations contributes to normal modes. The result of this analysis is expected to facilitate future improvement of DFT-D*.

  12. Amplitude-Mode Spectroscopy of Charge Excitations in PTB7 π -Conjugated Donor-Acceptor Copolymer for Photovoltaic Applications

    NASA Astrophysics Data System (ADS)

    Baniya, Sangita; Vardeny, Shai R.; Lafalce, Evan; Peygambarian, Nasser; Vardeny, Z. Valy

    2017-06-01

    We measure the spectra of resonant Raman scattering and doping-induced absorption of pristine films of the π -conjugated donor-acceptor (D -A ) copolymer, namely, thieno[3,4 b]thiophene-alt-benzodithiophene (PTB7), as well as photoinduced absorption spectrum in a blend of PTB7 with fullerene phenyl-C61-butyric acid methyl ester molecules used for organic photovoltaic (OPV) applications. We find that the D -A copolymer contains six strongly coupled vibrational modes having relatively strong Raman-scattering intensity, which are renormalized upon adding charge polarons onto the copolymer chains either by doping or photogeneration. Since the lower-energy charge-polaron absorption band overlaps with the renormalized vibrational modes, they appear as antiresonance lines superposed onto the induced polaron absorption band in the photoinduced absorption spectrum but less so in the doping-induced absorption spectrum. We show that the Raman-scattering, doping-, and photoinduced absorption spectra of PTB7 are well explained by the amplitude mode model, where a single vibrational propagator describes the renormalized modes and their related intensities in detail. From the relative strengths of the induced infrared activity of the polaron-related vibrations and electronic transitions, we obtain the polaron effective kinetic mass in PTB7 using the amplitude mode model to be approximately 3.8 m* , where m* is the electron effective mass. The enhanced polaronic mass in PTB7 may limit the charge mobility, which, in turn, reduces the OPV solar-cell efficiency based on the PTB7-fullerene blend.

  13. Infrared and Raman Spectroscopy from Ab Initio Molecular Dynamics and Static Normal Mode Analysis: The C-H Region of DMSO as a Case Study.

    PubMed

    Fischer, Sean A; Ueltschi, Tyler W; El-Khoury, Patrick Z; Mifflin, Amanda L; Hess, Wayne P; Wang, Hong-Fei; Cramer, Christopher J; Govind, Niranjan

    2016-03-03

    Carbon-hydrogen (C-H) vibration modes serve as key probes in the chemical identification of hydrocarbons and in vibrational sum-frequency generation spectroscopy of hydrocarbons at the liquid/gas interface. Their assignments pose a challenge from a theoretical viewpoint. In this work, we present a detailed study of the C-H stretching region of dimethyl sulfoxide using a new ab initio molecular dynamics (AIMD) module that we have implemented in NWChem. Through a combination of AIMD simulations and static normal mode analysis, we interpret experimental infrared and Raman spectra and explore the role of anharmonic effects in this system. Comprehensive anharmonic normal mode analysis of the C-H stretching region casts doubt upon previous experimental assignments of the shoulder on the symmetric C-H stretching peak. In addition, our AIMD simulations also show significant broadening of the in-phase symmetric C-H stretching resonance, which suggests that the experimentally observed shoulder is due to thermal broadening of the symmetric stretching resonance.

  14. Dynamic and polychromatic SPR leaky-mode spectroscopy with Teflon AF films on silver for chemo-sensing

    NASA Astrophysics Data System (ADS)

    Podgorsek, R. P.; Franke, Hilmar; Caron, Serge; Galarneau, Pierre

    1998-12-01

    The reflectivity of a polymer film on top of a thin metal layer is usually recorded for a fixed wavelength and the TM polarization as a function of the angle of incidence. This angular spectrum contains the surface plasmon resonance due to the metal layer and the leaky modes caused by the waveguide resonances of the polymer film. Here we investigated the reflectivity spectrum of such a multilayer for a white light source as a function of the wavelength at a constant angle of incidence. The leaky mode resonances on the wavelength scale have been detected. Dynamic measurements of the reflectivity of such a multilayer at constant angle and constant wavelength have been demonstrated for vapors of Toluene as an example. The realization of compact and simple devices using this technique is possible.

  15. Gap-mode enhancement on MoS2 probed by functionalized tip-enhanced Raman spectroscopy

    NASA Astrophysics Data System (ADS)

    Alajlan, Abdulrahman M.; Voronine, Dmitri V.; Sinyukov, Alexander M.; Zhang, Zhenrong; Sokolov, Alexei V.; Scully, Marlan O.

    2016-09-01

    Surface enhancement of molecular spectroscopic signals has been widely used for sensing and nanoscale imaging. Because of the weak electromagnetic enhancement of Raman signals on semiconductors, it is motivating but challenging to study the electromagnetic effect separately from the chemical effects. We report tip-enhanced Raman scattering measurements on Au and bulk MoS2 substrates using a metallic tip functionalized with copper phthalocyanine molecules and demonstrate similar gap-mode enhancement on both substrates. We compare the experimental results with theoretical calculations to confirm the gap-mode enhancement on MoS2 using a well-established electrostatic model. The functionalized tip approach allows for suppressing the background and is ideal for separating electromagnetic and chemical enhancement mechanisms on various substrates. Our results may find a wide range of applications in MoS2-based devices, sensors, and metal-free nanoscale bio-imaging.

  16. High resolution spectroscopy of 1,2-difluoroethane in a molecular beam: A case study of vibrational mode-coupling

    NASA Astrophysics Data System (ADS)

    Mork, Steven W.; Miller, C. Cameron; Philips, Laura A.

    1992-09-01

    The high resolution infrared spectrum of 1,2-difluoroethane (DFE) in a molecular beam has been obtained over the 2978-2996 cm-1 spectral region. This region corresponds to the symmetric combination of asymmetric C-H stretches in DFE. Observed rotational fine structure indicates that this C-H stretch is undergoing vibrational mode coupling to a single dark mode. The dark mode is split by approximately 19 cm-1 due to tunneling between the two identical gauche conformers. The mechanism of the coupling is largely anharmonic with a minor component of B/C plane Coriolis coupling. Effects of centrifugal distortion along the molecular A-axis are also observed. Analysis of the fine structure identifies the dark state as being composed of C-C torsion, CCF bend, and CH2 rock. Coupling between the C-H stretches and the C-C torsion is of particular interest because DFE has been observed to undergo vibrationally induced isomerization from the gauche to trans conformer upon excitation of the C-H stretch.

  17. Characterization of the LCLS "nanosecond two-bunch" mode for x-ray speckle visibility spectroscopy experiments

    NASA Astrophysics Data System (ADS)

    Sun, Yanwen; Zhu, Diling; Song, Sanghoon; Decker, Franz-Josef; Sutton, Mark; Ludwig, Karl; Roseker, Wojciech; Grübel, Gerhard; Hruszkewycz, Stephan; Stephenson, G. Brian; Fuoss, Paul H.; Robert, Aymeric

    2017-05-01

    The generation of two X-ray pulses with tunable nanosecond scale time separations has recently been demonstrated at the Linac Coherent Light Source using an accelerator based technique. This approach offers the opportunity to extend X-ray Photon Correlation Spectroscopy techniques to the yet unexplored regime of nanosecond timescales by means of X-ray Speckle Visibility Spectroscopy. As the two pulses originate from two independent Spontaneous Amplified Stimulated Emission processes, the beam properties fluctuate from pulse pair to pulse pair, but as well between the individual pulses within a pair. However, two-pulse XSVS experiments require the intensity of the individual pulses to be either identical in the ideal case, or with a accurately known intensity ratio. We present the design and performances of a non-destructive intensity diagnostic based on measurement of scattering from a transparent target using a high-speed photo-detector. Individual pulses within a pulse pair with time delays as short as 0.7 ns can be resolved. Moreover, using small angle coherent scattering, we characterize the averaged spatial overlap of the focused pulse pairs. The multi-shot average-speckle contrasts from individual pulses and pulse pairs are compared.

  18. Characterization of the LCLS “nanosecond two-bunch” mode for x-ray speckle visibility spectroscopy experiments

    DOE PAGES

    Sun, Yanwen; Zhu, Diling; Song, Sanghoon; ...

    2017-05-23

    The generation of two X-ray pulses with tunable nanosecond scale time separations has recently been demonstrated at the Linac Coherent Light Source using an accelerator based technique. This approach offers the opportunity to extend X-ray Photon Correlation Spectroscopy techniques to the yet unexplored regime of nanosecond timescales by means of X-ray Speckle Visibility Spectroscopy. As the two pulses originate from two independent Spontaneous Amplified Stimulated Emission processes, the beam properties fluctuate from pulse pair to pulse pair, but as well between the individual pulses within a pair. However, two-pulse XSVS experiments require the intensity of the individual pulses to bemore » either identical in the ideal case, or with a accurately known intensity ratio. We present the design and performances of a non-destructive intensity diagnostic based on measurement of scattering from a transparent target using a high-speed photo-detector. Individual pulses within a pulse pair with time delays as short as 0.7 ns can be resolved. Moreover, using small angle coherent scattering, we characterize the averaged spatial overlap of the focused pulse pairs. Furthermore, the multi-shot average-speckle contrasts from individual pulses and pulse pairs are compared.« less

  19. Characterization of the LCLS ”Nanosecond Two-Bunch” Mode for X-Ray Speckle Visibility Spectroscopy Experiments.

    SciTech Connect

    Sun, Yanwen; Zhu, Dilling; Song, Sanghoon; Decker, Franz-Josef; Sutton, Mark; Ludwig, Karl; Roseker, Wojciech; Gruebel, Gerhard; Hruszkewycz, Stephan; Stephenson, G. Brian; Fuoss, Paul H.; Robert, Aymeric

    2017-01-01

    The generation of two X-ray pulses with tunable nanosecond scale time separations has recently been demonstrated at the Linac Coherent Light Source using an accelerator based technique. This approach offers the opportunity to extend X-ray Photon Correlation Spectroscopy techniques to the yet unexplored regime of nanosecond timescales by means of X-ray Speckle Visibility Spectroscopy. As the two pulses originate from two independent Spontaneous Amplified Stimulated Emission processes, the beam properties fluctuate from pulse pair to pulse pair, but as well between the individual pulses within a pair. However, two-pulse XSVS experiments require the intensity of the individual pulses to be either identical in the ideal case, or with a accurately known intensity ratio. We present the design and performances of a non-destructive intensity diagnostic based on measurement of scattering from a transparent target using a high-speed photo-detector. Individual pulses within a pulse pair with time delays as short as 0.7 ns can be resolved. Moreover, using small angle coherent scattering, we characterize the averaged spatial overlap of the focused pulse pairs. The multi-shot average-speckle contrasts from individual pulses and pulse pairs are compared.

  20. Part-Per-Trillion Level SF6 Detection Using a Quartz Enhanced Photoacoustic Spectroscopy-Based Sensor with Single-Mode Fiber-Coupled Quantum Cascade Laser Excitation

    SciTech Connect

    Spagnolo, V.; Patimisco, P.; Borri, Simone; Scamarcio, G.; Bernacki, Bruce E.; Kriesel, J.M.

    2012-10-23

    A sensitive spectroscopic sensor based on a hollow-core fiber-coupled quantum cascade laser (QCL) emitting at 10.54 µm and quartz enhanced photoacoustic spectroscopy (QEPAS) technique is reported. The design and realization of mid-infrared fiber and coupler optics has ensured single-mode QCL beam delivery to the QEPAS sensor . The collimation optics was designed to produce a laser beam of significantly reduced beam size and waist so as to prevent illumination of the quartz tuning fork and micro-resonator tubes. SF6 was selected as the target gas. A minimum detection sensitivity of 50 parts per trillion in 1 s was achieved with a QCL power of 18 mW, corresponding to a normalized noise-equivalent absorption of 2.7x10-10 W•cm-1/Hz1/2.

  1. Part-per-trillion level SF6 detection using a quartz enhanced photoacoustic spectroscopy-based sensor with single-mode fiber-coupled quantum cascade laser excitation.

    PubMed

    Spagnolo, Vincenzo; Patimisco, Pietro; Borri, Simone; Scamarcio, Gaetano; Bernacki, Bruce E; Kriesel, Jason

    2012-11-01

    A sensitive spectroscopic sensor based on a hollow-core fiber-coupled quantum cascade laser (QCL) emitting at 10.54 μm and quartz enhanced photoacoustic spectroscopy (QEPAS) technique is reported. The design and realization of mid-IR fiber and coupler optics has ensured single-mode QCL beam delivery to the QEPAS sensor. The collimation optics was designed to produce a laser beam of significantly reduced beam size and waist so as to prevent illumination of the quartz tuning fork and microresonator tubes. SF(6) was selected as the target gas. A minimum detection sensitivity of 50 parts per trillion in 1 s was achieved with a QCL power of 18 mW, corresponding to a normalized noise-equivalent absorption of 2.7×10(-10) W·cm(-1)/Hz(1/2).

  2. Infrared complex refractive index measurements and simulated reflection mode infrared absorption spectroscopy of shock-compressed polymer thin films.

    PubMed

    Moore, D S; McGrane, S D; Funk, D J

    2004-05-01

    Thin film interference effects complicate the interpretation of reflection-mode infrared absorption spectra obtained in shock-compressed thin film materials and must be carefully accounted for in any analysis attempting to unravel shock-induced energy transfer or reactivity. We have calculated such effects for spectrally simple model systems and also, to the extent possible, for real systems such as polymethylmethacrylate (PMMA) and nitrocellulose (NC). We have utilized angle-dependent infrared (IR) reflectometry to obtain the ambient spectral complex index for PMMA and NC for use in the calculations and to interpret experiments. A number of counter-intuitive spectral effects are observed versus film thickness and during uniaxial shock compression: absorption band shifts, changes of shape, and changes in both absolute and relative peak intensities. The film thickness effects can be predicted by thin film interference alone, while additional assumptions are required to predict the effects due to shock compression. Since it is very difficult to obtain the complex index in the shock state, we made very simple assumptions regarding the change in vibrational spectra upon shock load-ing. We illustrate general thin film interference effects that could be expected and compare them to experimental results for the antisymmetric NO2 stretch mode of NC.

  3. Phonon Mode Transformation Across the Orthohombic-Tetragonal Phase Transition in a Lead Iodide Perovskite CH3NH3PbI3: A Terahertz Time-Domain Spectroscopy Approach.

    PubMed

    La-o-Vorakiat, Chan; Xia, Huanxin; Kadro, Jeannette; Salim, Teddy; Zhao, Daming; Ahmed, Towfiq; Lam, Yeng Ming; Zhu, Jian-Xin; Marcus, Rudolph A; Michel-Beyerle, Maria-Elisabeth; Chia, Elbert E M

    2016-01-07

    We study the temperature-dependent phonon modes of the organometallic lead iodide perovskite CH3NH3PbI3 thin film across the terahertz (0.5-3 THz) and temperature (20-300 K) ranges. These modes are related to the vibration of the Pb-I bonds. We found that two phonon modes in the tetragonal phase at room temperature split into four modes in the low-temperature orthorhombic phase. By use of the Lorentz model fitting, we analyze the critical behavior of this phase transition. The carrier mobility values calculated from the low-temperature phonon mode frequencies, via two theoretical approaches, are found to agree reasonably with the experimental value (∼2000 cm(2) V(-1) s(-1)) from a previous time-resolved THz spectroscopy work. Thus, we have established a possible link between terahertz phonon modes and the transport properties of perovskite-based solar cells.

  4. Time-resolved soft X-ray absorption spectroscopy in transmission mode on liquids at MHz repetition rates.

    PubMed

    Fondell, Mattis; Eckert, Sebastian; Jay, Raphael M; Weniger, Christian; Quevedo, Wilson; Niskanen, Johannes; Kennedy, Brian; Sorgenfrei, Florian; Schick, Daniel; Giangrisostomi, Erika; Ovsyannikov, Ruslan; Adamczyk, Katrin; Huse, Nils; Wernet, Philippe; Mitzner, Rolf; Föhlisch, Alexander

    2017-09-01

    We present a setup combining a liquid flatjet sample delivery and a MHz laser system for time-resolved soft X-ray absorption measurements of liquid samples at the high brilliance undulator beamline UE52-SGM at Bessy II yielding unprecedented statistics in this spectral range. We demonstrate that the efficient detection of transient absorption changes in transmission mode enables the identification of photoexcited species in dilute samples. With iron(II)-trisbipyridine in aqueous solution as a benchmark system, we present absorption measurements at various edges in the soft X-ray regime. In combination with the wavelength tunability of the laser system, the set-up opens up opportunities to study the photochemistry of many systems at low concentrations, relevant to materials sciences, chemistry, and biology.

  5. Time-resolved soft X-ray absorption spectroscopy in transmission mode on liquids at MHz repetition rates

    PubMed Central

    Fondell, Mattis; Eckert, Sebastian; Jay, Raphael M.; Weniger, Christian; Quevedo, Wilson; Niskanen, Johannes; Kennedy, Brian; Sorgenfrei, Florian; Schick, Daniel; Giangrisostomi, Erika; Ovsyannikov, Ruslan; Adamczyk, Katrin; Huse, Nils; Wernet, Philippe; Mitzner, Rolf; Föhlisch, Alexander

    2017-01-01

    We present a setup combining a liquid flatjet sample delivery and a MHz laser system for time-resolved soft X-ray absorption measurements of liquid samples at the high brilliance undulator beamline UE52-SGM at Bessy II yielding unprecedented statistics in this spectral range. We demonstrate that the efficient detection of transient absorption changes in transmission mode enables the identification of photoexcited species in dilute samples. With iron(II)-trisbipyridine in aqueous solution as a benchmark system, we present absorption measurements at various edges in the soft X-ray regime. In combination with the wavelength tunability of the laser system, the set-up opens up opportunities to study the photochemistry of many systems at low concentrations, relevant to materials sciences, chemistry, and biology. PMID:28852689

  6. Infrared spectroscopy of the amide I mode of N-methylacetamide in solid hydrogen at 2-4 K.

    PubMed

    Paulson, Leif O; Anderson, David T

    2011-11-24

    We report high-resolution (0.05 cm(-1)) FTIR spectra of the fundamental and first overtone of the amide I mode of trans-N-methylacetamide (NMA) trapped in solid molecular hydrogen (SMH) at cryogenic temperatures with low (0.03%) and high (55%) ortho-hydrogen (oH(2)) concentrations. NMA-doped SMH samples with high oH(2) concentrations are nearly free from inhomogeneous broadening, permitting the measured amide I homogeneous line width of 1.268(8) cm(-1) to be used to place a lower limit on the vibrational lifetime of 4.19(3) ps. Direct observation of the amide I overtone allows the harmonic vibrational frequency ω(e) = 1726.6(5) cm(-1) and the anharmonicity constant ω(e)x(e) = 8.5(2) cm(-1) to be determined for NMA isolated in SMH samples with low oH(2) concentrations.

  7. A versatile setup for ultrafast broadband optical spectroscopy of coherent collective modes in strongly correlated quantum systems

    PubMed Central

    Baldini, Edoardo; Mann, Andreas; Borroni, Simone; Arrell, Christopher; van Mourik, Frank; Carbone, Fabrizio

    2016-01-01

    A femtosecond pump-probe setup is described that is optimised for broadband transient reflectivity experiments on solid samples over a wide temperature range. By combining high temporal resolution and a broad detection window, this apparatus can investigate the interplay between coherent collective modes and high-energy electronic excitations, which is a distinctive characteristic of correlated electron systems. Using a single-shot readout array detector at frame rates of 10 kHz allows resolving coherent oscillations with amplitudes <10−4. We demonstrate its operation on the charge-transfer insulator La2CuO4, revealing coherent phonons with frequencies up to 13 THz and providing access into their Raman matrix elements. PMID:27990455

  8. High-resolution Fourier-transform infrared spectroscopy of the Coriolis coupled ground state and ν7 mode of ketenimine.

    PubMed

    Bane, Michael K; Robertson, Evan G; Thompson, Christopher D; Medcraft, Chris; Appadoo, Dominique R T; McNaughton, Don

    2011-06-21

    High resolution FTIR spectra of the short lived species ketenimine have been recorded in the regions 390-1300 cm(-1) and 20-110 cm(-1) using synchrotron radiation. Two thousand six hundred sixty transitions of the ν(7) band centered at 693 cm(-1) and 126 far-IR rotational transitions have been assigned. Rotational and centrifugal distortion parameters for the ν(7) mode were determined and local Fermi and b-axis Coriolis interactions with 2ν(12) are treated. A further refinement of the ground state, ν(12) and ν(8) parameters was also achieved, including the treatment of previously unrecognized ac-axis and ab-axis second order perturbations to the ground state.

  9. Observation of multiple vibrational modes in ultrahigh vacuum tip-enhanced Raman spectroscopy combined with molecular-resolution scanning tunneling microscopy.

    PubMed

    Jiang, N; Foley, E T; Klingsporn, J M; Sonntag, M D; Valley, N A; Dieringer, J A; Seideman, T; Schatz, G C; Hersam, M C; Van Duyne, R P

    2012-10-10

    Multiple vibrational modes have been observed for copper phthalocyanine (CuPc) adlayers on Ag(111) using ultrahigh vacuum (UHV) tip-enhanced Raman spectroscopy (TERS). Several important new experimental features are introduced in this work that significantly advance the state-of-the-art in UHV-TERS. These include (1) concurrent sub-nm molecular resolution STM imaging using Ag tips with laser illumination of the tip-sample junction, (2) laser focusing and Raman collection optics that are external to the UHV-STM that has two cryoshrouds for future low temperature experiments, and (3) all sample preparation steps are carried out in UHV to minimize contamination and maximize spatial resolution. Using this apparatus we have been able to demonstrate a TERS enhancement factor of 7.1 × 10(5). Further, density-functional theory calculations have been carried out that allow quantitative identification of eight different vibrational modes in the TER spectra. The combination of molecular-resolution UHV-STM imaging with the detailed chemical information content of UHV-TERS allows the interactions between large polyatomic molecular adsorbates and specific binding sites on solid surfaces to be probed with unprecedented spatial and spectroscopic resolution.

  10. Far-Infrared and Raman Spectroscopy Investigation of Phonon Modes in Amorphous and Crystalline Epitaxial GeTe-Sb2Te3 Alloys

    PubMed Central

    Bragaglia, V.; Holldack, K.; Boschker, J. E.; Arciprete, F.; Zallo, E.; Flissikowski, T.; Calarco, R.

    2016-01-01

    A combination of far-infrared and Raman spectroscopy is employed to investigate vibrational modes and the carrier behavior in amorphous and crystalline ordered GeTe-Sb2Te3 alloys (GST) epitaxially grown on Si(111). The infrared active GST mode is not observed in the Raman spectra and vice versa, indication of the fact that inversion symmetry is preserved in the metastable cubic phase in accordance with the Fm3 space group. For the trigonal phase, instead, a partial symmetry break due to Ge/Sb mixed anion layers is observed. By studying the crystallization process upon annealing with both the techniques, we identify temperature regions corresponding to the occurrence of different phases as well as the transition from one phase to the next. Activation energies of 0.43 eV and 0.08 eV for the electron conduction are obtained for both cubic and trigonal phases, respectively. In addition a metal-insulator transition is clearly identified to occur at the onset of the transition between the disordered and the ordered cubic phase. PMID:27340085

  11. Measurement of deuterium density profiles in the H-mode steep gradient region using charge exchange recombination spectroscopy on DIII-D

    DOE PAGES

    Haskey, S. R.; Grierson, B. A.; Burrell, K. H.; ...

    2016-09-26

    Recent completion of a thirty two channel main-ion (deuterium) charge exchange recombination spectroscopy (CER) diagnostic on the DIII-D tokamak enables detailed comparisons between impurity and main-ion temperature, density, and toroidal rotation. In a H-mode DIII-D discharge, these new measurement capabilities are used to provide the deuterium density profile, demonstrate the importance of profile alignment between Thomson scattering and CER diagnostics, and aid in determining the electron temperature at the separatrix. Sixteen sightlines cover the core of the plasma and another sixteen are densely packed towards the plasma edge, providing high resolution measurements across the pedestal and steep gradient region inmore » H-mode plasmas. Extracting useful physical quantities such as deuterium density is challenging due to multiple photoemission processes. Finally, these challenges are overcome using a detailed fitting model and by forward modeling the photoemission using the FIDASIM code, which implements a comprehensive collisional radiative model. Published by AIP Publishing.« less

  12. Far-Infrared and Raman Spectroscopy Investigation of Phonon Modes in Amorphous and Crystalline Epitaxial GeTe-Sb2Te3 Alloys

    NASA Astrophysics Data System (ADS)

    Bragaglia, V.; Holldack, K.; Boschker, J. E.; Arciprete, F.; Zallo, E.; Flissikowski, T.; Calarco, R.

    2016-06-01

    A combination of far-infrared and Raman spectroscopy is employed to investigate vibrational modes and the carrier behavior in amorphous and crystalline ordered GeTe-Sb2Te3 alloys (GST) epitaxially grown on Si(111). The infrared active GST mode is not observed in the Raman spectra and vice versa, indication of the fact that inversion symmetry is preserved in the metastable cubic phase in accordance with the Fm3 space group. For the trigonal phase, instead, a partial symmetry break due to Ge/Sb mixed anion layers is observed. By studying the crystallization process upon annealing with both the techniques, we identify temperature regions corresponding to the occurrence of different phases as well as the transition from one phase to the next. Activation energies of 0.43 eV and 0.08 eV for the electron conduction are obtained for both cubic and trigonal phases, respectively. In addition a metal-insulator transition is clearly identified to occur at the onset of the transition between the disordered and the ordered cubic phase.

  13. Interface and growth-mode characterization of Ce/Fe and CeH≊2/Fe multilayers by x-ray diffraction and Rutherford backscattering spectroscopy

    NASA Astrophysics Data System (ADS)

    Klose, F.; Steins, M.; Kacsich, T.; Felsch, W.

    1993-07-01

    The detailed structural characterization of ion beam sputtered Ce/Fe and CeH≊2/Fe multilayers offers the possibility for a better understanding of their magnetic properties. In the case of the Ce/Fe multilayers the extension of the interface, as one of the most important features, is determined to 5-7 Å by means of Monte Carlo simulations of the small-angle x-ray scattering diagrams. Below a critical thickness of ≊24 Å Fe grows in an amorphous structure. Here the interface extension is enhanced. In contrast all CeH≊2/Fe multilayers show nearly abrupt interfaces. X-ray scattering experiments at higher angles in reflection and transmission mode provide information about the crystal structure, the texture, and the lateral dimensions of the grains in the samples. Depths profiles of the multilayers are generated by Rutherford backscattering spectroscopy, which confirm the well-ordered periodic structures. Surprisingly indications of an island-like growth mode of the Fe layers onto the Ce and CeH≊2 layers could be resolved by using this procedure.

  14. Material/element-dependent fluorescence-yield modes on soft X-ray absorption spectroscopy of cathode materials for Li-ion batteries

    SciTech Connect

    Asakura, Daisuke; Hosono, Eiji; Nanba, Yusuke; Zhou, Haoshen; Okabayashi, Jun; Ban, Chunmei; Glans, Per -Anders; Guo, Jinghua; Mizokawa, Takashi; Chen, Gang; Achkar, Andrew J.; Hawthron, David G.; Regier, Thomas Z.; Wadati, Hiroki

    2016-03-07

    Here, we evaluate the utilities of fluorescence-yield (FY) modes in soft X-ray absorption spectroscopy (XAS) of several cathodematerials for Li-ion batteries. In the case of total-FY (TFY) XAS for LiNi0.5Mn1.5O4, the line shape of the Mn L3-edge XAS was largely distorted by the self-absorption and saturation effects, while the distortions were less pronounced at the NiL3 edge. The distortions were suppressed for the inverse-partial-FY (IPFY) spectra. We found that, in the cathodematerials, the IPFY XAS is highly effective for the Cr, Mn, and Fe L edges and the TFY and PFY modes are useful enough for the NiL edge which is far from the O K edge.

  15. Cubic-tetragonal transition in KMnF(3): IR hard-mode spectroscopy and the temperature evolution of the (precursor) order parameter.

    PubMed

    Salje, Ekhard K H; Zhang, Ming; Zhang, Huali

    2009-08-19

    Precursor effects were observed in KMnF(3) using infrared hard-mode spectroscopy. The intensity of the infrared-active mode near 265 cm(-1) follows the thermodynamic order parameter, Q, in the tetragonal phase (I4/mcm). An additional weak signal is found in the cubic phase ([Formula: see text]). The order parameter step at T(o) = 185.95 K (L = 0.129 J g(-1)) is smeared with excess intensity due to the tetragonal short range order extending to T>215 K. The intensity follows the predictions of Landau theory with a defect field G(defect) = -hQ, h = 6 J mol(-1). The observed excess intensities are compared with the appearance of precursor elastic softening. It is concluded that the precursor softening and the local tetragonal short range order are likely to be related to an extended defect structure, such as a tweed pattern, which may be stabilized by extrinsic defects.

  16. Studies of redox reactions in electro-active proteins using optical impedance spectroscopy at single-mode waveguides

    NASA Astrophysics Data System (ADS)

    Han, Xue; Mendes, Sergio B.

    2013-09-01

    An electro-active platform based on a single-mode integrated optical waveguide over-coated with a 13-nm indium tin oxide film was developed for highly sensitive investigations on the kinetics of redox reactions from a sub-monolayer of cytochrome-c proteins. Optical impedance spectra (with and without cytochrome-c proteins present in the spectroelectrochemical flow-cell) were measured with the single-mode integrated optical waveguide for a 10-mV ac electric potential modulation. Significant changes in the ac component of the optical baseline response were observed, and a new analysis was developed to factor out the working electrode effects and deliver accurate results for the Faradaic process. Faradaic current density and active surface coverage were reconstructed at several modulation frequencies. As small as 7x10-14 mole/cm2 of cytochrome-c proteins were detected under such electric potential modulation leading to a faradaic current of about 200 nA/cm2. Such level of faradaic current is extremely difficult to be isolated by other electrochemical techniques (e.g. electrical impedance measurements) due to the strong background created by an always present electric double layer. We were able to achieve those detection limits because the optical signal is immune to those events and can be tuned solely to the Faradaic process. This highly sensitive and accurate strategy of spectro-electrochemistry is proved powerful for measurements of extreme small amount of electro-active proteins and has the potential to be used in many other important electrochemical processes.

  17. Stable, tunable, and single-mode operation of an erbium-doped fibre laser system using a saturable absorber for gas spectroscopy applications

    NASA Astrophysics Data System (ADS)

    Arsad, Norhana; Stewart, George

    2009-02-01

    We present an erbium doped fibre ring laser system to realize single frequency lasing by incorporating a reflector with ~2m of un-pumped polarization-maintaining erbium-doped fibre to act as a saturable absorber. Depending on the particular requirements, the fibre reflector may be a fibre Bragg grating (FBG), loop mirror (LM) or a reflective coating on the fibre end. In this way, a transient grating is formed in the saturable absorber which acts as a narrow-band optical filter, reducing the number of modes over which the laser can operate and hence suppressing mode hopping in the cavity. Polarization-maintaining (PM) components are used throughout the system, except for the EDFA, and a polarization controller is used for enhancing stability and to ensure that the state of polarization is properly aligned. With this system we have observed a long period of stable, narrow line-width and single mode operation, tuneable over 30nm. The intended application is for gas spectroscopy using wavelength scanning and pump modulation. A Sagnac loop filter (SLF) can be used to scan the centre wavelength over a gas absorption line while the pump modulation produces an amplitude modulated signal on the output, suitable for detection by a lock-in (phase-sensitive) amplifier. The method is useful for the recovery of absorption line-shapes in the near-IR where the overtone absorption lines are weak. Compared with the use of a traditional DFB laser source, the fibre laser offers the advantages of a much broader tuning range and recovery of distortion-free line-shapes since wavelength and amplitude modulation may be performed independently.

  18. High resolution spectroscopy of jet cooled phenyl radical: The ν1 and ν2 a1 symmetry C-H stretching modes.

    PubMed

    Chang, Chih-Hsuan; Nesbitt, David J

    2016-07-28

    A series of CH stretch modes in phenyl radical (C6H5) has been investigated via high resolution infrared spectroscopy at sub-Doppler resolution (∼60 MHz) in a supersonic discharge slit jet expansion. Two fundamental vibrations of a1 symmetry, ν1 and ν2, are observed and rotationally analyzed for the first time, corresponding to in-phase and out-of-phase symmetric CH stretch excitation at the ortho/meta/para and ortho/para C atoms with respect to the radical center. The ν1 and ν2 band origins are determined to be 3073.968 50(8) cm(-1) and 3062.264 80(7) cm(-1), respectively, which both agree within 5 cm(-1) with theoretical anharmonic scaling predictions based on density functional B3LYP/6-311g++(3df,3dp) calculations. Integrated band strengths for each of the CH stretch bands are analyzed, with the relative intensities agreeing remarkably well with theoretical predictions. Frequency comparison with previous low resolution Ar-matrix spectroscopy [A. V. Friderichsen et al., J. Am. Chem. Soc. 123, 1977 (2001)] reveals a nearly uniform Δν ≈ + 10-12 cm(-1) blue shift between gas phase and Ar matrix values for ν1 and ν2. This differs substantially from the much smaller red shift (Δν ≈ - 1 cm(-1)) reported for the ν19 mode, and suggests a simple physical model in terms of vibrational mode symmetry and crowding due to the matrix environment. Finally, the infrared phenyl spectra are well described by a simple asymmetric rigid rotor Hamiltonian and show no evidence for spectral congestion due to intramolecular vibrational coupling, which bodes well for high resolution studies of other ring radicals and polycyclic aromatic hydrocarbons. In summary, the combination of slit jet discharge methods with high resolution infrared lasers enables spectroscopic investigation of even highly reactive combustion and interstellar radical intermediates under gas phase, jet-cooled (Trot ≈ 11 K) conditions.

  19. High resolution spectroscopy of jet cooled phenyl radical: The ν1 and ν2 a1 symmetry C-H stretching modes

    NASA Astrophysics Data System (ADS)

    Chang, Chih-Hsuan; Nesbitt, David J.

    2016-07-01

    A series of CH stretch modes in phenyl radical (C6H5) has been investigated via high resolution infrared spectroscopy at sub-Doppler resolution (˜60 MHz) in a supersonic discharge slit jet expansion. Two fundamental vibrations of a1 symmetry, ν1 and ν2, are observed and rotationally analyzed for the first time, corresponding to in-phase and out-of-phase symmetric CH stretch excitation at the ortho/meta/para and ortho/para C atoms with respect to the radical center. The ν1 and ν2 band origins are determined to be 3073.968 50(8) cm-1 and 3062.264 80(7) cm-1, respectively, which both agree within 5 cm-1 with theoretical anharmonic scaling predictions based on density functional B3LYP/6-311g++(3df,3dp) calculations. Integrated band strengths for each of the CH stretch bands are analyzed, with the relative intensities agreeing remarkably well with theoretical predictions. Frequency comparison with previous low resolution Ar-matrix spectroscopy [A. V. Friderichsen et al., J. Am. Chem. Soc. 123, 1977 (2001)] reveals a nearly uniform Δν ≈ + 10-12 cm-1 blue shift between gas phase and Ar matrix values for ν1 and ν2. This differs substantially from the much smaller red shift (Δν ≈ - 1 cm-1) reported for the ν19 mode, and suggests a simple physical model in terms of vibrational mode symmetry and crowding due to the matrix environment. Finally, the infrared phenyl spectra are well described by a simple asymmetric rigid rotor Hamiltonian and show no evidence for spectral congestion due to intramolecular vibrational coupling, which bodes well for high resolution studies of other ring radicals and polycyclic aromatic hydrocarbons. In summary, the combination of slit jet discharge methods with high resolution infrared lasers enables spectroscopic investigation of even highly reactive combustion and interstellar radical intermediates under gas phase, jet-cooled (Trot ≈ 11 K) conditions.

  20. N-H stretching modes around 3300 wavenumber from peptide backbones observed by chiral sum frequency generation vibrational spectroscopy.

    PubMed

    Fu, Li; Wang, Zhuguang; Yan, Elsa C Y

    2014-09-01

    We present a detailed analysis of the molecular origin of the chiral sum frequency generation (SFG) signals of proteins and peptides at interfaces in the N-H stretching vibrational region. The N-H stretching can be a probe for investigating structural and functional properties of proteins, but remains technically difficult to analyze due to the overlapping with the O-H stretching of water molecules. Chiral SFG spectroscopy offers unique tools to study the N-H stretching from proteins at interfaces without interference from the water background. However, the molecular origin of the N-H stretching signals of proteins is still unclear. This work provides a justification of the origin of chiral N-H signals by analyzing the vibrational frequencies, examining chiral SFG theory, studying proton (hydrogen/deuterium) exchange kinetics, and performing optical control experiments. The results demonstrate that the chiral N-H stretching signals at ~3300 cm(-1) originate from the amide group of the protein backbones. This chiral N-H stretching signal offers an in situ, real-time, and background-free probe for interrogating the protein structures and dynamics at interfaces at the molecular level.

  1. Forced translocation of DNA hairpins through a tight molecular nanopore studied by atomic force microscopy in force-spectroscopy mode

    NASA Astrophysics Data System (ADS)

    Ashcroft, Brian Alan

    The transit of Deoxyribonucleic acid (DNA) through a molecular nanopore has been studied by pulling a beta-cyclodextrin ring over single stranded DNA using an atomic force microscope. After an exhaustive search, it was determined that n-propyl silane surface provides the most reliable background surface for performing force spectroscopy of DNA. A versatile rotaxane complex was formed between a hydrophobic molecule and cyclodextrin. DNA was then added to this complex to form a DNA rotaxane. The cyclodextrin is covalently linked by a molecular tether to the force probe, which both pulls on the cyclodextrin and reads off the forces required for passage of the DNA. The bases do not provide an obstacle to the passage of the cyclodextrin, but hairpins represent large barriers to transit, and analysis of the pulling kinetics show the opening rates of the hairpins. The utility of the system was determined by investigating the kinetics of the analogous biological system with two unusual hairpins: Unusually stable hairpins (consisting of the bases CTTG in the loop) and sequences with CTG repeats motifs. CTTG hairpins prove to be completely impassable both to reverse transcriptase and the cyclodextrin, while CTG repeats pass with an ease appropriate to their bulk measurements, but still enough force to stall a polymerase enzyme proving that the kinetic analysis is alone responsible for the stalling.

  2. Determination of 3D molecular orientation by concurrent polarization analysis of multiple Raman modes in broadband CARS spectroscopy

    PubMed Central

    2016-01-01

    A theoretical description is presented about a new analysis method to determine three-dimensional (3D) molecular orientation by concurrently analyzing multiple Raman polarization profiles. Conventional approaches to polarization Raman spectroscopy are based on single peaks, and their 2D-projected polarization profiles are limited in providing 3D orientational information. Our new method analyzes multiple Raman profiles acquired by a single polarization scanning measurement of broadband coherent anti-Stokes Raman scattering (BCARS). Because the analysis uses only dimensionless quantities, such as intensity ratios and phase difference between multiple profiles, the results are not affected by sample concentration and the system response function. We describe how to determine the 3D molecular orientation with the dimensionless observables by using two simplified model cases. In addition, we discuss the effect of orientational broadening on the polarization profiles in the two model cases. We find that in the presence of broadening we can still determine the mean 3D orientation angles and, furthermore, the degree of orientational broadening. PMID:26561197

  3. Monitoring Scanning Electrochemical Microscopy Approach Curves with Mid-Infrared Spectroscopy – Towards a Novel Current-Independent Positioning Mode

    PubMed Central

    Wang, Liqun; Kranz, Christine; Mizaikoff, Boris

    2010-01-01

    Single-bounce attenuated total reflection infrared spectroscopy in the 3–20 µm range (MIR) has been combined with scanning electrochemical microscopy (SECM) for in situ spectroscopic detection of electrochemically induced localized surface modifications using an ultramicroelectrode (UME). In this study, a novel current-independent approach for positioning the UME in aqueous electrolyte solution is presented using either changes of IR absorption intensity associated with borosilicate glass (BSG), which is used as shielding material of the UME wire, or by monitoring IR changes of the water spectrum within the penetration depth of the evanescent field due to displacement of water molecules in the volume between the sample surface and the UME within the evanescent field. The experimental results show that the UME penetrates into the exponentially decaying evanescent field in close vicinity (a few µm) to the ATR crystal surface. Hence, the resulting intensity changes of the IR absorption spectra for borosilicate glass (increase) and for water (decrease), can be used to determine the position of the UME relative to the ATR crystal surface independent of the current measured at the UME. PMID:20329757

  4. Deposition and immersion mode nucleation of ice by three distinct samples of volcanic ash using Raman spectroscopy

    NASA Astrophysics Data System (ADS)

    Schill, G. P.; Genareau, K.; Tolbert, M. A.

    2015-01-01

    Ice nucleation on volcanic ash controls both ash aggregation and cloud glaciation, which affect atmospheric transport and global climate. Previously, it has been suggested that there is one characteristic ice nucleation efficiency for all volcanic ash, regardless of its composition, when accounting for surface area; however, this claim is derived from data from only two volcanic eruptions. In this work, we have studied the depositional and immersion freezing efficiency of three distinct samples of volcanic ash using Raman Microscopy coupled to an environmental cell. Ash from the Fuego (basaltic ash, Guatemala), Soufrière Hills (andesitic ash, Montserrat), and Taupo (Oruanui euption, rhyolitic ash, New Zealand) volcanoes were chosen to represent different geographical locations and silica content. All ash samples were quantitatively analyzed for both percent crystallinity and mineralogy using X-ray diffraction. In the present study, we find that all three samples of volcanic ash are excellent depositional ice nuclei, nucleating ice from 225-235 K at ice saturation ratios of 1.05 ± 0.01, comparable to the mineral dust proxy kaolinite. Since depositional ice nucleation will be more important at colder temperatures, fine volcanic ash may represent a global source of cold-cloud ice nuclei. For immersion freezing relevant to mixed-phase clouds, however, only the Oruanui ash exhibited heterogeneous ice nucleation activity. Similar to recent studies on mineral dust, we suggest that the mineralogy of volcanic ash may dictate its ice nucleation activity in the immersion mode.

  5. Vibrational Relaxation of the Backbone and Base Modes in LacDNA Complexes by UV Resonance Raman Spectroscopy.

    PubMed

    Muntean, Cristina M; Bratu, Ioan; Hernanz, Antonio

    2017-07-20

    Vibrational band shape analysis through time correlation function concept is widely used to obtain experimental information on the molecular dynamics of medium-size molecules in different environments. Interesting details are revealed by extending this technique to biomolecules such as functional groups of the nucleic acids in media approaching the physiological conditions. In this work a study into the UV resonance Raman (UVRR) vibrational half bandwidths of functional groups in LacDNA, upon lowering the pH (pH 6.4, pH 3.45) and in the presence of Mn(2+) and Ca(2+) ions, respectively, was of interest. The corresponding global relaxation times have been derived. Also, the 793 cm(-1) UVRR band, corresponding to ν (backbone O-P-O, dT) oscillator of LacDNA in aqueous solutions, was selected for band shape-analysis. Vibrational relaxation appears as the dominant relaxation process for this mode, with vibrational dephasing being the most efficient for this oscillator. Current theories developed for vibrational dephasing have been applied to this profile, and relevant relaxation parameters have been obtained and discussed. To our knowledge this is the first study on DNA oligomers vibrational band shape analysis through time correlation function concept.

  6. Strong Overtones Modes in Inelastic Electron Tunneling Spectroscopy with Cross-Conjugated Molecules: A Prediction from Theory

    PubMed Central

    2013-01-01

    Cross-conjugated molecules are known to exhibit destructive quantum interference, a property that has recently received considerable attention in single-molecule electronics. Destructive quantum interference can be understood as an antiresonance in the elastic transmission near the Fermi energy and leading to suppressed levels of elastic current. In most theoretical studies, only the elastic contributions to the current are taken into account. In this paper, we study the inelastic contributions to the current in cross-conjugated molecules and find that while the inelastic contribution to the current is larger than for molecules without interference, the overall behavior of the molecule is still dominated by the quantum interference feature. Second, an ongoing challenge for single molecule electronics is understanding and controlling the local geometry at the molecule-surface interface. With this in mind, we investigate a spectroscopic method capable of providing insight into these junctions for cross-conjugated molecules: inelastic electron tunneling spectroscopy (IETS). IETS has the advantage that the molecule interface is probed directly by the tunneling current. Previously, it has been thought that overtones are not observable in IETS. Here, overtones are predicted to be strong and, in some cases, the dominant spectroscopic features. We study the origin of the overtones and find that the interference features in these molecules are the key ingredient. The interference feature is a property of the transmission channels of the π system only, and consequently, in the vicinity of the interference feature, the transmission channels of the σ system and the π system become equally transmissive. This allows for scattering between the different transmission channels, which serves as a pathway to bypass the interference feature. A simple model calculation is able to reproduce the results obtained from atomistic calculations, and we use this to interpret these findings

  7. Jet-cooled infrared spectroscopy in slit supersonic discharges: symmetric and antisymmetric CH2 stretching modes of fluoromethyl (CH2F) radical.

    PubMed

    Whitney, Erin S; Dong, Feng; Nesbitt, David J

    2006-08-07

    The combination of shot noise-limited direct absorption spectroscopy with long-path-length slit supersonic discharges has been used to obtain first high-resolution infrared spectra for jet-cooled CH2F radicals in the symmetric (nu1) and antisymmetric (nu5) CH2 stretching modes. Spectral assignment has yielded refined lower- and upper-state rotational constants and fine-structure parameters from least-squares fits to the sub-Doppler line shapes for individual transitions. The rotational constants provide indications of large amplitude vibrational averaging over a low-barrier double minimum inversion-bending potential. This behavior is confirmed by high-level coupled cluster singles/doubles/triples calculations extrapolated to the complete basis set limit and adiabatically corrected for zero point energy. The calculations predict a nonplanar equilibrium structure (theta approximately 29 degrees, where theta is defined to be 180 degrees minus the angle between the C-F bond and the CH2 plane) with a 132 cm(-1) barrier to planarity and a vibrational bend frequency (nu(bend) approximately 276 cm(-1)), in good agreement with previous microwave estimates (nu(bend) = 300 (30) cm(-1)) by Hirota and co-workers [Y. Endo et al., J. Chem. Phys. 79, 1605 (1983)]. The nearly 2:1 ratio of absorption intensities for the symmetric versus antisymmetric bands is in good agreement with density functional theory calculations, but in sixfold contrast with simple local mode CH2 bond dipole predictions of 1:3. This discrepancy arises from a surprisingly strong dependence of the symmetric stretch intensity on the inversion bend angle and provides further experimental support for a nonplanar equilibrium structure.

  8. Jet-cooled infrared spectroscopy in slit supersonic discharges: Symmetric and antisymmetric CH2 stretching modes of fluoromethyl (CH2F ) radical

    NASA Astrophysics Data System (ADS)

    Whitney, Erin S.; Dong, Feng; Nesbitt, David J.

    2006-08-01

    The combination of shot noise-limited direct absorption spectroscopy with long-path-length slit supersonic discharges has been used to obtain first high-resolution infrared spectra for jet-cooled CH2F radicals in the symmetric (ν1) and antisymmetric (ν5) CH2 stretching modes. Spectral assignment has yielded refined lower- and upper-state rotational constants and fine-structure parameters from least-squares fits to the sub-Doppler line shapes for individual transitions. The rotational constants provide indications of large amplitude vibrational averaging over a low-barrier double minimum inversion-bending potential. This behavior is confirmed by high-level coupled cluster singles/doubles/triples calculations extrapolated to the complete basis set limit and adiabatically corrected for zero point energy. The calculations predict a nonplanar equilibrium structure (θ ≈29°, where θ is defined to be 180° minus the angle between the C-F bond and the CH2 plane) with a 132cm-1 barrier to planarity and a vibrational bend frequency (νbend≈276cm-1), in good agreement with previous microwave estimates (νbend=300(30)cm-1) by Hirota and co-workers [Y. Endo et al., J. Chem. Phys. 79, 1605 (1983)]. The nearly 2:1 ratio of absorption intensities for the symmetric versus antisymmetric bands is in good agreement with density functional theory calculations, but in sixfold contrast with simple local mode CH2 bond dipole predictions of 1:3. This discrepancy arises from a surprisingly strong dependence of the symmetric stretch intensity on the inversion bend angle and provides further experimental support for a nonplanar equilibrium structure.

  9. Empirical mode decomposition analysis of near-infrared spectroscopy muscular signals to assess the effect of physical activity in type 2 diabetic patients.

    PubMed

    Molinari, Filippo; Joy Martis, Roshan; Acharya, U Rajendra; Meiburger, Kristen M; De Luca, Riccardo; Petraroli, Giuliana; Liboni, William

    2015-04-01

    Type 2 diabetes is a metabolic disorder that may cause major problems to several physiological systems. Exercise has proven to be very effective in the prevention, management and improvement of this pathology in patients. Muscle metabolism is often studied with near-infrared spectroscopy (NIRS), a noninvasive technique that can measure changes in the concentration of oxygenated (O2Hb) and reduced hemoglobin (HHb) of tissues. These NIRS signals are highly non-stationary, non-Gaussian and nonlinear in nature. The empirical mode decomposition (EMD) is used as a nonlinear adaptive model to extract information present in the NIRS signals. NIRS signals acquired from the tibialis anterior muscle of controls and type 2 diabetic patients are processed by EMD to yield three intrinsic mode functions (IMF). The sample entropy (SE), fractal dimension (FD), and Hurst exponent (HE) are computed from these IMFs. Subjects are monitored at the beginning of the study and after one year of a physical training programme. Following the exercise programme, we observed an increase in the SE and FD and a decrease in the HE in all diabetic subjects. Our results show the influence of physical exercise program in improving muscle performance and muscle drive by the central nervous system in the patients. A multivariate analysis of variance performed at the end of the training programme also indicated that the NIRS metabolic patterns of controls and diabetic subjects are more similar than at the beginning of the study. Hence, the proposed EMD technique applied to NIRS signals may be very useful to gain a non-invasive understanding of the neuromuscular and vascular impairment in diabetic subjects.

  10. Revealing the molecular structure of single-molecule junctions in different conductance states by fishing-mode tip-enhanced Raman spectroscopy.

    PubMed

    Liu, Zheng; Ding, Song-Yuan; Chen, Zhao-Bin; Wang, Xiang; Tian, Jing-Hua; Anema, Jason R; Zhou, Xiao-Shun; Wu, De-Yin; Mao, Bing-Wei; Xu, Xin; Ren, Bin; Tian, Zhong-Qun

    2011-01-01

    The conductance of single-molecule junctions may be governed by the structure of the molecule in the gap or by the way it bonds with the leads, and the information contained in a Raman spectrum is ideal for examining both. Here we demonstrate that molecule-to-surface bonding may be characterized during electron transport by 'fishing-mode' tip-enhanced Raman spectroscopy (FM-TERS). This technique allows mutually verifiable single-molecule conductance and Raman signals with single-molecule contributions to be acquired simultaneously at room temperature. Density functional theory calculations reveal that the most significant spectral change seen for a gold-4,4'-bipyridine-gold junction results from the deformation of the pyridine ring in contact with the drain electrode at high voltage, and these calculations suggest that a stronger bonding interaction between the molecule and the drain may account for the nonlinear dependence of conductance on bias voltage. FM-TERS will lead to a better understanding of electron-transport processes in molecular junctions.

  11. Self-mixing detection of backscattered radiation in a single-mode erbium fibre laser for Doppler spectroscopy and velocity measurements

    SciTech Connect

    Dmitriev, A K; Konovalov, A N; Ul'yanov, V A

    2014-04-28

    We report an experimental study of the self-mixing effect in a single-mode multifrequency erbium fibre laser when radiation backscattered from an external moving object arrives at its cavity. To eliminate resulting chaotic pulsations in the laser, we have proposed a technique for suppressing backscattered radiation through the use of multimode fibre for radiation delivery. The multifrequency operation of the laser has been shown to lead to strong fluctuations of the amplitude of the Doppler signal and a nonmonotonic variation of the amplitude with distance to the scattering object. In spite of these features, the self-mixing signal was detected with a high signal-to-noise ratio (above 10{sup 2}) when the radiation was scattered by a rotating disc, and the Doppler frequency shift, evaluated as the centroid of its spectrum, had high stability (0.15%) and linearity relative to the rotation rate. We conclude that the self-mixing effect in this type of fibre laser can be used for measuring the velocity of scattering objects and in Doppler spectroscopy for monitoring the laser evaporation of materials and biological tissues. (control of laser radiation parameters)

  12. Direct observation of the anchoring process during the adsorption of fibrinogen on a solid surface by force-spectroscopy mode atomic force microscopy

    PubMed Central

    Hemmerlé, J.; Altmann, S. M.; Maaloum, M.; Hörber, J. K. H.; Heinrich, L.; Voegel, J.-C.; Schaaf, P.

    1999-01-01

    Atomic force microscopy in a force-spectroscopy mode has been used to investigate the kinetics of the adsorption process of fibrinogen molecules on a silica surface. An original “approach/retraction” cycle of the tip/surface was used for this purpose. Fibrinogen molecules were adsorbed on the atomic force microscopy tip and were brought into contact with the silica surface for different interaction times varying from 5 to 2,000 ms. Multiple consecutive ruptures were observed. The mean number of ruptures nr per cycle increases steadily with the interaction time as well as the mean strength fr which varies from 300 pN for 5 ms to 1,400 pN for 2,000 ms. The minimal interaction time for a fibrinogen molecule to bind strongly to a silica surface during an adsorption process appears to lie between 50 and 200 ms. The histograms of the distances between two consecutive ruptures in one cycle exhibit maxima around 20–25 nm. This length is comparable to the characteristic distance between D and E globules of one fibrinogen molecule and suggests that fibrinogen molecules mainly adsorb through their D and E globules. PMID:10359776

  13. Time-resolved thermal lens spectroscopy with a single-pulsed laser excitation beam: an analytical model for dual-beam mode-mismatched experiments.

    PubMed

    Sabaeian, Mohammad; Rezaei, Hamidreza; Ghalambor-Dezfouli, Abdolmohammad

    2017-02-01

    Pulsed laser beam excitations are more commonly used in thermal lens spectroscopy (TLS) than continuous-wave (CW) ones, because CW excitations limit the measurement to linear absorption processes [J. Opt. A5, 256 (2003)]. In this work, we present a new and full analytical model for a single-pulsed laser excitation dual-beam mode-mismatched TLS for low absorption solid-state and liquid samples. Our model has been based on a new solution of time-dependent heat equation for a finite-radius cylindrical sample exposed to a single-pulsed excitation laser beam. For low absorbent samples, unlike previous models, all aberration terms associated in the thermal lens were taken into account in Fresnel integration. Besides, the model provides a full analytical mathematical expression for the temperature rise, normalized signal intensity, and Z-scan photothermal lens signal. The model was confirmed with experimental data of distilled deionized water with excellent agreement. Therefore, the model allows us to extract thermo-optical properties of samples in an analytical and more accurate way.

  14. Phonon Mode Transformation across the Orthohombic-Tetragonal Phase Transition in a Lead-Iodide Perovskite CH3NH3PbI3: a Terahertz Time-Domain Spectroscopy Approach

    NASA Astrophysics Data System (ADS)

    Chia, Elbert E. M.; La-O-Vorakiat, Chan; Kadro, Jeannette; Salim, Teddy; Zhao, Daming; Ahmed, Towfiq; Lam, Yeng Ming; Zhu, Jian-Xin; Marcus, Rudolph; Michel-Beyerle, Maria-Elisabeth

    Using terahertz time-domain spectroscopy (THz-TDS), we study the temperature-dependent phonon modes of the organometallic lead iodide perovskite CH3NH3PbI3 thin film across the terahertz (0.5-3 THz) and temperature (20-300 K) ranges. These modes are related to the vibration of the Pb-I bonds. We found that two phonon modes in the tetragonal phase at room temperature split into four modes in the low-temperature orthorhombic phase. By use of the Lorentz model fitting, we analyze the critical behavior of this phase transition. King Mongkut's University of Technology Thonburi (Grant No. SCI58-003), Singapore MOE Tier 1 (RG13/12, RG123/14), ONR, ARO, NTU Biophysics Center, LANL LDRD, LANL CINT.

  15. Probing plasmonic breathing modes optically

    SciTech Connect

    Krug, Markus K. Reisecker, Michael; Hohenau, Andreas; Ditlbacher, Harald; Trügler, Andreas; Hohenester, Ulrich; Krenn, Joachim R.

    2014-10-27

    The confinement of surface plasmon modes in flat nanoparticles gives rise to plasmonic breathing modes. With a vanishing net dipole moment, breathing modes do not radiate, i.e., they are optically dark. Having thus escaped optical detection, breathing modes were only recently revealed in silver nanodisks with electron energy loss spectroscopy in an electron microscope. We show that for disk diameters >200 nm, retardation induced by oblique optical illumination relaxes the optically dark character. This makes breathing modes and thus the full plasmonic mode spectrum accessible to optical spectroscopy. The experimental spectroscopy data are in excellent agreement with numerical simulations.

  16. Comparative study of Fourier transform infrared spectroscopy in transmission, attenuated total reflection, and total reflection modes for the analysis of plastics in the cultural heritage field.

    PubMed

    Picollo, Marcello; Bartolozzi, Giovanni; Cucci, Costanza; Galeotti, Monica; Marchiafava, Veronica; Pizzo, Benedetto

    2014-01-01

    This study was completed within the framework of two research projects dealing with the conservation of contemporary artworks. The first is the Seventh Framework Project (FP7) of the European Union, Preservation of Plastic ARTefacts in Museum Collections (POPART), spanning years 2008-2012, and the second is the Italian project funded by the Tuscan Region, Preventive Conservation of Contemporary Art (Conservazione Preventiva dell'Arte Contemporanea (COPAC)), spanning 2011-2013. Both of these programs pointed out the great importance of having noninvasive and portable analytical techniques that can be used to investigate and characterize modern and contemporary artworks, especially those consisting of synthetic polymers. Indeed, despite the extensive presence of plastics in museum collections, there is still a lack of analytical tools for identifying, characterizing, and setting up adequate conservation strategies for these materials. In this work, the potentials of in situ and noninvasive Fourier transform infrared (FT-IR) spectroscopy, implemented by means of portable devices that operate in reflection mode, are investigated with a view to applying the results in large-scale surveys of plastic objects in museums. To this end, an essential prerequisite are the reliability of spectral data acquired in situ and the availability of spectral databases acquired from reference materials. A collection of polymeric samples, which are available commercially as ResinKit, was analyzed to create a reference spectral archive. All the spectra were recorded using three FT-IR configurations: transmission (trans), attenuated total reflection (ATR), and total reflection (TR). A comparative evaluation of the data acquired using the three instrumental configurations is presented, together with an evaluation of the similarity percentages and a discussion of the critical cases.

  17. Identification of the Excited-State C═C and C═O Modes of trans-β-Apo-8'-carotenal with Transient 2D-IR-EXSY and Femtosecond Stimulated Raman Spectroscopy.

    PubMed

    Di Donato, Mariangela; Ragnoni, Elena; Lapini, Andrea; Kardaś, Tomasz M; Ratajska-Gadomska, Boźena; Foggi, Paolo; Righini, Roberto

    2015-05-07

    Assigning the vibrational modes of molecules in the electronic excited state is often a difficult task. Here we show that combining two nonlinear spectroscopic techniques, transient 2D exchange infrared spectroscopy (T2D-IR-EXSY) and femtosecond stimulated Raman spectroscopy (FSRS), the contribution of the C═C and C═O modes in the excited-state vibrational spectra of trans-β-apo-8'-carotenal can be unambiguously identified. The experimental results reported in this work confirm a previously proposed assignment based on quantum-chemical calculations and further strengthen the role of an excited state with charge-transfer character in the relaxation pathway of carbonyl carotenoids. On a more general ground, our results highlight the potentiality of nonlinear spectroscopic methods based on the combined use of visible and infrared pulses to correlate structural and electronic changes in photoexcited molecules.

  18. Experimental demonstration of mode-selective phonon excitation of 6H-SiC by a mid-infrared laser with anti-Stokes Raman scattering spectroscopy

    SciTech Connect

    Yoshida, Kyohei; Hachiya, Kan; Okumura, Kensuke; Mishima, Kenta; Inukai, Motoharu; Torgasin, Konstantin; Omer, Mohamed; Sonobe, Taro; Zen, Heishun; Negm, Hani; Kii, Toshiteru; Masuda, Kai; Ohgaki, Hideaki

    2013-10-28

    Mode-selective phonon excitation by a mid-infrared laser (MIR-FEL) is demonstrated via anti-Stokes Raman scattering measurements of 6H-silicon carbide (SiC). Irradiation of SiC with MIR-FEL and a Nd-YAG laser at 14 K produced a peak where the Raman shift corresponds to a photon energy of 119 meV (10.4 μm). This phenomenon is induced by mode-selective phonon excitation through the irradiation of MIR-FEL, whose photon energy corresponds to the photon-absorption of a particular phonon mode.

  19. The study of phonon modes of Cu 1- xTl xBa 2Ca 3Cu 4O 12- y superconductor thin films by FTIR absorption spectroscopy

    NASA Astrophysics Data System (ADS)

    Khan, Nawazish A.; Mumtaz, M.; Sabeeh, K.; Khan, M. I. A.; Ahmed, Mushtaq

    2004-08-01

    The superconducting properties of Cu 1- xTl xBa 2Ca 3Cu 4O 12- y thin films prepared by amorphous phase epitaxial (APE) method have been studied, by resistivity measurements, critical current density measurements, infrared spectroscopy and X-ray diffraction. The resistivity measurements of all the samples have shown metallic variation down to onset of superconductivity and Tc in the range of 95-112 K. The critical current densities of samples were also measured and it was observed that the samples with higher thallium contents in the unit cell have low critical current density, Jc (∼10 3 A/cm 2) while lower thallium contents in the material give, higher critical current density Jc (∼10 6 A/cm 2). The XRD measurements showed the material to be single phase and oriented along c-axis. The φ-scan of (1 0 3) reflection of Cu 1- xTl x-1234 material showed the crystal to be a-axis oriented. The main emphasis of this research work is on the study of phonon modes of vibration of different atoms in the unit cell of Cu 1- xTl xBa 2Ca 3Cu 4O 12- y superconductor. The effects of post-annealing, of the samples in air atmosphere, on the phonon modes absorption is also studied. Three major phonon modes around 450-475, 900 and 1200 cm -1 in Cu 1- xTl x-1234 have been observed. These modes are assigned to the vibrations of apical oxygen, O 3 and C-O respectively. The apical oxygen mode at 464 cm -1 is hardened to 474 cm -1 when the preparation temperature is increased from 905 to 920 °C while these modes substantially reduce in intensity after the post-annealing in air at 650 °C. The 945 cm -1 O 3 mode is softened to 880 °C when the synthesis temperature is above 910 °C. The softening of O 3 mode increases the critical temperature of the material, which also showed that the presence of O 3 atoms provide maximum stability to T1 atoms of the unit cell. The post-annealing of the materials in air atmosphere at 650 °C substantially reduces the intensity of 465-475 and 850 cm -1

  20. Angle-resolved photoemission spectroscopy of the Fe-Based Ba0.6K0.4Fe2As2 high temperature superconductor: evidence for an orbital selective electron-mode coupling.

    PubMed

    Richard, P; Sato, T; Nakayama, K; Souma, S; Takahashi, T; Xu, Y-M; Chen, G F; Luo, J L; Wang, N L; Ding, H

    2009-01-30

    We have performed an angle-resolved photoemission spectroscopy study of the new superconductor Ba0.6K0.4Fe2As2 in the low energy range. We report the observation of an anomaly around 25 meV in the dispersion of superconducting Ba0.6K0.4Fe2As2 samples that nearly vanishes above T_{c}. The energy scale of the related mode (13+/-2 meV) and its strong dependence on orbital and temperature indicates that it is unlikely related to phonons. Moreover, the momentum locations of the kink can be connected by the antiferromagnetic wave vector. Our results point towards an unconventional electronic origin of the mode and the superconducting pairing in the Fe-based superconductors, and strongly support the antiphase s-wave pairing symmetry.

  1. Inverse energy cascade in developed turbulence at the breaking of the symmetry of helical modes

    NASA Astrophysics Data System (ADS)

    Gledzer, E. B.; Chkhetiani, O. G.

    2015-10-01

    The interactions breaking the symmetry of the positive and negative components of the total helicity have been considered with quasinormal approximations and the cascade model of helical turbulence. In the ideal case of the absence of one of them, the equations have two sign-definite integrals of motion; as a result, an inverse energy cascade occurs, as for two-dimensional turbulence. Owing to the instability of the second moments, whose mechanism was proposed in A. Belian, O. Chkhetiani, E. Golbraikh, and S. Moiseev, Physica A 258, 55 (1998), the generation of large-scale modes has been considered within the Fourier equations of hydrodynamics under the assumption of a quasinormal velocity field. The presence of background turbulence with large-scale helical perturbations and small-scale sources of the energy and helicity is a determining circumstance in this mechanism. The possibility of the inverse cascade in the case of incomplete degeneracy of one of the helicity components has been studied in the numerical experiments with the cascade model. It has been shown that the existence of the inverse (toward large scales) energy flux from small-scale perturbations requires a certain external-action-generated level of helical noise in large modes, which depends on the degree of "mixing" of different-sign helical components of the velocity field.

  2. Investigations of black-hole spectra: Purely-imaginary modes and Kerr ringdown radiation

    NASA Astrophysics Data System (ADS)

    Zalutskiy, Maxim P.

    When black holes are perturbed they give rise to characteristic waves that propagate outwards carrying information about the black hole. In the linear regime these waves are described in terms of quasinormal modes (QNM). Studying QNM is an important topic which may provide a connection to the quantum theory of gravity in addition to their astrophysical applications. Quasinormal modes correspond to complex frequencies where the real part represents oscillation and the imaginary part represents damping. We have developed a new code for calculating QNM with high precision and accuracy, which we applied to the Schwarzschild and Kerr geometries. The high accuracy of our calculations was a significant improvement over prior work, allowing us to compute QNM much closer to the negative imaginary axis (NIA) than it was possible before. The existence of QNM on the NIA has remained poorly understood, but our high accuracy studies have highlighted the importance of understanding their nature. In this work we show how the purely-imaginary modes can be calculated with the help of the theory of confluent Heun polynomials with the conclusion that all modes on the NIA correspond to polynomial solutions. We also show that certain types of these modes correspond to Kerr QNM. Finally, using our highly accurate QNM data we model the ringdown, a remnant black hole's decaying radiation. Ringdown occurs in the final stages of such violent astrophysical events as supernovae and black hole collisions. We use our model to analyse the ringdown waveforms from the publicly available binary black hole coalescence catalog maintained by the SXS collaboration. In our analysis we use a number of methods: Fourier transform, multi-mode nonlinear fitting and waveform overlap. Both our fitting and overlap approach allow inclusion of many modes in the ringdown model with the goal being to extract information about the nature of the astrophysical source of the ringdown signal.

  3. Infrared and Raman Spectroscopy from Ab Initio Molecular Dynamics and Static Normal Mode Analysis: The C-H Region of DMSO as a Case Study

    SciTech Connect

    Fischer, Sean A.; Ueltschi, Tyler W.; El-Khoury, Patrick Z.; Mifflin, Amanda L.; Hess, Wayne P.; Wang, Hongfei; Cramer, Christopher J.; Govind, Niranjan

    2016-03-03

    Carbon-hydrogen (C-H) vibration modes serve as key probes in the chemical iden- tication of hydrocarbons and in vibrational sum-frequency generation (SFG) spec- *troscopy of hydrocarbons at the liquid/gas interface. Their assignments pose a chal- lenge from a theoretical viewpoint. In this work, we present a detailed study of the C-H stretching region of dimethyl sulfoxide (DMSO) using a new Gaussian basis set- based ab initio molecular dynamics (AIMD) module that we have implemented in the NWChem computational chemistry program. By combining AIMD simulations and static normal mode analysis, we interpret experimental infrared and Raman spectra and explore the role of anharmonic effects in this system. Our anharmonic normal mode analysis of the in-phase and out-of-phase symmetric C-H stretching modes chal- lenges the previous experimental assignment of the shoulder in the symmetric C-H stretching peak as an overtone or Fermi resonance. In addition, our AIMD simulations also show signicant broadening of the in-phase symmetric C-H stretching resonance, which suggests that the experimentally observed shoulder is due to thermal broadening of the symmetric stretching resonance.

  4. High-resolution Fourier-transform infrared spectroscopy of the ν6 and Coriolis perturbation allowed ν10 modes of ketenimine.

    PubMed

    Bane, Michael K; Robertson, Evan G; Thompson, Christopher D; Appadoo, Dominique R T; McNaughton, Don

    2011-12-14

    High-resolution FTIR spectra of the short lived species ketenimine have been recorded in the region 700-1300 cm(-1) and over 1500 transitions of the ν(10) and ν(6) modes have been assigned. Effective rotational and centrifugal distortion parameters for the v(10) = 1 and v(6) = 1 (excluding K(a) = 5) states were determined by co-fitting transitions, and treating strong a- and c-axis Coriolis interactions between them. Other perturbations attributed to interactions with the v(8) = 2 and v(12) = 1 + v(8) = 1 dark-states were also observed and treated. The ν(10) transitions are predicted to be inherently very weak, but are enhanced by an intensity stealing effect with the highly IR active ν(6) mode. A mechanism for this intensity stealing in ketenimine is also detailed.

  5. Jet-Cooled Infrared Laser Spectroscopy of Dimethyl Sulfide: High Resolution Analysis of the νb{14} CH_3-BENDING Mode

    NASA Astrophysics Data System (ADS)

    Jabri, Atef; Kleiner, Isabelle; Asselin, Pierre

    2017-06-01

    The rovibrational spectrum of the νb{14} CH_3-bending mode of dimethyl sulfide (CH_3)_2S was recorded in the 963-987 \\wn spectral region using our sensitive tunable quantum cascade laser spectrometer coupled to a pulsed slit jet. The combined use of a high dilution (CH_3)_2S/Ar gas mixture expanded at high backing pressure through a slit nozzle enabled to obtain an efficient rovibrational cooling which narrows the rotational distribution and eliminates hot bands arising from three low frequency modes below 300 \\wn. The characteristic PQR band contour of a b_{1} symmetry mode centered at 975.29 \\wn was observed and will be compared with theoretical calculations at the CCSD(T)/VTZ level^{c} (νb{14} mode at 986 \\wn) and room temperature experiments at low resolution (974 \\wn). Starting from the accurate set of ground state parameters derived from microwave, millimeter and far-infrared measurements, the rovibrational analysis will be presented and discussed. P. Asselin, Y. Berger, T. R. Huet, R. Motiyenko, L. Margulès, R. J. Hendricks, M. R. Tarbutt, S. Tokunaga, B. Darquié, Phys. Chem. Chem. Phys. 19, 4576 (2017) P. Asselin, A. Potapov, A. Turner, V. Boudon, L. Bruel, M. A. Gaveau and M. Mons, submitted to J. Phys. Chem. Lett. (2017) M. L. Senent, C. Puzzarini, R. Domínguez-Gómez, M. Carvajal, and M. Hochlaf, J. Chem. Phys., 140, 124302 (2014) J. W. Ypenburg & H. Gerding, Recueil des Travaux Chimiques des Pays-Bas, 90, 885 (1971)

  6. Transforming Fabry-Pérot resonances into a Tamm mode

    NASA Astrophysics Data System (ADS)

    Durach, Maxim; Rusina, Anastasia

    2012-12-01

    We propose an optical structure composed of two metal nanolayers enclosing a distributed Bragg reflector (DBR) mirror. The structure is an open photonic system whose bound modes are coupled to external radiation. We apply the special theoretical treatment based on inversion symmetry of the structure to classify its resonances. We show that the structure supports resonances transitional between Fabry-Pérot modes and Tamm plasmons. When the dielectric contrast of the DBR is removed these modes are a pair of conventional Fabry-Pérot resonances. They spectrally merge into a Tamm mode at high contrast. The optical properties of the structure in the frequency range of the DBR stop band, including highly beneficial 50% transmittivity through thick structures with sub-skin-depth metal films, are determined by the hybrid quasinormal modes of the open nonconservative structure under consideration. The results can find a broad range of applications in photonics and optoelectronics, including the possibility of coherent control over optical fields in the class of structures similar to the one proposed here.

  7. Linking structure and vibrational mode coupling using high-resolution infrared spectroscopy: A comparison of gauche and trans 1-chloro-2-fluoroethane

    NASA Astrophysics Data System (ADS)

    Miller, C. Cameron; Stone, Stephen C.; Philips, Laura A.

    1995-01-01

    The high-resolution infrared spectrum of 1-chloro-2-fluoroethane in a molecular beam was collected over the 2975-2994 cm-1 spectral region. The spectral region of 2975-2981 cm-1 contains a symmetric C-H stretching vibrational band of the gauche conformer containing the 35Cl isotope. The spectral region of 2985-2994 cm-1 contains three vibrational bands of the trans conformer. Two of the three bands are assigned as an antisymmetric C-H stretch of each of the two different chlorine isotopes. The third band is assigned as a symmetric C-H stretch of the 35Cl isotope. The gauche conformer of 1-chloro-2-fluoroethane showed doublet patterns similar to those previously observed in 1,2-difluoroethane. The model for 1,2-difluoroethane is further refined in the present work. These refinements suggest that the coupling dark state in 1,2-difluoroethane is composed of 1 quantum C-H bend, 1 quantum C-C stretch, and 12 quanta of torsion. For 1-chloro-2-fluoroethane the dark state could not be identified due to a small data set. The trans conformer of 1-chloro-2-fluoroethane showed no evidence of mode coupling in the three vibrational bands. Including 2-fluoroethanol in this series of molecules, the extent of vibrational mode coupling did not correlate with the density of states available for coupling. Therefore, density of states alone is insufficient to explain the observed trend. A correlation was observed between the degree of intramolecular interaction and vibrational mode coupling.

  8. Molecular Structures, Vibrational Spectroscopy, and Normal-Mode Analysis of M(2)(C&tbd1;CR)(4)(PMe(3))(4) Dimetallatetraynes. Observation of Strongly Mixed Metal-Metal and Metal-Ligand Vibrational Modes.

    PubMed

    John, Kevin D.; Miskowski, Vincent M.; Vance, Michael A.; Dallinger, Richard F.; Wang, Louis C.; Geib, Steven J.; Hopkins, Michael D.

    1998-12-28

    The nature of the skeletal vibrational modes of complexes of the type M(2)(C&tbd1;CR)(4)(PMe(3))(4) (M = Mo, W; R = H, Me, Bu(t)(), SiMe(3)) has been deduced. Metrical data from X-ray crystallographic studies of Mo(2)(C&tbd1;CR)(4)(PMe(3))(4) (R = Me, Bu(t)(), SiMe(3)) and W(2)(C&tbd1;CMe)(4)(PMe(3))(4) reveal that the core bond distances and angles are within normal ranges and do not differ in a statistically significant way as a function of the alkynyl substituent, indicating that their associated force constants should be similarly invariant among these compounds. The crystal structures of Mo(2)(C&tbd1;CSiMe(3))(4)(PMe(3))(4) and Mo(2)(C&tbd1;CBu(t)())(4)(PMe(3))(4) are complicated by 3-fold disorder of the Mo(2) unit within apparently ordered ligand arrays. Resonance-Raman spectra ((1)(delta-->delta) excitation, THF solution) of Mo(2)(C&tbd1;CSiMe(3))(4)(PMe(3))(4) and its isotopomers (PMe(3)-d(9), C&tbd1;CSiMe(3)-d(9), (13)C&tbd1;(13)CSiMe(3)) exhibit resonance-enhanced bands due to a(1)-symmetry fundamentals (nu(a) = 362, nu(b) = 397, nu(c) = 254 cm(-)(1) for the natural-abundance complex) and their overtones and combinations. The frequencies and relative intensities of the fundamentals are highly sensitive to isotopic substitution of the C&tbd1;CSiMe(3) ligands, but are insensitive to deuteration of the PMe(3) ligands. Nonresonance-Raman spectra (FT-Raman, 1064 nm excitation, crystalline samples) for the Mo(2)(C&tbd1;CSiMe(3))(4)(PMe(3))(4) compounds and for Mo(2)(C&tbd1;CR)(4)(PMe(3))(4) (R = H, D, Me, Bu(t)(), SiMe(3)) and W(2)(C&tbd1;CMe)(4)(PMe(3))(4) exhibit nu(a), nu(b), and nu(c) and numerous bands due to alkynyl- and phosphine-localized modes, the latter of which are assigned by comparisons to FT-Raman spectra of Mo(2)X(4)L(4) (X = Cl, Br, I; L = PMe(3), PMe(3)-d(9))(4) and Mo(2)Cl(4)(AsMe(3))(4). Valence force-field normal-coordinate calculations on the model compound Mo(2)(C&tbd1;CH)(4)P(4), using core force constants transferred from a calculation

  9. First high-efficiency and high-resolution (R=80,000) NIR spectroscopy with high-blazed Echelle grating: WINERED HIRES modes

    NASA Astrophysics Data System (ADS)

    Otsubo, Shogo; Ikeda, Yuji; Kobayashi, Naoto; Sukegawa, Takashi; Kondo, Sohei; Hamano, Satoshi; Sameshima, Hiroaki; Fukue, Kei; Yoshikawa, Tomohiro; Nakanishi, Kenshi; Watase, Ayaka; Takenaka, Keiichi; Asano, Akira; Yasui, Chikako; Matsunaga, Noriyuki; Kawakita, Hideyo

    2016-08-01

    WINERED is a PI-type 0.9 - 1.35 μm high-resolution spectrograph developed by the Laboratory of Infrared highresolution Spectrograph (LiH) of the Koyama Astronomical Observatory at Kyoto Sangyo University, Japan. The scope of WINERED is to realize a high-resolution near-infrared (NIR) spectrograph with both wide coverage and high sensitivity. WINERED provides three observational modes called as the Wide, Hires-Y and Hires-J modes. The Wide mode simultaneously covers the z, Y and J-bands in a single exposure with R ≡ λ/Δλ = 28,000 and was commissioned for the 1.3 m Araki Telescope of Koyama Astronomical Observatory in 2013. We have been building alternative observational modes "Hires-Y" and "Hires-J", providing R = 80,000 spectra in the Y- and J-bands, respectively. There are two choices for realizing a compact spectrograph with a high spectral resolution of R ≧ 50,000: an immersion grating (IG) or a highblazed echelle grating (HBG). Investigating the availabilities of both optical devices, we selected an HBG solution for λ < 1.5 μm because can be realized with currently available technology in earlier time. The optical parameters of WINERED's HBGs are as follows: groove pitch = 90.38 μm, blaze angle = 79.32 °, and apex angle = 88°, which are determined to minimize vignetting in the optical system as well as aberrations with the spectral resolution of R = 80,000. Custom HBGs were made by CANON Inc. Because of the size the size limitation in fabrication process, we decided to use a mosaicked grating consisting of two HBGs. The alignment tolerances of the two HBGs are very tight (< 0.5 arcsec for the parallelism between grooves of the two gratings and 1.5 arcsec for the flatness between the two grating surfaces). To enable these fine alignments, we designed a grating holder with an adjustment mechanism with sub-μm positional resolution. We adapted cordierite CO-220 as the material for the grating holder, thereby reducing the misalignment generated by

  10. Energy-dispersive X-ray emission spectroscopy using an X-ray free-electron laser in a shot-by-shot mode

    DOE PAGES

    Alonso-Mori, Roberto; Kern, Jan; Gildea, Richard J.; ...

    2012-11-05

    The ultrabright femtosecond X-ray pulses provided by X-ray free-electron lasers open capabilities for studying the structure and dynamics of a wide variety of systems beyond what is possible with synchrotron sources. Recently, this “probe-before-destroy” approach has been demonstrated for atomic structure determination by serial X-ray diffraction of microcrystals. There has been the question whether a similar approach can be extended to probe the local electronic structure by X-ray spectroscopy. To address this, we have carried out femtosecond X-ray emission spectroscopy (XES) at the Linac Coherent Light Source using redox-active Mn complexes. XES probes the charge and spin states as wellmore » as the ligand environment, critical for understanding the functional role of redox-active metal sites. Kβ1,3 XES spectra of MnII and Mn2III,IV complexes at room temperature were collected using a wavelength dispersive spectrometer and femtosecond X-ray pulses with an individual dose of up to >100 MGy. The spectra were found in agreement with undamaged spectra collected at low dose using synchrotron radiation. Our results demonstrate that the intact electronic structure of redox active transition metal compounds in different oxidation states can be characterized with this shot-by-shot method. This opens the door for studying the chemical dynamics of metal catalytic sites by following reactions under functional conditions. Furthermore, the technique can be combined with X-ray diffraction to simultaneously obtain the geometric structure of the overall protein and the local chemistry of active metal sites and is expected to prove valuable for understanding the mechanism of important metalloproteins, such as photosystem II.« less

  11. Energy-dispersive X-ray emission spectroscopy using an X-ray free-electron laser in a shot-by-shot mode.

    PubMed

    Alonso-Mori, Roberto; Kern, Jan; Gildea, Richard J; Sokaras, Dimosthenis; Weng, Tsu-Chien; Lassalle-Kaiser, Benedikt; Tran, Rosalie; Hattne, Johan; Laksmono, Hartawan; Hellmich, Julia; Glöckner, Carina; Echols, Nathaniel; Sierra, Raymond G; Schafer, Donald W; Sellberg, Jonas; Kenney, Christopher; Herbst, Ryan; Pines, Jack; Hart, Philip; Herrmann, Sven; Grosse-Kunstleve, Ralf W; Latimer, Matthew J; Fry, Alan R; Messerschmidt, Marc M; Miahnahri, Alan; Seibert, M Marvin; Zwart, Petrus H; White, William E; Adams, Paul D; Bogan, Michael J; Boutet, Sébastien; Williams, Garth J; Zouni, Athina; Messinger, Johannes; Glatzel, Pieter; Sauter, Nicholas K; Yachandra, Vittal K; Yano, Junko; Bergmann, Uwe

    2012-11-20

    The ultrabright femtosecond X-ray pulses provided by X-ray free-electron lasers open capabilities for studying the structure and dynamics of a wide variety of systems beyond what is possible with synchrotron sources. Recently, this "probe-before-destroy" approach has been demonstrated for atomic structure determination by serial X-ray diffraction of microcrystals. There has been the question whether a similar approach can be extended to probe the local electronic structure by X-ray spectroscopy. To address this, we have carried out femtosecond X-ray emission spectroscopy (XES) at the Linac Coherent Light Source using redox-active Mn complexes. XES probes the charge and spin states as well as the ligand environment, critical for understanding the functional role of redox-active metal sites. Kβ(1,3) XES spectra of Mn(II) and Mn(2)(III,IV) complexes at room temperature were collected using a wavelength dispersive spectrometer and femtosecond X-ray pulses with an individual dose of up to >100 MGy. The spectra were found in agreement with undamaged spectra collected at low dose using synchrotron radiation. Our results demonstrate that the intact electronic structure of redox active transition metal compounds in different oxidation states can be characterized with this shot-by-shot method. This opens the door for studying the chemical dynamics of metal catalytic sites by following reactions under functional conditions. The technique can be combined with X-ray diffraction to simultaneously obtain the geometric structure of the overall protein and the local chemistry of active metal sites and is expected to prove valuable for understanding the mechanism of important metalloproteins, such as photosystem II.

  12. Energy-dispersive X-ray emission spectroscopy using an X-ray free-electron laser in a shot-by-shot mode

    SciTech Connect

    Alonso-Mori, Roberto; Kern, Jan; Gildea, Richard J.; Sokaras, Dimosthenis; Weng, Tsu -Chien; Lassalle-Kaiser, Benedikt; Tran, Rosalie; Hattne, Johan; Laksmono, Hartawan; Hellmich, Julia; Glockner, Carina; Echols, Nathaniel; Sierra, Raymond G.; Schafer, Donald W.; Sellberg, Jonas; Kenney, Christopher; Herbst, Ryan; Pines, Jack; Hart, Philip; Herrmann, Sven; Grosse-Kunstleve, Ralf W.; Latimer, Matthew J.; Fry, Alan R.; Messerschmidt, Marc M.; Miahnahri, Alan; Seibert, M. Marvin; Zwart, Petrus H.; White, William E.; Adams, Paul D.; Bogan, Michael J.; Boutet, Sebastien; Williams, Garth J.; Zouni, Athina; Messinger, Johannes; Glatzel, Pieter; Sauter, Nicholas K.; Yachandra, Vittal K.; Yano, Junko; Bergmann, Uwe

    2012-11-05

    The ultrabright femtosecond X-ray pulses provided by X-ray free-electron lasers open capabilities for studying the structure and dynamics of a wide variety of systems beyond what is possible with synchrotron sources. Recently, this “probe-before-destroy” approach has been demonstrated for atomic structure determination by serial X-ray diffraction of microcrystals. There has been the question whether a similar approach can be extended to probe the local electronic structure by X-ray spectroscopy. To address this, we have carried out femtosecond X-ray emission spectroscopy (XES) at the Linac Coherent Light Source using redox-active Mn complexes. XES probes the charge and spin states as well as the ligand environment, critical for understanding the functional role of redox-active metal sites. Kβ1,3 XES spectra of MnII and Mn2III,IV complexes at room temperature were collected using a wavelength dispersive spectrometer and femtosecond X-ray pulses with an individual dose of up to >100 MGy. The spectra were found in agreement with undamaged spectra collected at low dose using synchrotron radiation. Our results demonstrate that the intact electronic structure of redox active transition metal compounds in different oxidation states can be characterized with this shot-by-shot method. This opens the door for studying the chemical dynamics of metal catalytic sites by following reactions under functional conditions. Furthermore, the technique can be combined with X-ray diffraction to simultaneously obtain the geometric structure of the overall protein and the local chemistry of active metal sites and is expected to prove valuable for understanding the mechanism of important metalloproteins, such as photosystem II.

  13. Time-resolved pump-probe photoelectron spectroscopy of helium using a mode-locked laser synchronized with synchrotron radiation pulses

    NASA Astrophysics Data System (ADS)

    Lacoursière, Jean; Meyer, Michael; Nahon, Laurent; Morin, Paul; Larzillière, Michel

    1994-12-01

    We report a new experimental setup consisting in the synchronization of 74.9094 MHz pulses from a mode-locked Ar + laser with 8.32 MHz pulses of vacuum ultraviolet (VUV) synchrotron radiation from the Super-ACO storage ring of the Laboratoire pour l'Utilisation du Rayonnement Electromagnétique (LURE). The capabilities of the setup are demonstrated in a time-resolved pump-probe (VUV + visible) experiment in which free helium atoms are resonantly ionized via the short-lived 1s3p ( 1P) state. This experiment allowed us to obtain the value of 1.12 ns for the temporal resolution (FWHM) of the experimental setup and to show the relevance of this technique for the investigation of nanosecond dynamics on gas phase species.

  14. Investigations on the Q and CT Bands of Cytochrome c Submonolayer Adsorbed on an Alumina Surface Using Broadband Spectroscopy with Single-Mode Integrated Optical Waveguides.

    PubMed

    Wiederkehr, Rodrigo S; Hoops, Geoffrey C; Aslan, Mustafa M; Byard, Courtney L; Mendes, Sergio B

    2009-05-14

    In this work, we report experimental results on the molar absorptivity of cytochrome c adsorbed at different submonolayer levels onto an aluminum oxide waveguide surface; our data show a clear dependence of the protein optical properties on its surface density. The measurements were performed using the broadband, single-mode, integrated optical waveguide spectroscopic technique, which is an extremely sensitive tool able to reach submonolayer levels of detection required for this type of studies. This investigation focuses on the molar absorptivity at the Q-band (centered at 525 nm) and, for the first time to our knowledge, the weak charge transfer (CT) band (centered at 695 nm) of surface-adsorbed cyt c. Polarized light in the spectral region from 450 to 775 nm was all-coupled into an alumina thin film, which functioned as a single-mode planar optical waveguide. The alumina thin-film waveguide used for this work had a thickness of 180 nm and was deposited on a glass substrate by the atomic layer deposition process. The protein submonolayer was formed on the alumina waveguide surface through electrostatic adsorption from an aqueous buffer solution at neutral pH. The optical properties of the surface-adsorbed cyt c were investigated for bulk protein concentrations ranging from 5 nM to 8200 nM in the aqueous buffer solution. For a protein surface density of 2.3 pmol/cm(2), the molar absorptivity measured at the charge transfer band was 335 M(-1) cm(-1), and for a surface density of 15 pmol/cm(2) was 720 M(-1) cm(-1), which is much closer to the value of cyt c dissolved in an aqueous neutral buffer (830 M(-1) cm(-1)). The modification of the protein molar absorptivity and its dependence on the surface density can most likely be attributed to conformational changes of the surface-adsorbed species.

  15. Basaltic glass formed from hydrovolcanism and impact processes: Characterization and clues for detection of mode of origin from VNIR through MWIR reflectance and emission spectroscopy

    NASA Astrophysics Data System (ADS)

    Farrand, W. H.; Wright, S. P.; Rogers, A. D.; Glotch, T. D.

    2016-09-01

    The CheMin X-ray diffraction instrument on-board the Curiosity rover in Gale crater has measured a consistent X-ray amorphous component in drill core samples examined to-date, clearly demonstrating that X-ray amorphous materials are a significant fraction of the martian surface layer. Glasses are potential components of this amorphous material and in this study, basaltic tephras from several hydro- and glaciovolcanic centers, as well as impact melts from India's Lonar Crater, were examined using thin section petrography, visible and near-infrared reflectance and mid-wave infrared emission spectroscopy as well as measuring major and minor element chemistry of representative samples using X-ray fluorescence (XRF) spectroscopy. The objectives of this study have been to look for distinguishing characteristics between volcanic and impact glasses and to determine features that indicate whether the glasses are fresh or altered using methods available on current and planned Mars rovers. Spectral features in the visible and near-infrared (VNIR) that can be used as indicators of alteration include the development of hydration features at 1.9 and ∼3 μm and a feature attributed to ferric oxide development at 0.48 μm. In the mid-wave infrared, it was observed that glass-rich tephra field samples did not display a broad, disordered glass feature near 9-10 μm (as is observed in pristine basaltic glasses) but rather a doublet with centers near 9.5 and 11 μm attributed in earlier work to incipient devitrification into SiO4 chain and sheet structures respectively. A tentative observation was made that the Si-O bending feature, observed in all the sample spectra near 22 μm was broader in the hydro- and glaciovolcanic glass samples than in the impact glass samples. Hydro- and glaciovolcanic glass-rich tephra samples were used as library spectra in linear deconvolution analyses of Mars Global Surveyor Thermal Emission Spectrometer (MGS TES) surface spectral types. These

  16. A comparison between adsorption mechanism of tricyclic antidepressants on silver nanoparticles and binding modes on receptors. Surface-enhanced Raman spectroscopy studies.

    PubMed

    Jaworska, Aleksandra; Malek, Kamilla

    2014-10-01

    A series of the tricyclic antidepressants known as a surface-active drugs, has been used as a model for an evaluation of their adsorption mechanism on the metal substrate and its relationship to pharmacological action of the chosen drugs. In these studies, six antidepressants were adsorbed on the metal substrate in a form of silver nanoparticles (ca. 30 nm in diameter) and afterwards their interactions have been examined in terms of surface-enhanced Raman spectroscopy (SERS). An analysis of SERS spectra has revealed that the dibenzopine moiety is a primary site of the adsorption with some differences in the orientation with respect to the metal among the studied molecules. The spectral changes due to the interactions with the silver particles also appear in the region typical for vibrations of the side chain. These observations are consistent with a model, in which the tricyclic ring is docked in the outer vestibule of biogenic amine transporters whereas the dimethyl-aminopropyl side chain is pointed to the substrate binding site. This work sheds a light on a potential of SERS technique in predicting a key functional group responsible for drug action. Copyright © 2014 Elsevier Inc. All rights reserved.

  17. Double-resonance spectroscopy of the high Rydberg states of HCO. II. Mode specificity in the dynamics of vibrational autoionization via CO stretch versus bend

    NASA Astrophysics Data System (ADS)

    Mayer, Eric E.; Hedderich, Hartmut G.; Grant, Edward R.

    1998-02-01

    We report ionization-detected absorption spectra of vibrationally autoionizing high Rydberg states of formyl radical. Steps of uv-visible double resonance with selected rovibrational levels of the 3pπ 2Π Rydberg state of HCO promote Franck-Condon vertical transitions that isolate series converging to (010) (bend) and (001) (CO stretch) excited states of HCO+. Final state energies in these spectra exceed the threshold for production of the cation ground state. Intensities and linewidths of observed resonances convey information on the dynamics of electron ejection driven by the vibronic relaxation of specific normal modes of the linear triatomic core. Many resonances in (010) and (001) autoionization spectra exhibit widths that approach the resolution of our laser. Other resonances in series converging to both limits are noticeably broadened, with linewidths that display an inverse cubic dependence on principal quantum number. Among these broader resonances, those in series that decay by relaxation of CO stretch exhibit a scaled width that is about a factor of two larger than that of the broadest resonances in series that relax via the bending fundamental. This trend mirrors to some degree one which has been seen in similar experiments on NO2. We consider these dynamics in the light of a multichannel quantum defect theory picture for the autoionization of polyatomic molecules.

  18. Characterization of dopant diffusion within semiconducting polymer and small-molecule films using infrared-active vibrational modes and attenuated total reflectance infrared spectroscopy.

    PubMed

    Maliakal, Ashok J

    2013-09-11

    Understanding dopant diffusion within organic and polymeric semiconductors is of great importance toward the development of organic photovoltaic and electronic devices, many of which require layered structures with controlled doping profiles (e.g., p-n and p-i-n structures). The current paper demonstrates a new method to determine the diffusion and permeability coefficients for dopant diffusion within polymeric and small-molecule organic semiconductors using attenuated total reflectance infrared (ATR-IR) spectroscopy and taking advantage of the intense IR-active vibrational bands created when dopants such as iodine accept charge from a semiconducting polymer to generate polaronic species. The diffusion and permeability coefficients for iodine within poly(3-hexylthiophene) (P3HT) are determined to be 2.5×10(-11)±1.2×10(-11) cm2/s and 2.4×10(-8)±1.2×10(-8) cm2/s·atm, respectively. The approach is applied to P3HT/PCBM (1:1 mass ratio) films, and the diffusion and permeability coefficients through these composite films are determined to be 7.8×10(-11)±2.8×10(-11) cm2/s and 4.8×10(-8)±1.3×10(-8) cm2/s·atm, respectively. Finally, the approach is extended to determining iodine diffusion within the polycrystalline semiconductor tetraphenylporphyrin (TPP) in a bilayer film with P3HT, and the diffusion coefficient of iodine through TPP is determined to be 7.1×10(-14)±1.1×10(-14) cm2/s. Although the current paper determines diffusion and permeability for the dopant iodine, this approach should be applicable to a wide array of dopants and polymeric and small-molecule semiconductors of interest in photovoltaic and electronic applications.

  19. High resolution, jet-cooled infrared spectroscopy of (HCl)2: Analysis of ν1 and ν2 HCl stretching fundamentals, interconversion tunneling, and mode-specific predissociation lifetimes

    NASA Astrophysics Data System (ADS)

    Schuder, Michael D.; Lovejoy, Christopher M.; Lascola, Robert; Nesbitt, David J.

    1993-09-01

    An extensive series of near-infrared absorption spectra are recorded for jet-cooled (6-14 K) hydrogen chloride dimer (HCl)2. Both ΔKa=0 and ΔKa=±1 bands are observed for both the free (ν1) and bonded (ν2) HCl stretches; all three chlorine isotopomers (H 35Cl-H 35Cl, H 35Cl-H 37Cl, and H 37Cl-H 37Cl) are observed and analyzed for K`a ≤ 2. The slit jet spectrum extends significantly the previous cooled cell infrared study of this complex and provides a measure of tunneling splittings for Ka=0 and 1 for each of the HCl ground (v=0) and excited (v=1) states. Mode specific vibrational predissociation is observed via analysis of the absorption line shapes, with Lorentzian contributions to the line profiles of Δν1≲1.6 MHz and Δν2=5.1±1.2 (2σ) MHz full width at half-maximum for ν1 and ν2 excitation, respectively. Stronger coupling in (HCl)2 of the bonded (ν2) vs free (ν1) HCl vibration to the dissociation coordinate is consistent with the comparable trends observed in other hydrogen bonded dimers. Quantum mechanical variational calculations on an electrostatic angular potential energy surface are used to model the internal HCl rotor dynamics using a coupled rotor formalism; analysis of the internal rotor eigenfunctions provides direct evidence for large amplitude ``geared'' internal rotation of the HCl subunits.

  20. THE {nu}{sub 8} BENDING MODE OF DIACETYLENE: FROM LABORATORY SPECTROSCOPY TO THE DETECTION OF {sup 13}C ISOTOPOLOGUES IN TITAN'S ATMOSPHERE

    SciTech Connect

    Jolly, A.; Benilan, Y.; Fayt, A.; Jacquemart, D.; Nixon, C. A.; Jennings, D. E.

    2010-05-01

    The strong {nu}{sub 8} band of diacetylene at 627.9 cm{sup -1} has been investigated to improve the spectroscopic line data used to model the observations, particularly in Titan's atmosphere by Cassini/Composite Infrared Spectrometer. Spectra have first been recorded in the laboratory at 0.5 and 0.1 cm{sup -1} resolution and temperature as low as 193 K. Previous analysis and line lists present in the GEISA database appeared to be insufficient to model the measured spectra in terms of intensity and hot band features. To improve the situation and in order to be able to take into account all rovibrational transitions with a non-negligible intensity, a global analysis of C{sub 4}H{sub 2} has been carried out to improve the description of the energy levels up to E{sub v} = 1900 cm{sup -1}. The result is a new extensive line list which enables us to model very precisely the temperature variation as well as the numerous hot band features observed in the laboratory spectra. One additional feature, observed at 622.3 cm{sup -1}, was assigned to the {nu}{sub 6} mode of a {sup 13}C isotopologue of diacetylene. The {nu}{sub 8} bands of both {sup 13}C isotopomers were also identified in the 0.1 cm{sup -1} resolution spectrum. Finally, a {sup 13}C/C{sub 4}H{sub 2} line list was added to the model for comparison with the observed spectra of Titan. We obtain a clear detection of {sup 13}C monosubstituted diacetylene at 622.3 cm{sup -1} and 627.5 cm{sup -1} (blended {nu}{sub 8} bands), deriving a mean {sup 12}C/{sup 13}C isotopic ratio of 90 {+-} 8. This value agrees with the terrestrial (89.4, inorganic standard) and giant planet values (88 {+-} 7), but is only marginally consistent with the bulk carbon value in Titan's atmosphere, measured in CH{sub 4} by Huygens GCMS to be 82 {+-} 1, indicating that isotopic fractionation during chemical processing may be occurring, as suggested for ethane formation.

  1. MHD Spectroscopy

    SciTech Connect

    Heeter, R F; Fasoli, A; Testa, D; Sharapov, S; Berk, H L; Breizman, B; Gondhalekar, A; Mantsinen, M

    2004-03-23

    Experiments are conducted on the JET tokamak to assess the diagnostic potential of MHD active and passive spectroscopy, for the plasma bulk and its suprathermal components, using Alfv{acute e}n Eigenmodes (AEs) excited by external antennas and by energetic particles. The measurements of AE frequencies and mode numbers give information on the bulk plasma. Improved equilibrium reconstruction, in particular in terms of radial profiles of density and safety factor, is possible from the comparison between the antenna driven spectrum and that calculated theoretically. Details of the time evolution of the non-monotonic safety factor profile in advanced scenarios can be reconstructed from the frequency of ICRH-driven energetic particle modes. The plasma effective mass can be inferred from the resonant frequency of externally driven AEs in discharges with similar equilibrium profiles. The stability thresholds and the nonlinear development of the instabilities can give clues on energy and spatial distribution of the fast particle population. The presence of unstable AEs provides lower limits in the energy of ICRH generated fast ion tails. Fast ion pressure gradients and their evolution can be inferred from the stability of AEs at different plasma radial positions. Finally, the details of the AE spectrum in the nonlinear stage can be used to obtain information about the fast particle velocity space diffusion.

  2. A new, model-free calculation method to determine the coordination modes and distribution of copper(II) among the metal binding sites of multihistidine peptides using circular dichroism spectroscopy.

    PubMed

    Osz, Katalin

    2008-12-01

    A new calculation method to determine microscopic protonation processes from CD spectra measured at different pH and Cu(II):ligand ratios was developed and used to give the relative binding strengths for the three histidines of hsPrP(84-114), a 31-mer polypeptide modeling the N-terminal copper(II) binding region of human (homo sapiens) prion protein. Mutants of hsPrP(84-114) with two or one histidyl residues have also been synthesized and their copper(II) complexes studied by CD spectroscopy. The 1-His models were analyzed first, and the molar CD spectra for the different coordination modes on the different histidines were calculated using the general computational program PSEQUAD. These spectra were deconvoluted into the sum of Gaussian curves and used as a first parameter set to calculate the molar spectra for the different coordination modes (3N and 4N coordination) and coordination positions (His85, His96 and His111) of the 2-His peptides. The calculation method therefore does not require the direct use of CD spectra measured in the smaller peptide models. This is a significant improvement over earlier calculation methods. In the same runs, the stepwise deprotonation pK(mic) values were refined and the pH-dependent distribution of copper(II) between the two histidines was determined. The results revealed the high, but different copper(II) binding affinities of the three separate histidines in the following order: His85 < His96His111. The calculation also showed that molar CD spectra which belong to the same coordination mode and coordination position in different ligands have very similar transition energies but different intensities. For this reason, direct transfer of molar CD spectra between different ligands may be a source of error, but the pK(mic) values and the copper(II) binding preferences are transferable from the 2-His peptides to the 3-His hsPrP(84-114).

  3. A Comparison between Electrochemical Impedance Spectroscopy and Incremental Capacity-Differential Voltage as Li-ion Diagnostic Techniques to Identify and Quantify the Effects of Degradation Modes within Battery Management Systems

    NASA Astrophysics Data System (ADS)

    Pastor-Fernández, Carlos; Uddin, Kotub; Chouchelamane, Gael H.; Widanage, W. Dhammika; Marco, James

    2017-08-01

    Degradation of Lithium-ion batteries is a complex process that is caused by a variety of mechanisms. For simplicity, ageing mechanisms are often grouped into three degradation modes (DMs): conductivity loss (CL), loss of active material (LAM) and loss of lithium inventory (LLI). State of Health (SoH) is typically the parameter used by the Battery Management System (BMS) to quantify battery degradation based on the decrease in capacity and the increase in resistance. However, the definition of SoH within a BMS does not currently include an indication of the underlying DMs causing the degradation. Previous studies have analysed the effects of the DMs using incremental capacity and differential voltage (IC-DV) and electrochemical impedance spectroscopy (EIS). The aim of this study is to compare IC-DV and EIS on the same data set to evaluate if both techniques provide similar insights into the causes of battery degradation. For an experimental case of parallelized cells aged differently, the effects due to LAM and LLI were found to be the most pertinent, outlining that both techniques are correlated. This approach can be further implemented within a BMS to quantify the causes of battery ageing which would support battery lifetime control strategies and future battery designs.

  4. Spectroscopic mode identification of γ Doradus stars

    NASA Astrophysics Data System (ADS)

    Brunsden, E.; Pollard, K. R.; Cottrell, P. L.; Wright, D. J.; Cat, P. De

    2017-09-01

    The g-mode pulsations in γ Doradus stars are identified using time-series colour photometry and high-resolution spectroscopy. For 22 class members the pulsational frequencies and modes are compared. Ground-based spectroscopic and photometric results show good agreement. The prevalence of (1, |1|) modes is noted and examined.

  5. Stoichiometry, vibrational modes, and structure of niobium(V) oxosulfato complexes in the molten Nb(2)O(5)-K(2)S(2)O(7)-K(2)SO(4) system studied by Raman spectroscopy.

    PubMed

    Paulsen, Andreas L; Borup, Flemming; Berg, Rolf W; Boghosian, Soghomon

    2010-07-22

    The structural and vibrational properties of NbV oxosulfato complexes formed in Nb2O5-K2S2O7 and Nb2O5-K2S2O7-K2SO4 molten mixtures with 0 spectroscopy under static equilibtrium at temperatures up to 700 degrees C. The spectral features for the binary Nb2O5-K2S2O7 molten system indicate that the dissolution of Nb2O5 proceeds with consumption of S2O72- leading to the formation of a NbV oxosulfato complex according to Nb2O5 + nS2O72- --> C2n-; a simple formalism exploiting the relative Raman band intensities is used for determining the stoichiometric coefficient, n, pointing to n = 3 and to the following reaction: Nb2O5 + 3S2O72- --> 2NbO(SO4)33-, which is consistent with the Raman spectra of the molten mixtures. Nb2O5 could be dissolved much easier when K2SO4 was present in an equimolar (1:1) SO42-/Nb ratio; the incremental presence of K2SO4 in Nb2O5-K2S2O7 melts induces composition effects in the Raman spectra that terminate when n(SO42-)/n(Nb) = 1. The composition effects and the temperature-dependent features of the Raman spectra obtained for Nb2O5-K2S2O7-K2SO4 molten mixtures together with the spectral changes occurring upon freezing are accounted for by a Nb2O5.3K2S2O7.2K2SO4 stoichiometry for the complete reaction taking place: Nb2O5 + 3S2O72- + 2SO42- --> NbO(SO4)4S2O77- + NbO2(SO4)23-. The spectral data are discussed in terms of the most plausible structural models, for which consistent band assignments are made. The most characteristic Raman bands for the NbV oxosulfato complexes pertain to Nb=O modes: (i) at 937 cm-1 for the mono-oxo Nb=O mode of NbO(SO4)33-; (ii) at 958 cm-1 for the mono-oxo Nb=O mode of NbO(SO4)4S2O77-; and (iii) at 926 cm-1 for the symmetric dioxo Nb(=O)2 mode of NbO2(SO4)23-.

  6. Interference between the Modes of an All-Dielectric Meta-atom

    NASA Astrophysics Data System (ADS)

    Powell, David A.

    2017-03-01

    The modes of silicon meta-atoms are investigated, motivated by their use as building blocks of Huygens metasurfaces. A model based on these modes is presented, giving a clear physical explanation of all features in the extinction spectrum. Counterintuitively, this model can show negative contributions to extinction, which are shown to arise from the interference between nonorthogonal modes. The direct and interference contributions to extinction are determined, showing that conservation of energy is preserved. The Huygens condition of matched electric- and magnetic-dipole moments leads to strong forward scattering and suppressed backscattering. It is shown that higher-order modes with appropriate symmetry generalize this condition, leading to multiple bands of directional scattering. The presented results are obtained using a robust approach to find the modes of nanophotonic scatterers, commonly referred to as quasinormal modes. By utilizing an integral formulation of Maxwell's equations, this work avoids the problem of normalizing diverging far fields, which other approaches require. The model and presented results are implemented in open-source code.

  7. Quarkonium spectroscopy

    SciTech Connect

    Scharre, D.L.

    1981-06-01

    Recent experimental investigations of heavy quark-antiquark bound state systems are reviewed. Results from SPEAR on charmonium spectroscopy and from DORIS and CESR on bottomonium spectroscopy are presented. The current status of the search for top is also discussed.

  8. Theory of Acoustic Raman Modes in Proteins

    NASA Astrophysics Data System (ADS)

    DeWolf, Timothy; Gordon, Reuven

    2016-09-01

    We present a theoretical analysis that associates the resonances of extraordinary acoustic Raman (EAR) spectroscopy [Wheaton et al., Nat. Photonics 9, 68 (2015)] with the collective modes of proteins. The theory uses the anisotropic elastic network model to find the protein acoustic modes, and calculates Raman intensity by treating the protein as a polarizable ellipsoid. Reasonable agreement is found between EAR spectra and our theory. Protein acoustic modes have been extensively studied theoretically to assess the role they play in protein function; this result suggests EAR spectroscopy as a new experimental tool for studies of protein acoustic modes.

  9. Vibrational spectroscopy

    Treesearch

    Umesh P. Agarwal; Rajai Atalla

    2010-01-01

    Vibrational spectroscopy is an important tool in modern chemistry. In the past two decades, thanks to significant improvements in instrumentation and the development of new interpretive tools, it has become increasingly important for studies of lignin. This chapter presents the three important instrumental methods-Raman spectroscopy, infrared (IR) spectroscopy, and...

  10. Influence of zero-modes on the inertial-range anisotropy of Rayleigh-Taylor and unstably stratified homogeneous turbulence

    NASA Astrophysics Data System (ADS)

    Soulard, Olivier; Gréa, Benoît-Joseph

    2017-07-01

    The purpose of this work is to study the anisotropic properties of the inertial range of Rayleigh-Taylor and unstably stratified homogeneous (USH) turbulence. More precisely, we aim to understand the role played by the so-called zero-modes, i.e., modes that nullify the anisotropic part of transfer terms. To this end, we determine several characteristic properties of zero-modes using an eddy-damped quasinormal Markovianized (EDQNM) model. Then we perform a high-Reynolds-number EDQNM simulation of a USH flow and check whether the predicted zero-mode properties are indeed observed in this idealized setting. Finally, we carry out a large-eddy simulation of a Rayleigh-Taylor flow and verify if zero-modes can also be identified in this configuration. Among the main findings of this work, we show that the small-scale anisotropy of the velocity and concentration spectra is dominated by the nonlocal contribution of zero-modes rather than by the local action of buoyancy forces. As a result, we predict inertial scaling exponents close to -7 /3 (rather than -3 ) for the second-order harmonics of the velocity and concentration spectra. By contrast, the concentration flux spectrum remains controlled by buoyancy forces. Still, we show that the zero-mode contribution vanishes slowly as the Reynolds number increases. This translates into a slow convergence of the scaling exponent of the second-order harmonic of the concentration flux to -7 /3 .

  11. Ring resonant cavities for spectroscopy

    DOEpatents

    Zare, Richard N.; Martin, Juergen; Paldus, Barbara A.; Xie, Jinchun

    1999-01-01

    Ring-shaped resonant cavities for spectroscopy allow a reduction in optical feedback to the light source, and provide information on the interaction of both s- and p-polarized light with samples. A laser light source is locked to a single cavity mode. An intracavity acousto-optic modulator may be used to couple light into the cavity. The cavity geometry is particularly useful for Cavity Ring-Down Spectroscopy (CRDS).

  12. Ring resonant cavities for spectroscopy

    DOEpatents

    Zare, R.N.; Martin, J.; Paldus, B.A.; Xie, J.

    1999-06-15

    Ring-shaped resonant cavities for spectroscopy allow a reduction in optical feedback to the light source, and provide information on the interaction of both s- and p-polarized light with samples. A laser light source is locked to a single cavity mode. An intracavity acousto-optic modulator may be used to couple light into the cavity. The cavity geometry is particularly useful for Cavity Ring-Down Spectroscopy (CRDS). 6 figs.

  13. Chiroptical spectroscopy

    NASA Astrophysics Data System (ADS)

    Gunde, Kevin Edward

    1997-09-01

    The research presented here is of chiroptical spectroscopy. A new type of non-linear chiroptical spectroscopy, two-photon circular dichroism, is developed experimentally and theoretically. A theoretical formalism is developed to describe another new chiroptical spectroscopy, second-harmonic generation circular dichroism. An established type of chiroptical spectroscopy, time-resolved chiroptical luminescence, is applied to two new sets of subject systems. Journal articles related to these topics, as well as other research to which the author has contributed, are reproduced and included as appendices.

  14. Laser Spectroscopy and Frequency Combs

    NASA Astrophysics Data System (ADS)

    Hänsch, Theodor W.; Picqué, Nathalie

    2013-12-01

    The spectrum of a frequency comb, commonly generated by a mode-locked femtosecond laser consists of several hundred thousand precisely evenly spaced spectral lines. Such laser frequency combs have revolutionized the art measuring the frequency of light, and they provide the long-missing clockwork for optical atomic clocks. The invention of the frequency comb technique has been motivated by precision laser spectroscopy of the simple hydrogen atom. The availability of commercial instruments is facilitating the evolution of new applications far beyond the original purpose. Laser combs are becoming powerful instruments for broadband molecular spectroscopy by dramatically improving the resolution and recording speed of Fourier spectrometers and by creating new opportunities for highly multiplexed nonlinear spectroscopy, such as two-photon spectroscopy or coherent Raman spectroscopy. Other emerging applications of frequency combs range from fundamental research in astronomy, chemistry, or attosecond science to telecommunications and satellite navigation.

  15. Amateur Spectroscopy

    NASA Astrophysics Data System (ADS)

    Gavin, M.; Murdin, P.

    2003-04-01

    Spectroscopy (see ASTRONOMICAL SPECTROSCOPY) has seen a revival of late. Pioneers in the 19th century such as Angelo Secchi and William Huggins observed spectra visually via large refractors under pristine skies. While the eye can comprehend the brilliant solar spectrum and a few brighter stars aided by a telescope, even low spectral dispersion greatly dilutes starlight. Photo-film can marginally ...

  16. Raman Spectroscopy.

    ERIC Educational Resources Information Center

    Gerrard, Donald L.

    1984-01-01

    Reviews literature on Raman spectroscopy from late 1981 to late 1983. Topic areas include: instrumentation and sampling; liquids and solutions; gases and matrix isolation; biological molecules; polymers; high-temperature and high-pressure studies; Raman microscopy; thin films and surfaces; resonance-enhanced and surface-enhanced spectroscopy; and…

  17. Raman Spectroscopy.

    ERIC Educational Resources Information Center

    Gerrard, Donald L.

    1984-01-01

    Reviews literature on Raman spectroscopy from late 1981 to late 1983. Topic areas include: instrumentation and sampling; liquids and solutions; gases and matrix isolation; biological molecules; polymers; high-temperature and high-pressure studies; Raman microscopy; thin films and surfaces; resonance-enhanced and surface-enhanced spectroscopy; and…

  18. Mode Hopping in Semiconductor Lasers

    NASA Astrophysics Data System (ADS)

    Heumier, Timothy Alan

    Semiconductor lasers have found widespread use in fiberoptic communications, merchandising (bar-code scanners), entertainment (videodisc and compact disc players), and in scientific inquiry (spectroscopy, laser cooling). Some uses require a minimum degree of stability of wavelength which is not met by these lasers: Under some conditions, semiconductor lasers can discontinuously switch wavelengths in a back-and-forth manner. This is called mode hopping. We show that mode hopping is directly correlated to noise in the total intensity, and that this noise is easily detected by a photodiode. We also show that there are combinations of laser case temperature and injection current which lead to mode hopping. Conversely, there are other combinations for which the laser is stable. These results are shown to have implications for controlling mode hopping.

  19. Lifetimes of Hydrogen and Deuterium Related Vibrational Modes in Silicon

    SciTech Connect

    Budde, M.; Luepke, G.; Chen, E; Zhang, X.; Tolk, N. H.; Feldman, L. C.; Tarhan, E.; Ramdas, A. K.; Stavola, M.

    2001-10-01

    Lifetimes of hydrogen and deuterium related stretch modes in Si are measured by high-resolution infrared absorption spectroscopy and transient bleaching spectroscopy. The lifetimes are found to be extremely dependent on the defect structure, ranging from 2 to 295 ps. Against conventional wisdom, we find that lifetimes of Si-D modes typically are longer than for the corresponding Si-H modes. The potential implications of the results on the physics of electronic device degradation are discussed.

  20. Charm and Charm Spectroscopy

    SciTech Connect

    Santoro, Valentina; /Ferrara U.

    2011-11-23

    Recent developements in D mixing physics and charm spectroscopy will be discussed. Focus will be on the BaBar experimental results for the D mixing: first evidence of the D{sup 0}-mixing (hadronic D{sup 0} decays), lifetime difference and time-dependent Dalitz plot analysis of D{sup 0} {yields} K{sup +}{pi}{sup -}{pi}{sup 0}. Then, recent results on charm spectroscopy will be presented with particular focus on the new Ds states that have been discovered in the last few years. Some of these states were not expected theoretically: their masses, widths, quantum numbers, and decay modes do not fit the existing spectroscopic classication, which is based mostly on potential model calculations.

  1. Inelastic electron tunneling spectroscopy

    NASA Technical Reports Server (NTRS)

    Khanna, S. K.; Lambe, J.

    1983-01-01

    Inelastic electron tunneling spectroscopy is a useful technique for the study of vibrational modes of molecules adsorbed on the surface of oxide layers in a metal-insulator-metal tunnel junction. The technique involves studying the effects of adsorbed molecules on the tunneling spectrum of such junctions. The data give useful information about the structure, bonding, and orientation of adsorbed molecules. One of the major advantages of inelastic electron tunneling spectroscopy is its sensitivity. It is capable of detecting on the order of 10 to the 10th molecules (a fraction of a monolayer) on a 1 sq mm junction. It has been successfully used in studies of catalysis, biology, trace impurity detection, and electronic excitations. Because of its high sensitivity, this technique shows great promise in the area of solid-state electronic chemical sensing.

  2. Soft acoustic mode in ferroelastic BiVO4

    NASA Astrophysics Data System (ADS)

    Benyuan, Gu; Copic, M.; Cummins, H. Z.

    1981-10-01

    Brillouin scattering spectroscopy of bismuth vanadate has revealed a soft acoustic mode which is characteristic of a proper ferroelastic phase transition. Raman scattering has revealed an optic mode which is doubly degenerate Eg in the paraelastic phase and splits into two Bg modes in the ferroelastic phase. The temperature dependence of the splitting is also consistent with a proper ferroelastic transition.

  3. When black holes collide: Probing the interior composition by the spectrum of ringdown modes and emitted gravitational waves

    NASA Astrophysics Data System (ADS)

    Brustein, Ram; Medved, A. J. M.; Yagi, K.

    2017-09-01

    The merger of colliding black holes (BHs) should lead to the production of ringdown or quasinormal modes (QNMs), which may very well be sensitive to the state of the interior. We put this idea to the test with a recent proposal that the interior of a BH consists of a bound state of highly excited, long, closed, interacting strings; figuratively, a collapsed polymer. We show, using scalar perturbations for simplicity, that such BHs do indeed have a distinct signature in their QNM spectrum: A new class of modes whose frequencies are parametrically lower than the lowest-frequency mode of a classical BH and whose damping times are parametrically longer. The reason for the appearance of the new modes is that our model contains another scale, the string length, which is parametrically larger than the Planck length. This distinction between the collapsed-polymer model and general-relativistic BHs could be made with gravitational-wave observations and offers a means for potentially measuring the strength of the coupling in string theory. For example, GW150914 already allows us to probe the strength of the string coupling near the regime which is predicted by the unification of the gravitational and gauge-theory couplings. We also derive bounds on the amplitude of the collapsed-polymer QNMs that can be placed by current and future gravitational-wave observations.

  4. Sensors Based on Spectroscopy of Guided Waves

    NASA Astrophysics Data System (ADS)

    Homola, Jiří

    The last two decades have witnessed remarkable progress in the develpment of affinity biosensors and their applications in areas such as environmental protection, biotechnology, medical diagnostics, drug screening, food safety, and security. An affinity biosensor consists of a transducer and a biological recognition element which is able to interact with a selected analyte. Various optical methods have been exploited in biosensors including fluorescence spectroscopy, interferometry (reflectometric white light interferometry, modal interferometry in optical waveguide structures), and spectroscopy of guided modes of optical waveguides. Optical biosensors based on spectroscopy of guided modes of optical waveguides - grating coupler, resonant mirror, and surface plasmon resonance (SPR) - rely on the measurement of binding-induced refractive index changes and thus are label-free technologies. This paper reviews fundamentals of optical sensors based on spectroscopy of guided modes of optical waveguides and their applications.

  5. Raman spectroscopy

    NASA Astrophysics Data System (ADS)

    Gleeson, Helen F.

    Raman spectroscopy has been used as a tool to study liquid crystals for several decades. There are several features that make Raman spectroscopy an important characterisation method. It is bond-specific, so can provide information about the interaction of liquid crystals with colloidal systems and can offer an insight into phase transitions. The polarization dependence of the scattering can be used to determine order parameters in liquid crystal systems. Finally, the relatively high spatial resolution of the technique (∽1 μm) can be used to explore spatiallydependent order in soft matter systems. This chapter describes the most important ways in which Raman spectroscopy can be used to reveal information about liquid crystal systems, illustrated by examples. Both the theoretical background and experimental considerations are described, providing a comprehensive introduction to anybody interested in using the technique to understand liquid crystal systems.

  6. Cometary spectroscopy

    NASA Astrophysics Data System (ADS)

    Biver, N.

    2011-04-01

    Cometary spectroscopy from the ultraviolet to the radio wavelength domain provides us with insights on the composition of the gases that are released by the cometary nuclei. While infrared to millimeter spectroscopy give access to the parent molecules that are released directly from the nucleus, visible spectroscopy enables observation of daughter species. Those "radicals" observable in the visible domain have more complex spectroscopic band-like structures and are mainly CN, C2, C3, NH2. Their spectroscopic signatures are easily accessible to amateur astronomers class equipment. Provided that carefully calibrated data are acquired, some simple calculation can readily be done to convert the line intensities into comet molecular outgassing rates and thus provide interesting physical data on comets. In addition to broadband dust measurements, the interested amateur can produce valuable scientific data on comets that will always be welcome from the professional community and certainly useful as the monitoring of comets activity is always essential.

  7. Hardware Assisted ROP Detection Mode (HARD Mode)

    DTIC Science & Technology

    2013-08-01

    Distribution A. Cleared for public release; unlimited distribution. USAFA-CN-2013-457 Hardware Assisted ROP Detection Mode (HARD Mode) NATHANIEL HART...457 This report, "Hardware Assisted ROP Detection Mode (HARD Mode)" is presented as a competent treatment of the subj ect, worthy of publication. The...Technical 20120810-20121215 Hardware Assisted ROP Detection Mode (HARD Mode) NATHANIEL HART MICHAEL WINSTEAD MARTIN CARLISLE RODNEY LYKINS MICHAEL

  8. Pd/Pt(1 1 1) surface structure and metal epitaxy by time-of-flight impact-collision ion scattering spectroscopy and scanning tunneling microscopy: Does lattice mismatch really determine the growth mode?

    NASA Astrophysics Data System (ADS)

    Umezawa, K.; Narihiro, E.; Ohta, Y.; Ohira, Y.; Yoshimura, M.

    2008-04-01

    We have investigated the growth of 3 ML of Pd on Pt(1 1 1) at substrate temperature of around 300 K using TOF-ICISS. Also a series of STM topographs were taken as a function of coverage of Pd atoms. The Pd-Pt(1 1 1) combination does not have lattice mismatch (less than 1%); the nearest neighbor distance of bulk Pd(1 1 1) and Pt(1 1 1) are 2.75 Å and 2.77 Å, respectively. Experimental data and computer simulations result clearly show the growth mode of Pd(1 1 1) [ 2 bar 1 1]/Pt(1 1 1) [ 2 bar 1 1] hetero epitaxy at the coverage of the Pd deposition less than 3 ML. The growth mode of Pd(1 1 1) [ 1 bar 1 bar 2 ]/Pt(1 1 1) [ 2 bar 1 1] could not be observed at all. One would expect that the growth mode of Pd atoms on Pt(1 1 1) surfaces is like homo epitaxy (layer-by-layer growth), because of no lattice mismatch (less than 1%). However, it was not. The calculated surface and interface energies and STM results show 2D or 3D dimensional island growth. Pd atoms is mainly form dense islands at the steps on Pt(1 1 1) surfaces at the coverage of 0.13 ML.

  9. Modern Spectroscopy

    ERIC Educational Resources Information Center

    Barrow, Gordon M.

    1970-01-01

    Presents the basic ideas of modern spectroscopy. Both the angular momenta and wave-nature approaches to the determination of energy level patterns for atomic and molecular systems are discussed. The interpretation of spectra, based on atomic and molecular models, is considered. (LC)

  10. Raman spectroscopy

    USDA-ARS?s Scientific Manuscript database

    Raman spectroscopy has gained increased use and importance in recent years for accurate and precise detection of physical and chemical properties of food materials, due to the greater specificity and sensitivity of Raman techniques over other analytical techniques. This book chapter presents Raman s...

  11. Low-frequency vibrational modes of glutamine

    NASA Astrophysics Data System (ADS)

    Wang, Wei-Ning; Wang, Guo; Zhang, Yan

    2011-12-01

    High-resolution terahertz absorption and Raman spectra of glutamine in the frequency region 0.2 THz-2.8 THz are obtained by using THz time domain spectroscopy and low-frequency Raman spectroscopy. Based on the experimental and the computational results, the vibration modes corresponding to the terahertz absorption and Raman scatting peaks are assigned and further verified by the theoretical calculations. Spectral investigation of the periodic structure of glutamine based on the sophisticated hybrid density functional B3LYP indicates that the vibrational modes come mainly from the inter-molecular hydrogen bond in this frequency region.

  12. Nuclear Inelastic Scattering and Mössbauer Spectroscopy as Local Probes for Ligand Binding Modes and Electronic Properties in Proteins: Vibrational Behavior of a Ferriheme Center Inside a β-Barrel Protein

    PubMed Central

    Moeser, Beate; Janoschka, Adam; Wolny, Juliusz A.; Paulsen, Hauke; Filippov, Igor; Berry, Robert E.; Zhang, Hongjun; Chumakov, Alexander I.; Walker, F. Ann; Schünemann, Volker

    2012-01-01

    In this work we present a study of the influence of the protein matrix on its ability to tune the binding of small ligands such as NO, cyanide (CN-) and histamine to the ferric heme iron center in the NO-storage and -transport protein Nitrophorin 2 (NP2) from the salivary glands of the blood-sucking insect Rhodnius prolixus. Conventional Mössbauer spectroscopy shows a diamagnetic ground state of the NP2-NO complex and Type I and II electronic ground states of the NP2-CN- and NP2-histamine complex, respectively. The change in the vibrational signature of the protein upon ligand binding has been monitored by Nuclear Inelastic Scattering (NIS), also called Nuclear Resonant Vibrational Spectroscopy (NRVS). The NIS data thus obtained have also been calculated by quantum mechanical (QM) density functional theory (DFT) coupled with Molecular Mechanics (MM) methods. The calculations presented here show that the heme ruffling in NP2 is a consequence of the interaction with the protein matrix. Structure optimizations of the heme and its ligands with DFT retain the characteristic saddling and ruffling only if the protein matrix is taken into account. Furthermore, simulations of the NIS data by QM/MM calculations suggest that the pH dependence of the binding of NO, but not of CN– and histamine, might be a consequence of the protonation state of the heme carboxyls. PMID:22295945

  13. Capillary wave spectroscopy on ferrofluids

    NASA Astrophysics Data System (ADS)

    Patzke, J.; Rathke, B.; Will, S.

    2007-12-01

    We investigate the magnetoviscous effect in ferrofluids by Capillary Wave Spectroscopy (CWS, Surface Light Scattering). This technique probes a specific mode of thermally excited surface waves giving information on surface tension and viscosity. In ferrofluids we detect a transition from propagating surface modes to overdamped ones depending on the particle concentration and strength and the orientation of an externally applied magnetic field. We interprete this effect as caused by an increase of the liquid viscosity with an increasing particle concentration and field-strength. Changing the relative orientation of the scattering vector and magnetic field shows that the viscous properties of ferrofluids in a magnetic field are anisotropic. Figs 8, Refs 12.

  14. Grain Spectroscopy

    NASA Technical Reports Server (NTRS)

    Allamandola, L. J.

    1992-01-01

    Our fundamental knowledge of interstellar grain composition has grown substantially during the past two decades thanks to significant advances in two areas: astronomical infrared spectroscopy and laboratory astrophysics. The opening of the mid-infrared, the spectral range from 4000-400 cm(sup -1) (2.5-25 microns), to spectroscopic study has been critical to this progress because spectroscopy in this region reveals more about a materials molecular composition and structure than any other physical property. Infrared spectra which are diagnostic of interstellar grain composition fall into two categories: absorption spectra of the dense and diffuse interstellar media, and emission spectra from UV-Vis rich dusty regions. The former will be presented in some detail, with the latter only very briefly mentioned. This paper summarized what we have learned from these spectra and presents 'doorway' references into the literature. Detailed reviews of many aspects of interstellar dust are given.

  15. Grain Spectroscopy

    NASA Technical Reports Server (NTRS)

    Allamandola, L. J.

    1992-01-01

    Our fundamental knowledge of interstellar grain composition has grown substantially during the past two decades thanks to significant advances in two areas: astronomical infrared spectroscopy and laboratory astrophysics. The opening of the mid-infrared, the spectral range from 4000-400 cm(sup -1) (2.5-25 microns), to spectroscopic study has been critical to this progress because spectroscopy in this region reveals more about a materials molecular composition and structure than any other physical property. Infrared spectra which are diagnostic of interstellar grain composition fall into two categories: absorption spectra of the dense and diffuse interstellar media, and emission spectra from UV-Vis rich dusty regions. The former will be presented in some detail, with the latter only very briefly mentioned. This paper summarized what we have learned from these spectra and presents 'doorway' references into the literature. Detailed reviews of many aspects of interstellar dust are given.

  16. Laser Spectroscopy

    NASA Astrophysics Data System (ADS)

    Katori, H.; Yoneda, H.; Nakagawa, K.; Shimizu, F.

    2010-02-01

    Anderson localization of matter-waves in a controlled disorder: a quantum simulator? / A. Aspect ... [et al.] -- Squeezing and entanglement in a Bose-Einstein condensate / C. Gross ... [et al.] -- New physics in dipolar Bose-Einstein condensates / Y. Kawaguchi, H. Saito, and M. Ueda -- Observation of vacuum fluctuations in a spinor Bose-Einstein condensate / C. Klempt ... [et al.] -- Negative-index media for matter waves / F. Perales ... [et al.] -- Entanglement of two individual atoms using the Rydberg blockade / A. Browaeys ... [et al.] -- Array of mesoscopic ensembles on a magnetic atom chip / A. F. Tauschinsky ... [et al.] -- Stability of the proton-to-electron mass ratio tested with molecules using an optical link to primary clock / A. Amy-Klein ... [et al.] -- Metastable helium: lifetime measurements using cold atoms as a test of QED / K. G. H. Baldwin ... [et al.] -- Optical lattice clocks with single occupancy bosons and spin-polarized fermions toward 10[symbol] accuracy / M. Takamoto ... [et al.] -- Frequency measurements of Al[symbol] and Hg[symbol] optical standards / W. M. Itano ... [et al.] -- Switching of light with light using cold atoms inside a hollow optical fiber / M. Bajcsy ... [et al.] -- Room-temperature atomic ensembles for quantum memory and magnetometry / K. Jensen ... [et al.] -- Components for multi-photon non-classical state preparation and measurement / G. Puentes ... [et al.] -- Quantum field state measurement and reconstruction in a cavity by quantum nondemolition photon counting / M. Brune ... [et al.] -- XUV frequency comb spectroscopy / C. Gohle ... [et al.] -- Ultrahigh-repetition-rate pulse train with absolute-phase control produced by an adiabatic raman process / M. Katsuragawa ... [et al.] -- Strongly correlated bosons and fermions in optical lattices / S. Will ... [et al.] -- Bragg spectroscopy of ultracold bose gases in optical lattices / L. Fallani ... [et al.] -- Synthetic quantum many-body systems / C. Guerlin ... [et al

  17. The identification and quantification of a high molecular weight light stabilizer in polycarbonate by application of an online coupling of size exclusion chromatography in stopped flow mode with pyrolysis gas chromatography time of flight mass spectroscopy.

    PubMed

    Brander, Eric; Wold, Christian

    2014-10-03

    The identification and quantification of a high molecular weight light stabilizer (Uvinul 3030™) in an unknown polycarbonate sample was achieved through the application of SEC-Py-TOF-GCMS. A size exclusion column optimized to achieve resolution in the lower mass range was applied to allow the fractionation of an individual additive peak. A commercially available sampling interface was operated in stop flow mode and fractions were pyrolyzed to allow chromatographic separation of the fragments of the otherwise non-volatile stabilizer. After identification on the basis of accurate mass and elemental composition of the additive the quantification was compared using the available SEC-UV and SEC-PY-GC-TOFMS data. The resulting method provided a high degree of certainty in identification and flexibility in quantification expected to be applicable to other additives of similar volatilities or functional class. Copyright © 2014 Elsevier B.V. All rights reserved.

  18. Theory of single-mode laser instabilities

    SciTech Connect

    Hendow, S.T.; Sargent M. III

    1985-01-01

    We use the semiclassical strong-signal theory of the laser to predict and explain the onset of side-mode buildup in lasers with one oscillating mode. Two general categories are considered: one for which the side modes and the oscillating mode all have the same wavelength and the other for which they have different wavelengths. The treatments include an arbitrary amount of inhomogeneous broadening. Our approach unifies the treatments of the side-mode instabilities presented earlier and extends them to handle standing waves in addition to the previously treated running waves. We write the field and the population matrix elements as Fourier series in the adjacent mode beat frequency. This approach has been used extensively in both multimode laser theory and saturation spectroscopy. This technique coincides with linear stability analyses used by others, provided that our beat frequency includes a contribution that is proportional to the Complex side-mode gain. We give a solution that allows for detuned operation along with its simpler, centrally tuned special case. The connection with saturation spectroscopy clearly reveals that the side-mode instabilities require side-mode gain. For the single-wavelength case, nonlinear anomalous dispersion is also required. The side-mode gain and dispersion result from both inhomogeneous broadening and population pulsations. The lowest instability thresholds occur when both of these mechanisms play a role. The approach can also be used to treat instabilities in optical bistability by substituting the appropriate equation of state for the strong-mode intensity and by changing the sign of the absorption coefficient. In homogeneously broadened, standing-wave lasers, we show that multiwavelength instabilities depend strongly on the position of the medium in the cavity.

  19. Dark plasmonic breathing modes in silver nanodisks.

    PubMed

    Schmidt, Franz-Philipp; Ditlbacher, Harald; Hohenester, Ulrich; Hohenau, Andreas; Hofer, Ferdinand; Krenn, Joachim R

    2012-11-14

    We map the complete plasmonic spectrum of silver nanodisks by electron energy loss spectroscopy and show that the mode which couples strongest to the electron beam has radial symmetry with no net dipole moment. Therefore, this mode does not couple to light and has escaped from observation in optical experiments. This radial breathing mode has the character of an extended two-dimensional surface plasmon with a wavenumber determined by the circular disk confinement. Its strong near fields can impact the hybridization in coupled plasmonic nanoparticles as well as couplings with nearby quantum emitters.

  20. Dual Comb Fourier Transform Spectroscopy

    NASA Astrophysics Data System (ADS)

    Hänsch, T. W.; Picqué, N.

    2010-06-01

    The advent of laser frequency combs a decade ago has already revolutionized optical frequency metrology and precision spectroscopy. Extensions of laser combs from the THz region to the extreme ultraviolet and soft x-ray frequencies are now under exploration. Such laser combs have become enabling tools for a growing tree of applications, from optical atomic clocks to attosecond science. Recently, the millions of precisely controlled laser comb lines that can be produced with a train of ultrashort laser pulses have been harnessed for highly multiplexed molecular spectroscopy. Fourier multi-heterodyne spectroscopy, dual comb spectroscopy, or asynchronous optical sampling spectroscopy with frequency combs are emerging as powerful new spectroscopic tools. Even the first proof-of-principle experiments have demonstrated a very exciting potential for ultra-rapid and ultra-sensitive recording of complex molecular spectra. Compared to conventional Fourier transform spectroscopy, recording times could be shortened from seconds to microseconds, with intriguing prospects for spectroscopy of short lived transient species. Longer recording times allow high resolution spectroscopy of molecules with extreme precision, since the absolute frequency of each laser comb line can be known with the accuracy of an atomic clock. The spectral structure of sharp lines of a laser comb can be very useful even in the recording of broadband spectra without sharp features, as they are e.g. encountered for molecular gases or in the liquid phase. A second frequency comb of different line spacing permits the generation of a comb of radio frequency beat notes, which effectively map the optical spectrum into the radio frequency regime, so that it can be recorded with a single fast photodetector, followed by digital signal analysis. In the time domain, a pulse train of a mode-locked femtosecond laser excites some molecular medium at regular time intervals. A second pulse train of different repetition

  1. Hypernuclear spectroscopy

    SciTech Connect

    F. Garibaldi, O. Hashimoto, J.J. LeRose, P. Markowitz, S.N. Nakamura, J. Reinhold, L. Tang

    2011-06-01

    A program of hypernuclear spectroscopy experiments encompassing many hypernuclei has been undertaken in both Halls A and C using complimentary approaches. Spectra with sub-MeV resolution have been obtained for Li, B, and N in Hall A, while results from Hall C include He, B, and Al with new data still under analysis for He, Li, Be, B and V. High resolution and high precision in the determination of the single Λ binding energy at various shell levels has been the key success of these experiments using the (e,e'K+) reaction to produce Λ hypernuclei.

  2. Raman spectroscopy

    SciTech Connect

    Gerrard, D.L.; Bowley, H.J.

    1988-06-15

    The period of this review is from late 1985 to late 1987. During this time over 6000 papers have been published in the scientific literature dealing with many applications of Raman spectroscopy and extending its use to new areas of study. This article covers only those papers that are relevant to the analytical chemist and this necessitates a highly selective approach. There are some areas that have been the subject of many papers with relatively few being of analytical interest. In such cases the reader is referred to appropriate reviews which are detailed in this section.

  3. Femtosecond resolution of soft mode dynamics in structural phase transitions

    NASA Technical Reports Server (NTRS)

    Dougherty, Thomas P.; Wiederrecht, Gary P.; Nelson, Keith A.; Garrett, Mark H.; Jensen, Hans P.; Warde, Cardinal

    1992-01-01

    The microscopic pathway along which ions or molecules in a crystal move during structural phase transition can often be described in terms of a collective vibrational mode of the lattice. In many cases, this mode, called a 'soft' phonon mode because of its characteristically low frequency near the phase transition temperature, is difficult to characterize through conventional frequency-domain spectroscopies such as light or neutron scattering. A femtosecond time-domain analog of light-scattering spectroscopy called impulsive stimulated Raman scattering (ISRS) has been used to examine the soft modes of two perovskite ferroelectric crystals. The low-frequency lattice dynamics of KNbO3 and BaTiO3 are clarified in a manner that permits critical evaluation of microscopic models for their ferroelectric transitions. The results illustrate the advantages of ISRS over conventional Raman spectroscopy of low-frequency, heavily damped soft modes.

  4. Applications of absorption spectroscopy using quantum cascade lasers.

    PubMed

    Zhang, Lizhu; Tian, Guang; Li, Jingsong; Yu, Benli

    2014-01-01

    Infrared laser absorption spectroscopy (LAS) is a promising modern technique for sensing trace gases with high sensitivity, selectivity, and high time resolution. Mid-infrared quantum cascade lasers, operating in a pulsed or continuous wave mode, have potential as spectroscopic sources because of their narrow linewidths, single mode operation, tunability, high output power, reliability, low power consumption, and compactness. This paper reviews some important developments in modern laser absorption spectroscopy based on the use of quantum cascade laser (QCL) sources. Among the various laser spectroscopic methods, this review is focused on selected absorption spectroscopy applications of QCLs, with particular emphasis on molecular spectroscopy, industrial process control, combustion diagnostics, and medical breath analysis.

  5. Correlation between fusogenicity of synthetic modified peptides corresponding to the NH2-terminal extremity of simian immunodeficiency virus gp32 and their mode of insertion into the lipid bilayer: an infrared spectroscopy study.

    PubMed Central

    Martin, I; Dubois, M C; Defrise-Quertain, F; Saermark, T; Burny, A; Brasseur, R; Ruysschaert, J M

    1994-01-01

    The amino-terminal extremity of the simian immunodeficiency virus (SIV) transmembrane protein (gp32) has been shown to play a pivotal role in cell-virus fusion and syncytium formation. We provide here evidence of a correlation between the structure and orientation of the modified SIV fusion peptide after insertion into the lipid membrane and its fusogenic activity. The sequence of the wild-type SIV peptide has been modified in such a way that the calculated angles of insertion correspond to an oblique, parallel, or normal orientation with respect to the lipid-water interface. Fourier transform infrared spectroscopy was used to gain experimental informations about the structures and orientations, of the membrane-inserted peptides with respect to the lipid acyl chains. The peptides adopt mainly a beta-sheet conformation in the absence of lipids. After interaction with large unilamellar liposomes, this beta sheet is partly converted into alpha helix. The ability of the modified peptides to promote lipid mixing was assessed by a fluorescence energy transfer assay. The data provide evidence that alpha-helix formation is not sufficient to induce lipid mixing and that the fusogenic activity of the peptide depends on its orientation in the lipid bilayer. PMID:8289343

  6. Laser Spectroscopy

    NASA Astrophysics Data System (ADS)

    Hollberg, Leo; Bergquist, James Charles; Kasevich, Mark A.

    2008-04-01

    Degenerate gases. Probing vortex pair sizes in the Berezinskii-Kosterlitz-Thouless regime on a two-dimensional lattice of Bose-Einstein condensates / V. Schweikhard ... [et al.]. Interacting Bose-Einstein condensates in random potentials / P. Bouyer ... [et al.]. Towards quantum magnetism with ultracold atoms in optical lattices / I. Bloch -- Precision measurement and fundamental physics. T-violation and the search for a permanent electric dipole moment of the mercury atom / E. N. Fortson -- Quantum information and control I. Quantum information processing and ramsey spectroscopy with trapped ions / C. F. Roos ... [et al.]. Quantum non-demolition counting of photons in a cavity / S. Haroche ... [et al.] -- Ultra-fast control and spectroscopy. Frequency-Comb- assisted mid-infrared spectroscopy / P. de Natale ... [et al.] -- Precision measurement and applications. Precision gravity tests by atom interferometry / G. M. Tino ... [et al.] -- Novel spectroscopic applications. On a variation of the proton-electron mass ratio / W. Ubachs ... [et al.] -- Quantum information and control II. Quantum interface between light and atomic ensembles / H. Krauter ... [et al.] -- Degenerate Fermi gases. An atomic Fermi gas near a P-wave Feshbach resonance / D. S. Jin, J. P. Gaebler and J. T. Stewart. Bragg scattering of correlated atoms from a degenerate Fermi gas / R. J. Ballagh, K. J. Challis and C. W. Gardiner -- Spectroscopy and control of atoms and molecules. Stark and Zeeman deceleration of neutral atoms and molecules / S. D. Hogan ... [et al.]. Generation of coherent, broadband and tunable soft x-ray continuum at the leading edge of the driver laser pulse / A. Jullien ... [et al.]. Controlling neural atoms and photons with optical conveyor belts and ultrathin optical fibers / D. Meschede. W. Alt and A. Rauschenbeutel -- Spectroscopy on the small scale. Wide-field cars-microscopy / C. Heinrich ... [et al.]. Atom nano-optics and nano-lithography / V. I. Balykin ... [et al

  7. Solvent effects on the a sub g C double bond C stretching mode in the 2 sup 1 A sub g sup minus excited state of. beta. -carotene and two derivatives: Picosecond time-resolved resonance Raman spectroscopy

    SciTech Connect

    Noguchi, T.; Hayashi, H. Univ. of Tokyo ); Tasumi, M. ); Atkinson, G.H. Hebrew Univ., Jerusalem )

    1991-04-18

    Picosecond time-resolved resonance Raman spectra in the C{double bond}C stretching region are presented for {beta}-carotene and two of its derivatives, {beta}-apo-8{prime}-carotenal and ethyl {beta}-apo-8{prime}-carotenoate. The solvent effects on the Franck-Condon-active a{sub g} C{double bond}C stretching mode in the {sup 1}A{sub g}{sup {minus}} ground state (S{sub 0}) and the 2{sup 1}A{sub g}{sup {minus}} excited state (S{sub 1}) of each carotenoid are described. The C{double bond}C stretching frequencies in S{sub 1} are affected by the solvent and show a correlation with the absorption maxima of the S{sub 2} ({sup 1}B{sub u}{sup +}) {l arrow} S{sub 0} transition, while those in S{sub 0} are not significantly affected. These results are interpreted in terms of the vibronic coupling among the S{sub 0}, S{sub 1}, and S{sub 2} electronic states, the solvent effect on the energy of the S{sub 1} and S{sub 2} states, and the structures of carotenoid molecules.

  8. Experimental optical-spectroscopy study of: (a) The liquid-glass transition in glycerol. A mode coupling theory analysis. (b) Low-frequency light scattering from powders. Multiple scattering model. (c) Side chain intramolecular hydrogen bond interactions in helical peptides

    NASA Astrophysics Data System (ADS)

    Hernandez, Joel

    Depolarized light-scattering spectra of the intermediate glass-former glycerol were obtained in the frequency and temperature ranges of 0.4 to 6000 GHz and 173 to 413 K respectively. Analysis of the resulting susceptibility spectra using the asymptotic leading order equations of mode coupling theory (MCT) showed only partial agreement between theory and experiment. However, a recent analysis of our data using a full numerical solution of the MCT equations has been remarkably successful, widening the applicability of the theory to weak network glass-formers and motivating the need to conduct similar tests with strong network glass-formers. The accidental discovery of a low-frequency band in the light scattering spectrum from a powder of the protein lysozyme lead us to the development of a model for that kind of scattering. Such a model was found to be in very good agreement with our experimental data. A preliminary infrared absorption experiment on synthesized helical peptides, containing glutamic acid (Glu) amino acid residues spaced periodically along the polypeptide chain, showed evidence for the stabilization of the helical structure of the peptide, by intramolecular hydrogen bonding interactions between the carboxylic acid groups in the side chains of the Glu residues.

  9. Photothermal spectroscopy of aerosols

    SciTech Connect

    Campillo, A.J.; Lin, H.B.

    1981-04-01

    In situ aerosol absorption spectroscopy was performed using two novel photothermal detection schemes. The first, based on a photorefractive effect and coherent detection, called phase fluctuation optical heterodyne (PFLOH) spectroscopy, could, depending on the geometry employed, yield particle specific or particle and gas absorption data. Single particles of graphite as small as 1 ..mu..m were detected in the particle specific mode. In another geometrical configuration, the total absorption (both gas and particle) of submicron sized aerosols of ammonium sulfate particles in equilibrium with gaseous ammonia and water vapor were measured at varying CO/sub 2/ laser frequencies. The specific absorption coefficient for the sulfate ion was measured to be 0.5 m/sup 2//g at 1087 cm/sup -1/. The absorption coefficient sensitivity of this scheme was less than or equal to 10/sup -8/ cm/sup -1/. The second scheme is a hybrid visible Mie scattering scheme incorporating photothermal modulation. Particle specific data on ammonium sulfate droplets were obtained. For chemically identical species, the relative absorption spectrum versus laser frequency can be obtained for polydisperse aerosol distributions directly from the data without the need for complex inverse scattering calculations.

  10. Tuning vibrational mode localization with frequency windowing

    NASA Astrophysics Data System (ADS)

    Cheng, Xiaolu; Talbot, Justin J.; Steele, Ryan P.

    2016-09-01

    Local-mode coordinates have previously been shown to be an effective starting point for anharmonic vibrational spectroscopy calculations. This general approach borrows techniques from localized-orbital machinery in electronic structure theory and generates a new set of spatially localized vibrational modes. These modes exhibit a well-behaved spatial decay of anharmonic mode couplings, which, in turn, allows for a systematic, a priori truncation of couplings and increased computational efficiency. Fully localized modes, however, have been found to lead to unintuitive mixtures of characteristic motions, such as stretches and bends, and accordingly large bilinear couplings. In this work, a very simple, tunable localization frequency window is introduced, in order to realize the transition from normal modes to fully localized modes. Partial localization can be achieved by localizing only pairs of modes within this traveling frequency window, which allows for intuitive interpretation of modes. The optimal window size is suggested to be a few hundreds of wave numbers, based on small- to medium-sized test systems, including water clusters and polypeptides. The new sets of partially localized coordinates retain their spatial coupling decay behavior while providing a reduced number of potential energy evaluations for convergence of anharmonic spectra.

  11. Vibrational Spectroscopy and Quantum Localization

    NASA Astrophysics Data System (ADS)

    Fillaux, François

    These lecture-notes are meant to provide newcomers with an overview of the impact of vibrational spectroscopy in the field of nonlinear dynamics of atoms and molecules, in the perspective of energy localization. In the introduction, the terminology of nonlinear excitations and tentative experimental evidences are briefly recalled in a brief historical perspective. The basic principles of vibrational spectroscopy are presented in section 11 for infrared, Raman and inelastic neutron scattering. The potentialities for each technique to probing energy localization are discussed. In section 12, nonlinear dynamics in isolated molecules are treated within the framework of normal versus local mode representations. It is shown that these complementary representations are not necessarily distinctive of weak versus strong anharmonicity, in the context of chemical complexity. It is emphasized that local modes and energy localization are totally independent concepts. In section 4, examples of nonlinear dynamics in crystals are reviewed: multiphonon bound states, strong coupling between phonons and electrons probed with resonance Raman, local modes and quantum rotation in one-dimension probed with inelastic neutron scattering, strong coupling in hydrogen-bonded crystals and self-trapping probed with time-resolved vibrational-spectroscopy. The extended character of eigenstates in crystals free of impurities and disorder, the nature of the interaction of periodic lattices with plane waves, the Franck-Condon principle and the particle-wave duality in the quantum regime are key factors preventing observation of energy localization. It is shown that free spatially-localized nondissipative classical waves give rise to free pseudoparticles that behave as planar waves in the quantum regime. In conclusion, a clear demonstration that energy localization corresponds to eigenstates is eagerly expected for further evidencing these states with vibrational spectroscopy.

  12. Free electron laser mode dynamics

    NASA Astrophysics Data System (ADS)

    Kan, Shidong

    The University of Hawai'i at Manoa (UHM) Fox-Smith project opens a door for great research opportunities to the fields of high resolution infrared laser spectroscopy, quantum optics, coherent x-ray production and new and fundamental applications of phase-locked pulse trains and coherent frequency combs. An understanding of FEL mode dynamics is essential for facilitating this multimirror laser cavity design and improving laser performance for applications. Of particular interest is the nonlinear mode competition and mode evolution in the time domain which can give insight understanding of FELs' mode spectrum evolution. In this dissertation, I report the first thorough investigation and analysis of the nonlinear mode competition and mode evolution from the small signal regime through deep saturation using a time domain full particle simulation code based on the fundamental FEL equations of motion. It is found that the passive eigenmode theory of multimirror resonator FEL is not fully applicable in the large signal saturated regime. Extreme mode competition at the midpoint-phase offset versus beamsplitter reflectance indicating enhanced single mode operation is also discovered. In addition, matrix analysis including the proper form of the FEL gain saturation and the phase of the complex gain is also performed. This dissertation, for the first time known to the author, proposes a Michelson configuration which couples every third pulse. The feasibility and performance of the proposed configuration is elaborately investigated. An experimental design for evaluating the extreme mode competition effect discovered during the course of this dissertation research is described, based on the Mark V FEL in the current Michelson and the proposed new Michelson configurations. Finally, I report the construction and calibration of a Fox-Smith beamsplitter using a rotatable birefringent sapphire plate. High assembly precision is achieved. The angular beam wander caused by the rotation

  13. Inelastic electron tunneling spectroscopy in molecular junctions showing quantum interference

    NASA Astrophysics Data System (ADS)

    Salhani, C.; Della Rocca, M. L.; Bessis, C.; Bonnet, R.; Barraud, C.; Lafarge, P.; Chevillot, A.; Martin, P.; Lacroix, J.-C.

    2017-04-01

    Destructive quantum interference effect is implemented in large area molecular junctions to improve signatures of electron-phonon interaction. Vertical molecular junctions based on a cross-conjugated anthraquinone layer were fabricated and low-noise transport measurements were performed by acquiring simultaneously the current-voltage characteristics, its second derivative, and the differential conductance. Signatures of vibrational modes excited by inelastic events are present in the whole measured voltage range and superpose to the conductance suppression induced by destructive quantum interference. As a consequence vibrational modes have improved visibility in the low energy window (<80 meV ). Inelastic electron transport spectroscopy data are compared to infrared attenuated total reflection spectroscopy on Au/anthraquinone thin films. Common vibrational modes can be clearly identified, but inelastic electron tunneling spectroscopy reveals the existence of vibrational modes in a wider energy range (0 -400 meV ) where infrared spectroscopy is lacking.

  14. Single particle plasmon spectroscopy of silver nanowires and gold nanorods.

    PubMed

    N'Gom, Moussa; Ringnalda, Jan; Mansfield, John F; Agarwal, Ashish; Kotov, Nicholas; Zaluzec, Nestor J; Norris, Theodore B

    2008-10-01

    The excitation of surface plasmons in individual silver nanowires and gold nanorods is investigated by means of high-resolution electron energy loss spectroscopy in a transmission electron microscope. The transverse and longitudinal modes of these nanostructures are resolved, and the size variation of the plasmon peaks is studied. The effect of electromagnetic coupling between closely spaced nanoparticles is also observed. Finally, the relation between energy-loss measurements and optical spectroscopy of nanoparticle plasmon modes is discussed.

  15. Laser spectroscopy 9

    SciTech Connect

    Feld, M.S. . Dept. of Physics); Thomas, J.E. . Dept. of Physics); Mooradian, A. . Lincoln Lab.)

    1989-01-01

    This book covers subjects under the following headings: New cooling mechanisms; Laser spectroscopy; Cavity Qed; Noise and coherence; Quantum size effects; Surface spectroscopy; Laser light sources; Trapped ion spectroscopy; and Fundamental measurements.

  16. A la Mode II.

    ERIC Educational Resources Information Center

    Stowe, Richard A.

    This paper describes two modes of educational decision-making: Mode I, in which the instructor makes such decisions as what to teach, to whom, when, in what order, at what pace, and at what complexity level; and Mode II, in which the learner makes the decisions. While Mode I comprises most of what is regarded as formal education, the learner in…

  17. List mode multichannel analyzer

    DOEpatents

    Archer, Daniel E.; Luke, S. John; Mauger, G. Joseph; Riot, Vincent J.; Knapp, David A.

    2007-08-07

    A digital list mode multichannel analyzer (MCA) built around a programmable FPGA device for onboard data analysis and on-the-fly modification of system detection/operating parameters, and capable of collecting and processing data in very small time bins (<1 millisecond) when used in histogramming mode, or in list mode as a list mode MCA.

  18. Amateur spectroscopy

    NASA Astrophysics Data System (ADS)

    Gavin, M. V.

    1998-06-01

    (The 1997 Presidential Address to the British Astronomical Association.) Auguste Comte is remembered for an unfortunate remark. In 1825 he said the chemical composition of stars would never be revealed. Within a decade or so the heart of the atom was being explored in remote stars through the science of spectroscopy. In simplistic terms one can regard the atom as a miniature solar system, but with the novel option that electrons (representing planets) having the ability to 'jump' from one orbit to another. In 'falling' to a lower orbit a photon of light of precise wavelength is released to travel outwards. When the electron 'jumps' to a higher orbit a photon of light is absorbed. This is taking place on a vast scale which we observe as lines in the spectrum - their position and prominence relates to the particular atomic element, temperature and pressure within the stellar atmosphere. It is beyond the scope of this Address to discuss the various processes that affect spectra, or to provide a mathematical explanation which can be found elsewhere. In any case the lack of a deep understanding does not preclude enjoyable or useful observations. Methods and results from amateurs conducting such observations are discussed in this paper.

  19. SIMP spectroscopy

    NASA Astrophysics Data System (ADS)

    Hochberg, Yonit; Kuflik, Eric; Murayama, Hitoshi

    2016-05-01

    We study the interactions between strongly interacting massive particle dark matter and the Standard Model via a massive vector boson that is kinetically mixed with the hypercharge gauge boson. The relic abundance is set by 3 → 2 self-interactions of the dark matter, while the interactions with the vector mediator enable kinetic equilibrium between the dark and visible sectors. We show that a wide range of parameters is phenomenologically viable and can be probed in various ways. Astrophysical and cosmological constraints are evaded due to the p-wave nature of dark matter annihilation into visible particles, while direct detection methods using electron recoils can be sensitive to parts of the parameter space. In addition, we propose performing spectroscopy of the strongly coupled dark sector at e + e - colliders, where the energy of a mono-photon can track the resonance structure of the dark sector. Alternatively, some resonances may decay back into Standard Model leptons or jets, realizing `hidden valley' phenomenology at the LHC and ILC in a concrete fashion.

  20. Black hole spectroscopy via adiabatic invariant in a quantum corrected spacetime

    NASA Astrophysics Data System (ADS)

    Liu, Cheng-Zhou

    2012-05-01

    Using the modified Kunstatter method, which employs as proper frequency the imaginary part instead of the real part of the quasinormal modes, the entropy spectrum and area spectrum of the modified Schwarzschild black holes in gravity's rainbow are investigated. In the current study, two cases of modified dispersion relations concerning energy dependent and energy independent speed of light are considered. The entropy spectra with equal spacing are derived in these two cases. Furthermore, the obtained entropy spectra are independent of the energy of a test particle and are the same as the one of the usual Schwarzschild black hole. Also, the same area spectrum formulas are obtained in these different dispersion relations. However, due to the quantum effect of spacetime, the obtained area spectra are not equally spaced and are different from the one of the usual Schwarzschild black hole. Besides, in these two cases, the same black hole entropy formulas with logarithmic correction to the standard Bekenstein-Hawking area formula are obtained by the adiabatic invariant. The form of area spacing formulas and entropy formulas are independent of the particle's energy, but the area spacing and entropy can have energy dependence through the area.

  1. Raman spectroscopy of thin films

    NASA Astrophysics Data System (ADS)

    Burgess, James Shaw

    Raman spectroscopy was used in conjunction with x-ray diffraction and x-ray photoelectron spectroscopy to elucidate structural and compositional information on a variety of samples. Raman was used on the unique La 2NiMnO6 mixed double perovskite which is a member of the LaMnO3 family of perovskites and has multiferroic properties. Raman was also used on nanodiamond films as well as some boron-doped carbon compounds. Finally, Raman was used to identify metal-dendrimer bonds that have previously been overlooked. Vibrational modes for La2NiMnO6 were ascribed by comparing spectra with that for LaMnO3 bulk and thin film spectra. The two most prominent modes were labeled as an asymmetric stretch (A g) centered around 535 cm-1 and a symmetric stretch (B g) centered around 678 cm. The heteroepitaxial quality of La2NiMnO 6 films on SrTiO3 (100) and LaAlO3 (100) substrates were examined using the Raman microscope by way of depth profile experiments and by varying the thickness of the films. It was found that thin films (10 nm) had much greater strain on the LaAlO3 substrate than on the SrTiO3 substrate by examining the shifts of the Ag and the Bg modes from their bulk positions. Changes in the unit cell owing to the presence of oxygen defects were also monitored using Raman spectroscopy. It was found that the Ag and Bg modes shifted between samples formed with different oxygen partial pressures. These shifts could be correlated to changes in the symmetry of the manganese centers due to oxygen defects. Raman spectroscopy was used to examine the structural and compositional characteristics of carbon materials. Nanocrystalline diamond coated cutting tools were examined using the Raman Microscope. Impact, abrasion, and depth profile experiments indicated that delamination was the primary cause of film failure in these systems. Boron doped material of interest as catalyst supports were also examined. Monitoring of the G-mode and intensities of the D- and G-modes indicated that

  2. Visualizing Infrared (IR) Spectroscopy with Computer Animation

    NASA Technical Reports Server (NTRS)

    Abrams, Charles B.; Fine, Leonard W.

    1996-01-01

    IR Tutor, an interactive, animated infrared (IR) spectroscopy tutorial has been developed for Macintosh and IBM-compatible computers. Using unique color animation, complicated vibrational modes can be introduced to beginning students. Rules governing the appearance of IR absorption bands become obvious because the vibrational modes can be visualized. Each peak in the IR spectrum is highlighted, and the animation of the corresponding normal mode can be shown. Students can study each spectrum stepwise, or click on any individual peak to see its assignment. Important regions of each spectrum can be expanded and spectra can be overlaid for comparison. An introduction to the theory of IR spectroscopy is included, making the program a complete instructional package. Our own success in using this software for teaching and research in both academic and industrial environments will be described. IR Tutor consists of three sections: (1) The 'Introduction' is a review of basic principles of spectroscopy. (2) 'Theory' begins with the classical model of a simple diatomic molecule and is expanded to include larger molecules by introducing normal modes and group frequencies. (3) 'Interpretation' is the heart of the tutorial. Thirteen IR spectra are analyzed in detail, covering the most important functional groups. This section features color animation of each normal mode, full interactivity, overlay of related spectra, and expansion of important regions. This section can also be used as a reference.

  3. Visualizing Infrared (IR) Spectroscopy with Computer Animation

    NASA Technical Reports Server (NTRS)

    Abrams, Charles B.; Fine, Leonard W.

    1996-01-01

    IR Tutor, an interactive, animated infrared (IR) spectroscopy tutorial has been developed for Macintosh and IBM-compatible computers. Using unique color animation, complicated vibrational modes can be introduced to beginning students. Rules governing the appearance of IR absorption bands become obvious because the vibrational modes can be visualized. Each peak in the IR spectrum is highlighted, and the animation of the corresponding normal mode can be shown. Students can study each spectrum stepwise, or click on any individual peak to see its assignment. Important regions of each spectrum can be expanded and spectra can be overlaid for comparison. An introduction to the theory of IR spectroscopy is included, making the program a complete instructional package. Our own success in using this software for teaching and research in both academic and industrial environments will be described. IR Tutor consists of three sections: (1) The 'Introduction' is a review of basic principles of spectroscopy. (2) 'Theory' begins with the classical model of a simple diatomic molecule and is expanded to include larger molecules by introducing normal modes and group frequencies. (3) 'Interpretation' is the heart of the tutorial. Thirteen IR spectra are analyzed in detail, covering the most important functional groups. This section features color animation of each normal mode, full interactivity, overlay of related spectra, and expansion of important regions. This section can also be used as a reference.

  4. Spectroscopy of the Heaviest Elements

    NASA Astrophysics Data System (ADS)

    Clark, Roderick

    2009-10-01

    The specific ``magic'' proton and neutron numbers, representing major spherical shell gaps, beyond 208Pb are a matter of considerable debate. It is well established that nuclei near Z=100, N=152 (252Fm) have well-deformed prolate shapes. By performing prompt and delayed gamma-ray spectroscopy on deformed transfermium nuclei we can learn about the single-particle structure, shell gaps, pairing correlations, and excitation modes in the heaviest nuclei. After a brief overview of state-of-the-art measurements, I will describe recent results from experiments at the 88-Inch Cyclotron of the Lawrence Berkeley National Laboratory which use the Berkeley Gas-filled Separator (BGS). I will then discuss the prospects of a new generation of spectroscopy measurements on the heaviest elements when the BGS is used in conjunction with the GRETINA gamma--ray tracking array.

  5. Evanescent optical fluorescence excitation: the role of photonic mode density

    NASA Astrophysics Data System (ADS)

    Menges, Bernhard; Sato, Akihiro; Knoll, Wolfgang

    2007-04-01

    In this paper we will discuss a few basic concepts concerning the use of evanescent optical fields for the excitation of fluorescent chromophores placed near the interface. The observation of enhanced fluorescence from chromophores excited by surface plasmon and waveguide modes will be presented and discussed. We attribute the enhancement to the near-field interaction between the chromophores and the increased photonic mode density by surface plasmon and waveguide modes. We determined limits of detection (LOD) of DNA hybridisation using the same sensor architecture by surface plasmon fluorescence spectroscopy (SPFS) and optical waveguide fluorescence spectroscopy (OWFS). Both SPFS and OWFS techniques have the same detection principle using an enhanced electromagnetic field to excite fluorophores and make it possible to monitor DNA hybridisation in real-time with high sensitivity. The relative photonic mode density of each mode was calculated under the resonance condition, and these values are reflected in the LOD values.

  6. Terahertz Spectrum Analysis Based on Empirical Mode Decomposition

    NASA Astrophysics Data System (ADS)

    Su, Yunpeng; Zheng, Xiaoping; Deng, Xiaojiao

    2017-08-01

    Precise identification of terahertz absorption peaks for materials with low concentration and high attenuation still remains a challenge. Empirical mode decomposition was applied to terahertz spectrum analysis in order to improve the performance on spectral fingerprints identification. We conducted experiments on water vapor and carbon monoxide respectively with terahertz time domain spectroscopy. By comparing their absorption spectra before and after empirical mode decomposition, we demonstrated that the first-order intrinsic mode function shows absorption peaks clearly in high-frequency range. By comparing the frequency spectra of the sample signals and their intrinsic mode functions, we proved that the first-order function contains most of the original signal's energy and frequency information so that it cannot be left out or replaced by high-order functions in spectral fingerprints detection. Empirical mode decomposition not only acts as an effective supplementary means to terahertz time-domain spectroscopy but also shows great potential in discrimination of materials and prediction of their concentrations.

  7. Analysis of propagation properties of terahertz hollow-optical fiber by using time-domain spectroscopy and application for THz wave remote spectroscopy

    NASA Astrophysics Data System (ADS)

    Ito, K.; Katagiri, T.; Matsuura, Y.

    2017-02-01

    Terahertz pulse propagation in hollow optical fibers is investigated by using terahertz time-domain spectroscopy. From evaluation of transmission loss spectra of hollow optical fiber, it is found that TM11 mode propagates as well as TE11 mode that is the lowest order mode in terahertz metal-hollow fiber. Short-time Fourier transform is also applied for investigation of mode properties and as a result, it is confirmed that the interference peaks in the loss spectra are due to mode mixing in hollow optical fibers. Finally we performed a terahertz wave remote spectroscopy using the hollow optical fiber and acquired a clear transmission spectrum of the theophylline.

  8. Chiroptical Spectroscopy

    NASA Astrophysics Data System (ADS)

    Gurst, Jerome E.

    1995-09-01

    A brief review of the literature, and Chemical and Engineering News in particular, reveals that the determination and use of optical activity is of increasing importance in today's commercial and research laboratories. The classical technique is to measure [alpha]D using a manual or recording polarimeter to provide a single value, the specific rotation at 589 nm. A spectropolarimeter can be used to determine optical activity through the UV-Visible spectrum (Optical Rotatory Dispersion [ORD]). At wavelengths far removed from electronic absorption bands, optical activity arises from circular birefringence, or the difference in the refractive index for left- and right-circularly polarized light; i.e., nL - nR does not equal zero for chiral materials. If the optical activity is measured through an absorption band, complex behavior is observed (a Cotton Effect curve). At an absorption band, chiral materials exhibit circular dichroism (CD), or a difference in the absorption of left- and right-circularly polarized light; epsilon L minus epsilon R does not equal zero. If the spectropolarimeter is set for the measurement of CD spectra, one observes what appears to be a UV-Vis spectrum except that some absorption bands are positive while others may be negative. Just as enantiomers have specific rotations that are equal and opposite at 589 nm (sodium D line), rotations are equal and opposite at all wavelengths, and CD measurements are equal and opposite at all wavelengths. Figure 1 shows the ORD curves for the enantiomeric carvones while Figure 2 contains the CD curves. The enantiomer of carvone that has the positive [alpha]D is obtained from caraway seeds and is known to have the S-configuration while the R-enantiomer is found in spearmint oil. Figure 1. ORD of S-(+)- and R-(-)-carvones Figure 2. CD of S-(+)- and R-(-)-carvones While little can be done to correlate stereochemistry with [alpha]D values, chiroptical spectroscopy (ORD and/or CD) often can be used to assign

  9. Limiter H-mode experiments on TFTR

    SciTech Connect

    Bush, C.E. ); Bretz, N.L.; Fredrickson, E.D.; McGuire, K.M.; Nazikian, R.; Park, H.K.; Schivell, J.; Taylor, G.; Bitter, M.; Budny, R.; Cohen, S.A.; Kilpatrick, S.J.; LeBlanc, B.; Manos, D.M.; Meade, D.; Paul, S.F.; Scott, S.D.; Stratton, B.C.; Synakowski, E.J.; Towner, H.H.; Wieland, R.M.; Arunasalam, V.; Bateman, G.; Bell, M.G.; Bell, R.; Boivin, R.; Cavallo, A.; Cheng, C.Z.; Chu, T.K.; Co

    1991-05-01

    Limiter H-modes with centrally peaked density profiles have been obtained in TFTR using a highly conditioned graphite limiter. The transition to these centrally peaked H-modes takes place from the supershot to the H-mode rather than the usual L- to H-mode transition observed on other tokamaks. Bidirectional beam heating is required to induce the transition. Density peaking factors, n{sub e}(0)/, greater than 2.3 are obtained and at the same time the H-mode characteristics are similar to those of limiter H-modes on other tokamaks, while the global confinement, {tau}{sub E}, can be >2.5 times L-mode scaling. The transport analysis of the data shows that transport in these H-modes is similar to that of supershots within the inner 0.6 m core of the plasma, but the stored electron energy (calculated using measured values of T{sub e} and n{sub e}) is higher for the H-mode at the plasma edge. Microwave scattering data for the edge plasma shows broad spectra at k = 5.5 cm{sup {minus}1} which begin at the drop in D{sub {alpha}} radiation and are strongly shifted in the electron diamagnetic drift direction. At the same time, beam emission spectroscopy (BES) shows a coherent mode near the boundary which propagates in the ion direction with m = 15--20 at 20--30 kHz. During the ELM event these apparent rotations cease and Mirnov fluctuations in the frequency range of 50--500 kHz increase in intensity. 16 refs., 8 figs.

  10. Large mode radius resonators

    NASA Technical Reports Server (NTRS)

    Harris, Michael R.

    1987-01-01

    Resonator configurations permitting operation with large mode radius while maintaining good transverse mode discrimination are considered. Stable resonators incorporating an intracavity telescope and unstable resonator geometries utilizing an output coupler with a Gaussian reflectivity profile are shown to enable large radius single mode laser operation. Results of heterodyne studies of pulsed CO2 lasers with large (11mm e sup-2 radius) fundamental mode sizes are presented demonstrating minimal frequency sweeping in accordance with the theory of laser-induced medium perturbations.

  11. Few-mode fibers for mode division multiplexing transmission

    NASA Astrophysics Data System (ADS)

    Kubota, Hirokazu; Morioka, Toshio

    2012-01-01

    A study is presented of the fiber properties needed to achieve 10-mode multiplexing transmission. A combination of MIMO processing with optical LP mode separation is proposed to prevent the need for massive MIMO computation. The impact of mode crosstalk, differential mode delay, and the mode dependent loss of the few-mode fibers on mode multiplexing are discussed.

  12. Integrated mode converter for mode division multiplexing

    NASA Astrophysics Data System (ADS)

    Perez-Galacho, Diego; Alonso-Ramos, Carlos Alberto; Marris-Morini, Delphine; Vakarin, Vladyslav; Le Roux, Xavier; Ortega-Moñux, Alejandro; Wangüemert-Perez, Juan Gonzalo; Vivien, Laurent

    2016-05-01

    The ever growing demands of bandwidth in optical communication systems are making traditional Wavelength Division Multiplexing (WDM) based systems to reach its limit. In order to cope with future bandwidth demand is necessary to use new levels of orthogonality, such as the waveguide mode or the polarization state. Mode Division Multiplexing (MDM) has recently attracted attention as a possible solution to increase aggregate bandwidth. In this work we discuss the proposition a of mode converter that can cover the whole C-Band of optical communications. The Mode Converter is based on two Multimode Interference (MMI) couplers and a phase shifter. Insertion loss (IL) below 0.2 dB and Extinction ratio (ER) higher than 20 dB in a broad bandwidth range of 1.5 μm to 1.6 μm have been estimated. The total length of the device is less than 30 μm.

  13. Development of a novel mixed hemimicelles dispersive micro solid phase extraction using 1-hexadecyl-3-methylimidazolium bromide coated magnetic graphene for the separation and preconcentration of fluoxetine in different matrices before its determination by fiber optic linear array spectrophotometry and mode-mismatched thermal lens spectroscopy.

    PubMed

    Kazemi, Elahe; Haji Shabani, Ali Mohammad; Dadfarnia, Shayessteh; Abbasi, Amir; Rashidian Vaziri, Mohammad Reza; Behjat, Abbas

    2016-01-28

    This study aims at developing a novel, sensitive, fast, simple and convenient method for separation and preconcentration of trace amounts of fluoxetine before its spectrophotometric determination. The method is based on combination of magnetic mixed hemimicelles solid phase extraction and dispersive micro solid phase extraction using 1-hexadecyl-3-methylimidazolium bromide coated magnetic graphene as a sorbent. The magnetic graphene was synthesized by a simple coprecipitation method and characterized by X-ray diffraction (XRD), Fourier transform infrared (FT-IR) spectroscopy and scanning electron microscopy (SEM). The retained analyte was eluted using a 100 μL mixture of methanol/acetic acid (9:1) and converted into fluoxetine-β-cyclodextrin inclusion complex. The analyte was then quantified by fiber optic linear array spectrophotometry as well as mode-mismatched thermal lens spectroscopy (TLS). The factors affecting the separation, preconcentration and determination of fluoxetine were investigated and optimized. With a 50 mL sample and under optimized conditions using the spectrophotometry technique, the method exhibited a linear dynamic range of 0.4-60.0 μg L(-1), a detection limit of 0.21 μg L(-1), an enrichment factor of 167, and a relative standard deviation of 2.1% and 3.8% (n = 6) at 60 μg L(-1) level of fluoxetine for intra- and inter-day analyses, respectively. However, with thermal lens spectrometry and a sample volume of 10 mL, the method exhibited a linear dynamic range of 0.05-300 μg L(-1), a detection limit of 0.016 μg L(-1) and a relative standard deviation of 3.8% and 5.6% (n = 6) at 60 μg L(-1) level of fluoxetine for intra- and inter-day analyses, respectively. The method was successfully applied to determine fluoxetine in pharmaceutical formulation, human urine and environmental water samples.

  14. Spectroscopy of the amide-I modes of acetanilide

    SciTech Connect

    Bigio, I.J.; Scott, A.C.; Johnston, C.T.

    1989-01-01

    Raman measurements were made on acetanilide (N-phenyl-acetamide). Data are presented of the integrated intensity of the 1650 cm/sup /minus/1/ band as a function of temperature. The experimental procedures and data reduction were highly rigorous and are believed to be to most reliable data available. A concise theory of polaron states is presented and used to interpret the data. 22 refs., 4 figs., 1 tab.

  15. Neutron Speed Echo Spectroscopy

    NASA Astrophysics Data System (ADS)

    Ioffe, A.

    Neutron speed echo (NSPE) technique is in a way a generalization of the neutron spin echo (NSE) technique. Similar to NSE spectrometers, the resolution of such NSPE spectrometer is extremely high and is not connected with the monochromatization of the incoming beam. However, in contrast to NSE spectrometers, the operation of proposed spectrometer does not necessarily require a polarized neutron beam. Such decoupling the polarization and the resolution is in clear contrast to NSE technique. Because the resolution of a NSPE spectrometer can be a few orders higher than the resolution of NSE spectrometers, one can achieve the energy resolution of about 10-14 eV by the use of ultra cold neutrons; a fact that can be used in some fundamental physics experiments. Though the scattering on the sample impose limitations on the resolution of a NSPE spectrometer, the use of the proposed technique in a low-resolution mode can be useful in the combination with triple-axis spectrometers and allow for the significant improvement of their energy resolution, however, without the use of polarized neutrons. This fact opens new possibilities for the study of magnetic phenomena in solids, where the NSE method is principally not applicable because of the neutron precession in the sample, especially by combining polarization analysis with high-resolution spectroscopy. The proposed technique also allows for an easy implementation of the principle of the NSE focusing, when the resolution ellipse is aligned along a dispersion curve.

  16. Broadband transmission EPR spectroscopy.

    PubMed

    Hagen, Wilfred R

    2013-01-01

    EPR spectroscopy employs a resonator operating at a single microwave frequency and phase-sensitive detection using modulation of the magnetic field. The X-band spectrometer is the general standard with a frequency in the 9-10 GHz range. Most (bio)molecular EPR spectra are determined by a combination of the frequency-dependent electronic Zeeman interaction and a number of frequency-independent interactions, notably, electron spin - nuclear spin interactions and electron spin - electron spin interactions, and unambiguous analysis requires data collection at different frequencies. Extant and long-standing practice is to use a different spectrometer for each frequency. We explore the alternative of replacing the narrow-band source plus single-mode resonator with a continuously tunable microwave source plus a non-resonant coaxial transmission cell in an unmodulated external field. Our source is an arbitrary wave digital signal generator producing an amplitude-modulated sinusoidal microwave in combination with a broadband amplifier for 0.8-2.7 GHz. Theory is developed for coaxial transmission with EPR detection as a function of cell dimensions and materials. We explore examples of a doublet system, a high-spin system, and an integer-spin system. Long, straigth, helical, and helico-toroidal cells are developed and tested with dilute aqueous solutions of spin label hydroxy-tempo. A detection limit of circa 5 µM HO-tempo in water at 800 MHz is obtained for the present setup, and possibilities for future improvement are discussed.

  17. Vibrational spectroscopy in the electron microscope.

    PubMed

    Krivanek, Ondrej L; Lovejoy, Tracy C; Dellby, Niklas; Aoki, Toshihiro; Carpenter, R W; Rez, Peter; Soignard, Emmanuel; Zhu, Jiangtao; Batson, Philip E; Lagos, Maureen J; Egerton, Ray F; Crozier, Peter A

    2014-10-09

    Vibrational spectroscopies using infrared radiation, Raman scattering, neutrons, low-energy electrons and inelastic electron tunnelling are powerful techniques that can analyse bonding arrangements, identify chemical compounds and probe many other important properties of materials. The spatial resolution of these spectroscopies is typically one micrometre or more, although it can reach a few tens of nanometres or even a few ångströms when enhanced by the presence of a sharp metallic tip. If vibrational spectroscopy could be combined with the spatial resolution and flexibility of the transmission electron microscope, it would open up the study of vibrational modes in many different types of nanostructures. Unfortunately, the energy resolution of electron energy loss spectroscopy performed in the electron microscope has until now been too poor to allow such a combination. Recent developments that have improved the attainable energy resolution of electron energy loss spectroscopy in a scanning transmission electron microscope to around ten millielectronvolts now allow vibrational spectroscopy to be carried out in the electron microscope. Here we describe the innovations responsible for the progress, and present examples of applications in inorganic and organic materials, including the detection of hydrogen. We also demonstrate that the vibrational signal has both high- and low-spatial-resolution components, that the first component can be used to map vibrational features at nanometre-level resolution, and that the second component can be used for analysis carried out with the beam positioned just outside the sample--that is, for 'aloof' spectroscopy that largely avoids radiation damage.

  18. Vibrational spectroscopy in the electron microscope

    NASA Astrophysics Data System (ADS)

    Krivanek, Ondrej L.; Lovejoy, Tracy C.; Dellby, Niklas; Aoki, Toshihiro; Carpenter, R. W.; Rez, Peter; Soignard, Emmanuel; Zhu, Jiangtao; Batson, Philip E.; Lagos, Maureen J.; Egerton, Ray F.; Crozier, Peter A.

    2014-10-01

    Vibrational spectroscopies using infrared radiation, Raman scattering, neutrons, low-energy electrons and inelastic electron tunnelling are powerful techniques that can analyse bonding arrangements, identify chemical compounds and probe many other important properties of materials. The spatial resolution of these spectroscopies is typically one micrometre or more, although it can reach a few tens of nanometres or even a few ångströms when enhanced by the presence of a sharp metallic tip. If vibrational spectroscopy could be combined with the spatial resolution and flexibility of the transmission electron microscope, it would open up the study of vibrational modes in many different types of nanostructures. Unfortunately, the energy resolution of electron energy loss spectroscopy performed in the electron microscope has until now been too poor to allow such a combination. Recent developments that have improved the attainable energy resolution of electron energy loss spectroscopy in a scanning transmission electron microscope to around ten millielectronvolts now allow vibrational spectroscopy to be carried out in the electron microscope. Here we describe the innovations responsible for the progress, and present examples of applications in inorganic and organic materials, including the detection of hydrogen. We also demonstrate that the vibrational signal has both high- and low-spatial-resolution components, that the first component can be used to map vibrational features at nanometre-level resolution, and that the second component can be used for analysis carried out with the beam positioned just outside the sample--that is, for `aloof' spectroscopy that largely avoids radiation damage.

  19. Modes of log gravity

    SciTech Connect

    Bergshoeff, Eric A.; Rosseel, Jan; Hohm, Olaf; Townsend, Paul K.

    2011-05-15

    The physical modes of a recently proposed D-dimensional 'critical gravity', linearized about its anti-de Sitter vacuum, are investigated. All 'log mode' solutions, which we categorize as 'spin-2' or 'Proca', arise as limits of the massive spin-2 modes of the noncritical theory. The linearized Einstein tensor of a spin-2 log mode is itself a 'nongauge' solution of the linearized Einstein equations whereas the linearized Einstein tensor of a Proca mode takes the form of a linearized general coordinate transformation. Our results suggest the existence of a holographically dual logarithmic conformal field theory.

  20. Streaming tearing mode

    NASA Technical Reports Server (NTRS)

    Shigeta, M.; Sato, T.; Dasgupta, B.

    1985-01-01

    The magnetohydrodynamic stability of streaming tearing mode is investigated numerically. A bulk plasma flow parallel to the antiparallel magnetic field lines and localized in the neutral sheet excites a streaming tearing mode more strongly than the usual tearing mode, particularly for the wavelength of the order of the neutral sheet width (or smaller), which is stable for the usual tearing mode. Interestingly, examination of the eigenfunctions of the velocity perturbation and the magnetic field perturbation indicates that the streaming tearing mode carries more energy in terms of the kinetic energy rather than the magnetic energy. This suggests that the streaming tearing mode instability can be a more feasible mechanism of plasma acceleration than the usual tearing mode instability.

  1. Mode-dependent vibrational autoionization in aniline

    SciTech Connect

    Raptis, C. A.; Pratt, S. T.

    2000-09-08

    High-resolution photoelectron spectroscopy is used to study the branching ratios for vibrational autoionization of Rydberg states of aniline (C{sub 6}H{sub 5}NH{sub 2}) converging to the ground electronic state of the ion. By using two-color double-resonance excitation, it is possible to prepare autoionizing resonances in which two different vibrational modes are excited. Determination of the vibrational state distribution in the product ion provides information on the relative rates of autoionization for the two modes. It is found that some normal modes appear to be especially effective at promoting vibrational autoionization, while others appear to be completely ineffective. (c) 2000 American Institute of Physics.

  2. Coherent Raman spectroscopy for supersonic flow measurments

    NASA Technical Reports Server (NTRS)

    She, C. Y.

    1986-01-01

    In collaboration with NASA/Langley Research Center, a truly nonintrusive and nonseeding method for measuring supersonic molecular flow parameters was proposed and developed at Colorado State University. The feasibility of this Raman Doppler Velocimetry (RDV), currently operated in a scanning mode, was demonstrated not only in a laboratory environment at Colorado State University, but also in a major wind tunnel at NASA/Langley Research Center. The research progress of the RDV development is summarized. In addition, methods of coherent Rayleigh-Brillouin spectroscopy and single-pulse coherent Raman spectroscopy are investigated, respectively, for measurements of high-pressure and turbulent flows.

  3. Single-Mode VCSELs

    NASA Astrophysics Data System (ADS)

    Larsson, Anders; Gustavsson, Johan S.

    The only active transverse mode in a truly single-mode VCSEL is the fundamental mode with a near Gaussian field distribution. A single-mode VCSEL produces a light beam of higher spectral purity, higher degree of coherence and lower divergence than a multimode VCSEL and the beam can be more precisely shaped and focused to a smaller spot. Such beam properties are required in many applications. In this chapter, after discussing applications of single-mode VCSELs, we introduce the basics of fields and modes in VCSELs and review designs implemented for single-mode emission from VCSELs in different materials and at different wavelengths. This includes VCSELs that are inherently single-mode as well as inherently multimode VCSELs where higher-order modes are suppressed by mode selective gain or loss. In each case we present the current state-of-the-art and discuss pros and cons. At the end, a specific example with experimental results is provided and, as a summary, the most promising designs based on current technologies are identified.

  4. Modulated orientation sensitive terahertz spectroscopy

    NASA Astrophysics Data System (ADS)

    Singh, Rohit

    The energies of protein correlated motions lie in the far infrared or THz frequency range (lambda = 1 cm -- 50 mm, f = 0.03 -- 6 THz). The existence of correlated motions has been confirmed by neutron and inelastic x-ray scattering measurements. These techniques require large sample volumes and specialized facilities, limiting their application to systematic studies of changes in correlated motions with functional state and allosteric interactions. Standard terahertz time domain spectroscopy measurements have shown sensitivity to protein-ligand binding, oxidation state, conformation, temperature and hydration. However, the response is broad, in part from the large vibrational density of states and in part from the dielectric response contribution from surface water and side-chains. As an overall strategy to measure the correlated structural motions in protein, we use anisotropic and birefringent behavior of molecular crystals to develop a new technique called MOSTS (Modulated Orientation Sensitive Terahertz Spectroscopy). We achieve high sensitivity and mode separation, by using single molecular crystal such as sucrose and oxalic acid, and rapid modulation of the relative alignment of the terahertz polarization and the crystal axes by rotating the sample. By locking into the signal at the rotation frequency, we determine the polarization sensitive signal and map out the optically active vibrational resonances. To illustrate the technique, we compare our measured spectra with the calculated, and find a close agreement. We measure dielectric properties of oxalic acid, sucrose and protein crystals and polycarbonate sheet using standard terahertz time domain spectroscopy. We determine the absorbances in oxalic acid and sucrose crystals, using MOSTS technique. We compare the resonances in these two distinct methods. Then, we develop a protein model sample by sticking together two thin plates of sucrose and polycarbonate. We carry out standard THz-TDS and MOSTS

  5. Fourier Transform Infrared Spectroscopy and Photoacoustic Spectroscopy for Saliva Analysis.

    PubMed

    Mikkonen, Jopi J W; Raittila, Jussi; Rieppo, Lassi; Lappalainen, Reijo; Kullaa, Arja M; Myllymaa, Sami

    2016-09-01

    Saliva provides a valuable tool for assessing oral and systemic diseases, but concentrations of salivary components are very small, calling the need for precise analysis methods. In this work, Fourier transform infrared (FT-IR) spectroscopy using transmission and photoacoustic (PA) modes were compared for quantitative analysis of saliva. The performance of these techniques was compared with a calibration series. The linearity of spectrum output was verified by using albumin-thiocyanate (SCN(-)) solution at different SCN(-) concentrations. Saliva samples used as a comparison were obtained from healthy subjects. Saliva droplets of 15 µL were applied on the silicon sample substrate, 6 drops for each specimen, and dried at 37 ℃ overnight. The measurements were carried out using an FT-IR spectrometer in conjunction with an accessory unit for PA measurements. The findings with both transmission and PA modes mirror each other. The major bands presented were 1500-1750 cm(-1) for proteins and 1050-1200 cm(-1) for carbohydrates. In addition, the distinct spectral band at 2050 cm(-1) derives from SCN(-) anions, which is converted by salivary peroxidases to hypothiocyanate (OSCN(-)). The correlation between the spectroscopic data with SCN(-) concentration (r > 0.990 for transmission and r = 0.967 for PA mode) was found to be significant (P < 0.01), thus promising to be utilized in future applications. © The Author(s) 2016.

  6. Heterodyne laser spectroscopy system

    DOEpatents

    Wyeth, Richard W.; Paisner, Jeffrey A.; Story, Thomas

    1989-01-01

    A heterodyne laser spectroscopy system utilizes laser heterodyne techniques for purposes of laser isotope separation spectroscopy, vapor diagnostics, processing of precise laser frequency offsets from a reference frequency and the like, and provides spectral analysis of a laser beam.

  7. Heterodyne laser spectroscopy system

    DOEpatents

    Wyeth, Richard W.; Paisner, Jeffrey A.; Story, Thomas

    1990-01-01

    A heterodyne laser spectroscopy system utilizes laser heterodyne techniques for purposes of laser isotope separation spectroscopy, vapor diagnostics, processing of precise laser frequency offsets from a reference frequency, and provides spectral analysis of a laser beam.

  8. Ordinary electromagnetic mode instability

    NASA Technical Reports Server (NTRS)

    Cheng, C. Z.

    1974-01-01

    The instability of the ordinary electromagnetic mode propagating perpendicular to an external magnetic field is studied for a single-species plasma with ring velocity distribution. The marginal instability boundaries for both the purely growing mode and the propagating growing modes are calculated from the instability criteria. The dispersion characteristics for various sets of plasma parameters are also given. The typical growth rates are of the order of the cyclotron frequency.

  9. Time-resolved orbital angular momentum spectroscopy

    SciTech Connect

    Noyan, Mehmet A.; Kikkawa, James M.

    2015-07-20

    We introduce pump-probe magneto-orbital spectroscopy, wherein Laguerre-Gauss optical pump pulses impart orbital angular momentum to the electronic states of a material and subsequent dynamics are studied with 100 fs time resolution. The excitation uses vortex modes that distribute angular momentum over a macroscopic area determined by the spot size, and the optical probe studies the chiral imbalance of vortex modes reflected off the sample. First observations in bulk GaAs yield transients that evolve on time scales distinctly different from population and spin relaxation, as expected, but with surprisingly large lifetimes.

  10. Vibrational spectroscopy standoff detection of threat chemicals

    NASA Astrophysics Data System (ADS)

    Ortiz-Rivera, William; Pacheco-Londoño, Leonardo C.; Castro-Suarez, John R.; Felix-Rivera, Hilsamar; Hernandez-Rivera, Samuel P.

    2011-06-01

    Spectroscopy based standoff detection systems: Raman and FTIR have been tested for detection of threat chemicals, including highly energetic materials, homemade explosives, explosives formulations and high explosives mixtures. Other threat chemicals studied included toxic industrial compounds (TIC) and chemical agent simulants. Microorganisms and biological threat agent simulants have also been detected at standoff distances. Open Path FTIR has been used to detect vapors and chemicals deposited on metal surfaces at μg/cm2 levels at distances as far as 30 m in active mode and 60 m in passive mode. In the case of Raman telescope, standoff distances for acetonitrile and ammonium nitrate were 140 m.

  11. Dual-Mode Combustor

    NASA Technical Reports Server (NTRS)

    Trefny, Charles J (Inventor); Dippold, Vance F (Inventor)

    2013-01-01

    A new dual-mode ramjet combustor used for operation over a wide flight Mach number range is described. Subsonic combustion mode is usable to lower flight Mach numbers than current dual-mode scramjets. High speed mode is characterized by supersonic combustion in a free-jet that traverses the subsonic combustion chamber to a variable nozzle throat. Although a variable combustor exit aperture is required, the need for fuel staging to accommodate the combustion process is eliminated. Local heating from shock-boundary-layer interactions on combustor walls is also eliminated.

  12. Asymmetric Bessel modes.

    PubMed

    Kotlyar, V V; Kovalev, A A; Soifer, V A

    2014-04-15

    We propose a new, three-parameter family of diffraction-free asymmetric elegant Bessel modes (aB-modes) with an integer and fractional orbital angular momentum (OAM). The aB-modes are described by the nth-order Bessel function of the first kind with complex argument. The asymmetry degree of the nonparaxial aB-mode is shown to depend on a real parameter c≥0: when c=0, the aB-mode is identical to a conventional radially symmetric Bessel mode; with increasing c, the aB-mode starts to acquire a crescent form, getting stretched along the vertical axis and shifted along the horizontal axis for c≫1. On the horizontal axis, the aB-modes have a denumerable number of isolated intensity zeros that generate optical vortices with a unit topological charge of opposite sign on opposite sides of 0. At different values of the parameter c, the intensity zeros change their location on the horizontal axis, thus changing the beam's OAM. An isolated intensity zero on the optical axis generates an optical vortex with topological charge n. The OAM per photon of an aB-mode depends near-linearly on c, being equal to ℏ(n+cI1(2c)/I0(2c)), where ℏ is the Planck constant and In(x) is a modified Bessel function.

  13. SAMPEX special pointing mode

    NASA Technical Reports Server (NTRS)

    Markley, F. Landis; Flatley, Thomas W.; Leoutsakos, Theodore

    1995-01-01

    A new pointing mode has been developed for the Solar, Anomalous, and Magnetospheric Particle Explorer (SAMPEX) spacecraft. This pointing mode orients the instrument boresights perpendicular to the field lines of the Earth's magnetic field in regions of low field strength and parallel to the field lines in regions of high field strength, to allow better characterization of heavy ions trapped by the field. The new mode uses magnetometer signals and is algorithmically simpler than the previous control mode, but it requires increased momentum wheel activity. It was conceived, designed, tested, coded, uplinked to the spacecraft, and activated in less than seven months.

  14. Optical diagnosis of cervical cancer by intrinsic mode functions

    NASA Astrophysics Data System (ADS)

    Mukhopadhyay, Sabyasachi; Pratiher, Sawon; Pratiher, Souvik; Pradhan, Asima; Ghosh, Nirmalya; Panigrahi, Prasanta K.

    2017-03-01

    In this paper, we make use of the empirical mode decomposition (EMD) to discriminate the cervical cancer tissues from normal ones based on elastic scattering spectroscopy. The phase space has been reconstructed through decomposing the optical signal into a finite set of bandlimited signals known as intrinsic mode functions (IMFs). It has been shown that the area measure of the analytic IMFs provides a good discrimination performance. Simulation results validate the efficacy of the IMFs followed by SVM based classification.

  15. Atomic vapor spectroscopy in integrated photonic structures

    SciTech Connect

    Ritter, Ralf; Kübler, Harald; Pfau, Tilman; Löw, Robert; Gruhler, Nico; Pernice, Wolfram

    2015-07-27

    We investigate an integrated optical chip immersed in atomic vapor providing several waveguide geometries for spectroscopy applications. The narrow-band transmission through a silicon nitride waveguide and interferometer is altered when the guided light is coupled to a vapor of rubidium atoms via the evanescent tail of the waveguide mode. We use grating couplers to couple between the waveguide mode and the radiating wave, which allow for addressing arbitrary coupling positions on the chip surface. The evanescent atom-light interaction can be numerically simulated and shows excellent agreement with our experimental data. This work demonstrates a next step towards miniaturization and integration of alkali atom spectroscopy and provides a platform for further fundamental studies of complex waveguide structures.

  16. Raman spectroscopy of newberyite, hannayite and struvite

    NASA Astrophysics Data System (ADS)

    Frost, Ray L.; Weier, Matt L.; Martens, Wayde N.; Henry, Dermot A.; Mills, Stuart J.

    2005-11-01

    The phosphate minerals hannayite, newberyite and struvite have been studied by Raman spectroscopy using a thermal stage. Hannayite and newberyite are characterised by an intense band at around 980 cm -1 assigned to the v symmetric stretching vibration of the HPO 4 units. In contrast the symmetric stretching mode is observed at 942 cm -1 for struvite. The Raman spectra are characterised by multiple v anti-symmetric stretching bands and v and v bending modes indicating strong distortion of the HPO 4 and PO 4 units. Hannayite and newberyite are defined by bands at 3382 and 3350 cm -1 attributed to HOPO 3 vibrations and hannayite and struvite by bands at 2990, 2973 and 2874 assigned to NH 4+ bands. Raman spectroscopy has proven most useful for the analysis of these 'cave' minerals where complex paragenetic relationships exist between the minerals.

  17. Broadband Transmission EPR Spectroscopy

    PubMed Central

    Hagen, Wilfred R.

    2013-01-01

    EPR spectroscopy employs a resonator operating at a single microwave frequency and phase-sensitive detection using modulation of the magnetic field. The X-band spectrometer is the general standard with a frequency in the 9–10 GHz range. Most (bio)molecular EPR spectra are determined by a combination of the frequency-dependent electronic Zeeman interaction and a number of frequency-independent interactions, notably, electron spin – nuclear spin interactions and electron spin – electron spin interactions, and unambiguous analysis requires data collection at different frequencies. Extant and long-standing practice is to use a different spectrometer for each frequency. We explore the alternative of replacing the narrow-band source plus single-mode resonator with a continuously tunable microwave source plus a non-resonant coaxial transmission cell in an unmodulated external field. Our source is an arbitrary wave digital signal generator producing an amplitude-modulated sinusoidal microwave in combination with a broadband amplifier for 0.8–2.7 GHz. Theory is developed for coaxial transmission with EPR detection as a function of cell dimensions and materials. We explore examples of a doublet system, a high-spin system, and an integer-spin system. Long, straigth, helical, and helico-toroidal cells are developed and tested with dilute aqueous solutions of spin label hydroxy-tempo. A detection limit of circa 5 µM HO-tempo in water at 800 MHz is obtained for the present setup, and possibilities for future improvement are discussed. PMID:23555819

  18. Sensitivity Limits of Nanomechanical Resonance Spectroscopy

    NASA Astrophysics Data System (ADS)

    Greaney, P. Alex

    2009-03-01

    The sensitivity limit of the recently proposed chemical sensing method, nanomechanical resonance spectroscopy (NRS) ootnotetextP.A. Greaney and J.C. Grossman, Nano Letters, 8, 2648-2652, (2008)., is investigated using classical molecular dynamics simulations. The NRS method exploits the preferential transfer of energy between resonant modes, using an array of nanomechanical resonators to interrogate the vibrational spectrum of an analyte directly. We report on the effects of solvent and complex analytes.

  19. Low-frequency vibrational modes in blue opsin: A computational study

    NASA Astrophysics Data System (ADS)

    Thirumuruganandham, Saravana Prakash; Urbassek, Herbert M.

    Vibrational excitations of low-frequency collective modes are essential for functionally important conformational transitions in proteins. We have carried out an analysis of the low-frequency modes in blue opsin based on both normal-mode analysis and molecular dynamics simulations. Power spectra obtained by molecular dynamics agree well with the normal modes. A representative set of low-frequency modes is discussed with the help of vector-field representation. We thus demonstrate that terahertz spectroscopy of low-frequency modes might be relevant for identifying those vibrational degrees of freedom that correlate to known conformational changes in opsins.

  20. New perspectives on waves in random media: Speckle, modes, transmission eigenchannels, and focusing

    NASA Astrophysics Data System (ADS)

    Genack, Azriel

    2012-02-01

    The understanding of electron localization and conductance fluctuations has been advanced by utilizing notions of speckle, modes, and transmission eigenchannels. These concepts cannot be probed directly for electronic systems but can be explored for classical waves utilizing spectra of field transmission coefficients between arrays of points on the incident and output surfaces of ensembles of random samples. This is illustrated in microwave measurements of transmission through random waveguides in the Anderson localization transition. These experiments supply the link between the statistics of intensity and conductance and show that transmitted wave can be decomposed simultaneously into the underlying quasi-normal modes and transmission eigenchannels of the sample. The power of each of these approaches and the richness of the links between them will be illustrated by examples that reveal new aspects of wave propagation. The delayed onset of transmission following pulse excitation is shown to be the result of destructive interference between highly correlated speckle patterns of neighboring modes, while the falling decay rate at later times reflects the incoherent decay of increasingly prominent long-lived modes. We determine the individual eigenvalues τn of the transmission matrix and achieve nearly complete transmission in opaque diffusive samples. We demonstrate that when reflection at the sample interface is taken into account, the spacing between average values of lnτn is equal to the inverse of the bare conductance, in accord with predictions by Dorokhov [1]. We find that the distribution of total transmission relative to the conductance is determined by the effective number of transmission eigenvalues, Neff=( ∑n=1^N τn )^2/∑n=1^N τn^2 , which provides the link between the statistics of intensity and conductance. For diffusive waves, Neff is the inverse of the degree of intensity correlation. The contrast between the peak and background of maximally

  1. Tearing Modes in Tokamaks

    SciTech Connect

    White, R. B.

    2008-05-14

    This lecture gives a basic introduction to magnetic pound elds, magnetic surface destruction, toroidal equilibrium and tearing modes in a tokamak, including the linear and nonlinear development of these modes and their modi pound cation by current drive and bootstrap current, and sawtooth oscillations and disruptions.

  2. Mode decomposition evolution equations

    PubMed Central

    Wang, Yang; Wei, Guo-Wei; Yang, Siyang

    2011-01-01

    Partial differential equation (PDE) based methods have become some of the most powerful tools for exploring the fundamental problems in signal processing, image processing, computer vision, machine vision and artificial intelligence in the past two decades. The advantages of PDE based approaches are that they can be made fully automatic, robust for the analysis of images, videos and high dimensional data. A fundamental question is whether one can use PDEs to perform all the basic tasks in the image processing. If one can devise PDEs to perform full-scale mode decomposition for signals and images, the modes thus generated would be very useful for secondary processing to meet the needs in various types of signal and image processing. Despite of great progress in PDE based image analysis in the past two decades, the basic roles of PDEs in image/signal analysis are only limited to PDE based low-pass filters, and their applications to noise removal, edge detection, segmentation, etc. At present, it is not clear how to construct PDE based methods for full-scale mode decomposition. The above-mentioned limitation of most current PDE based image/signal processing methods is addressed in the proposed work, in which we introduce a family of mode decomposition evolution equations (MoDEEs) for a vast variety of applications. The MoDEEs are constructed as an extension of a PDE based high-pass filter (Europhys. Lett., 59(6): 814, 2002) by using arbitrarily high order PDE based low-pass filters introduced by Wei (IEEE Signal Process. Lett., 6(7): 165, 1999). The use of arbitrarily high order PDEs is essential to the frequency localization in the mode decomposition. Similar to the wavelet transform, the present MoDEEs have a controllable time-frequency localization and allow a perfect reconstruction of the original function. Therefore, the MoDEE operation is also called a PDE transform. However, modes generated from the present approach are in the spatial or time domain and can be

  3. Mode decomposition evolution equations.

    PubMed

    Wang, Yang; Wei, Guo-Wei; Yang, Siyang

    2012-03-01

    Partial differential equation (PDE) based methods have become some of the most powerful tools for exploring the fundamental problems in signal processing, image processing, computer vision, machine vision and artificial intelligence in the past two decades. The advantages of PDE based approaches are that they can be made fully automatic, robust for the analysis of images, videos and high dimensional data. A fundamental question is whether one can use PDEs to perform all the basic tasks in the image processing. If one can devise PDEs to perform full-scale mode decomposition for signals and images, the modes thus generated would be very useful for secondary processing to meet the needs in various types of signal and image processing. Despite of great progress in PDE based image analysis in the past two decades, the basic roles of PDEs in image/signal analysis are only limited to PDE based low-pass filters, and their applications to noise removal, edge detection, segmentation, etc. At present, it is not clear how to construct PDE based methods for full-scale mode decomposition. The above-mentioned limitation of most current PDE based image/signal processing methods is addressed in the proposed work, in which we introduce a family of mode decomposition evolution equations (MoDEEs) for a vast variety of applications. The MoDEEs are constructed as an extension of a PDE based high-pass filter (Europhys. Lett., 59(6): 814, 2002) by using arbitrarily high order PDE based low-pass filters introduced by Wei (IEEE Signal Process. Lett., 6(7): 165, 1999). The use of arbitrarily high order PDEs is essential to the frequency localization in the mode decomposition. Similar to the wavelet transform, the present MoDEEs have a controllable time-frequency localization and allow a perfect reconstruction of the original function. Therefore, the MoDEE operation is also called a PDE transform. However, modes generated from the present approach are in the spatial or time domain and can be

  4. Zero-mode waveguides

    DOEpatents

    Levene, Michael J.; Korlach, Jonas; Turner, Stephen W.; Craighead, Harold G.; Webb, Watt W.

    2007-02-20

    The present invention is directed to a method and an apparatus for analysis of an analyte. The method involves providing a zero-mode waveguide which includes a cladding surrounding a core where the cladding is configured to preclude propagation of electromagnetic energy of a frequency less than a cutoff frequency longitudinally through the core of the zero-mode waveguide. The analyte is positioned in the core of the zero-mode waveguide and is then subjected, in the core of the zero-mode waveguide, to activating electromagnetic radiation of a frequency less than the cut-off frequency under conditions effective to permit analysis of the analyte in an effective observation volume which is more compact than if the analysis were carried out in the absence of the zero-mode waveguide.

  5. Excursions through KK modes

    SciTech Connect

    Furuuchi, Kazuyuki

    2016-07-07

    In this article we study Kaluza-Klein (KK) dimensional reduction of massive Abelian gauge theories with charged matter fields on a circle. Since local gauge transformations change position dependence of the charged fields, the decomposition of the charged matter fields into KK modes is gauge dependent. While whole KK mass spectrum is independent of the gauge choice, the mode number depends on the gauge. The masses of the KK modes also depend on the field value of the zero-mode of the extra dimensional component of the gauge field. In particular, one of the KK modes in the KK tower of each massless 5D charged field becomes massless at particular values of the extra-dimensional component of the gauge field. When the extra-dimensional component of the gauge field is identified with the inflaton, this structure leads to recursive cosmological particle productions.

  6. Excursions through KK modes

    NASA Astrophysics Data System (ADS)

    Furuuchi, Kazuyuki

    2016-07-01

    In this article we study Kaluza-Klein (KK) dimensional reduction of massive Abelian gauge theories with charged matter fields on a circle. Since local gauge transformations change position dependence of the charged fields, the decomposition of the charged matter fields into KK modes is gauge dependent. While whole KK mass spectrum is independent of the gauge choice, the mode number depends on the gauge. The masses of the KK modes also depend on the field value of the zero-mode of the extra dimensional component of the gauge field. In particular, one of the KK modes in the KK tower of each massless 5D charged field becomes massless at particular values of the extra-dimensional component of the gauge field. When the extra-dimensional component of the gauge field is identified with the inflaton, this structure leads to recursive cosmological particle productions.

  7. Microresonator soliton dual-comb spectroscopy

    NASA Astrophysics Data System (ADS)

    Suh, Myoung-Gyun; Yang, Qi-Fan; Yang, Ki Youl; Yi, Xu; Vahala, Kerry J.

    2016-11-01

    Measurement of optical and vibrational spectra with high resolution provides a way to identify chemical species in cluttered environments and is of general importance in many fields. Dual-comb spectroscopy has emerged as a powerful approach for acquiring nearly instantaneous Raman and optical spectra with unprecedented resolution. Spectra are generated directly in the electrical domain, without the need for bulky mechanical spectrometers. We demonstrate a miniature soliton-based dual-comb system that can potentially transfer the approach to a chip platform. These devices achieve high-coherence pulsed mode locking. They also feature broad, reproducible spectral envelopes, an essential feature for dual-comb spectroscopy. Our work shows the potential for integrated spectroscopy with high signal-to-noise ratios and fast acquisition rates.

  8. Torque-mixing magnetic resonance spectroscopy.

    PubMed

    Losby, J E; Fani Sani, F; Grandmont, D T; Diao, Z; Belov, M; Burgess, J A J; Compton, S R; Hiebert, W K; Vick, D; Mohammad, K; Salimi, E; Bridges, G E; Thomson, D J; Freeman, M R

    2015-11-13

    A universal, torque-mixing method for magnetic resonance spectroscopy is presented. In analogy to resonance detection by magnetic induction, the transverse component of a precessing dipole moment can be measured in sensitive broadband spectroscopy, here using a resonant mechanical torque sensor. Unlike induction, the torque amplitude allows equilibrium magnetic properties to be monitored simultaneously with the spin dynamics. Comprehensive electron spin resonance spectra of a single-crystal, mesoscopic yttrium iron garnet disk at room temperature reveal assisted switching between magnetization states and mode-dependent spin resonance interactions with nanoscale surface imperfections. The rich detail allows analysis of even complex three-dimensional spin textures. The flexibility of microelectromechanical and optomechanical devices combined with broad generality and capabilities of torque-mixing magnetic resonance spectroscopy offers great opportunities for development of integrated devices.

  9. Optical Spectroscopy at the Nanoscale

    NASA Astrophysics Data System (ADS)

    Hong, Xiaoping

    Recent advances in material science and fabrication techniques enabled development of nanoscale applications and devices with superior performances and high degree of integration. Exotic physics also emerges at nanoscale where confinement of electrons and phonons leads to drastically different behavior from those in the bulk materials. It is therefore rewarding and interesting to investigate and understand material properties at the nanoscale. Optical spectroscopy, one of the most versatile techniques for studying material properties and light-matter interactions, can provide new insights into the nanomaterials. In this thesis, I explore advanced laser spectroscopic techniques to probe a variety of different nanoscale phenomena. A powerful tool in nanoscience and engineering is scanning tunneling microscopy (STM). Its capability in atomic resolution imaging and spectroscopy unveiled the mystical quantum world of atoms and molecules. However identification of molecular species under investigation is one of the limiting functionalities of the STM. To address this need, we take advantage of the molecular `fingerprints' - vibrational spectroscopy, by combining an infrared light sources with scanning tunneling microscopy. In order to map out sharp molecular resonances, an infrared continuous wave broadly tunable optical parametric oscillator was developed with mode-hop free fine tuning capabilities. We then combine this laser with STM by shooting the beam onto the STM substrate with sub-monolayer diamondoids deposition. Thermal expansion of the substrate is detected by the ultrasensitive tunneling current when infrared frequency is tuned across the molecular vibrational range. Molecular vibrational spectroscopy could be obtained by recording the thermal expansion as a function of the excitation wavelength. Another interesting field of the nanoscience is carbon nanotube, an ideal model of one dimensional physics and applications. Due to the small light absorption with

  10. Vibrational modes of aminothiophenol: a TERS and DFT study.

    PubMed

    Merlen, A; Chaigneau, M; Coussan, S

    2015-07-15

    We report Tip Enhanced Raman Spectroscopy (TERS) mapping and Density Functional (DFT) calculations of aminothiophenol (ATP) grafted on a gold surface. The TERS mapping has demonstrated Raman modes of (ATP) and its dimerised derivative Dimercaptoazobenzene (DMAB). This feature confirms that the plasmon activated chemical reaction of ATP has occurred during TERS measurements. In some specific part of the samples some unidentified Raman modes are observed. We suggest that they could come from intermediate species formed during the conversion of ATP into DMAB. These modes are compared with calculated Raman spectra of some possible intermediate species. These results confirm the high potentiality of TERS measurements for nanochemistry.

  11. Review on Acoustic Transducers for Resonant Ultrasound Spectroscopy

    NASA Astrophysics Data System (ADS)

    Nakamura, N.; Ogi, H.; Hirao, M.

    2015-08-01

    Determination of elastic constants using resonant ultrasound spectroscopy requires transducers that can measure resonance frequencies accurately and identify the vibrational mode of each resonance frequency. We developed three transducers, namely an electromagnetic acoustic transducer, a tripod piezoelectric transducer coupled with a laser Doppler interferometer, and an antenna transmission transducer, for use with various materials and in different measurement circumstances. Their capability in resonant ultrasound spectroscopy and their applications are described.

  12. Mode II fatigue crack propagation.

    NASA Technical Reports Server (NTRS)

    Roberts, R.; Kibler, J. J.

    1971-01-01

    Fatigue crack propagation rates were obtained for 2024-T3 bare aluminum plates subjected to in-plane, mode I, extensional loads and transverse, mode II, bending loads. These results were compared to the results of Iida and Kobayashi for in-plane mode I-mode II extensional loads. The engineering significance of mode I-mode II fatigue crack growth is considered in view of the present results. A fatigue crack growth equation for handling mode I-mode II fatigue crack growth rates from existing mode I data is also discussed.

  13. Relating normal vibrational modes to local vibrational modes: benzene and naphthalene.

    PubMed

    Zou, Wenli; Kalescky, Robert; Kraka, Elfi; Cremer, Dieter

    2013-07-01

    Local vibrational modes can be directly derived from normal vibrational modes using the method of Konkoli and Cremer (Int J Quant Chem 67:29, 1998). This implies the calculation of the harmonic force constant matrix F (q) (expressed in internal coordinates q) from the corresponding Cartesian force constant matrix f (x) with the help of the transformation matrix U = WB (†)(BWB (†))(-1) (B: Wilson's B-matrix). It is proven that the local vibrational modes are independent of the choice of the matrix W. However, the choice W = M (-1) (M: mass matrix) has numerical advantages with regard to the choice W = I (I: identity matrix), where the latter is frequently used in spectroscopy. The local vibrational modes can be related to the normal vibrational modes in the form of an adiabatic connection scheme (ACS) after rewriting the Wilson equation with the help of the compliance matrix. The ACSs of benzene and naphthalene based on experimental vibrational frequencies are discussed as nontrivial examples. It is demonstrated that the local-mode stretching force constants provide a quantitative measure for the C-H and C-C bond strength.

  14. Supersymmetric mode converters

    NASA Astrophysics Data System (ADS)

    Heinrich, Matthias; Miri, Mohammad-Ali; Stützer, Simon; Nolte, Stefan; Szameit, Alexander; Christodoulides, Demetrios N.

    2015-08-01

    In recent years, the ever-increasing demand for high-capacity transmission systems has driven remarkable advances in technologies that encode information on an optical signal. Mode-division multiplexing makes use of individual modes supported by an optical waveguide as mutually orthogonal channels. The key requirement in this approach is the capability to selectively populate and extract specific modes. Optical supersymmetry (SUSY) has recently been proposed as a particularly elegant way to resolve this design challenge in a manner that is inherently scalable, and at the same time maintains compatibility with existing multiplexing strategies. Supersymmetric partners of multimode waveguides are characterized by the fact that they share all of their effective indices with the original waveguide. The crucial exception is the fundamental mode, which is absent from the spectrum of the partner waveguide. Here, we demonstrate experimentally how this global phase-matching property can be exploited for efficient mode conversion. Multimode structures and their superpartners are experimentally realized in coupled networks of femtosecond laser-written waveguides, and the corresponding light dynamics are directly observed by means of fluorescence microscopy. We show that SUSY transformations can readily facilitate the removal of the fundamental mode from multimode optical structures. In turn, hierarchical sequences of such SUSY partners naturally implement the conversion between modes of adjacent order. Our experiments illustrate just one of the many possibilities of how SUSY may serve as a building block for integrated mode-division multiplexing arrangements. Supersymmetric notions may enrich and expand integrated photonics by versatile optical components and desirable, yet previously unattainable, functionalities.

  15. Mode Gaussian beam tracing

    NASA Astrophysics Data System (ADS)

    Trofimov, M. Yu.; Zakharenko, A. D.; Kozitskiy, S. B.

    2016-10-01

    A mode parabolic equation in the ray centered coordinates for 3D underwater sound propagation is developed. The Gaussian beam tracing in this case is constructed. The test calculations are carried out for the ASA wedge benchmark and proved an excellent agreement with the source images method in the case of cross-slope propagation. But in the cases of wave propagation at some angles to the cross-slope direction an account of mode interaction becomes necessary.

  16. Drug analysis by Raman and micro-Raman spectroscopy.

    PubMed

    Huong, P V

    1986-01-01

    The technique of Raman spectroscopy, resonance Raman spectroscopy and micro-Raman spectroscopy is described for application to drug analysis and investigation. Possibilities and limits are mentioned for qualitative and quantitative analyses as well as for studies of structure and interactions. Some principal interaction modes, such as hydrogen bonding, proton transfer, charge transfer and ion-molecule attraction, are shown to explain drug reactivity. Illustrations are given based on several drug families, in particular vitamins, anti-depressants, cardio-active and anticancer drugs.

  17. Time-resolved study of Higgs mode in superconductors

    NASA Astrophysics Data System (ADS)

    Shimano, Ryo

    The behavior of superconductors far from equilibrium has been intensively studied over decades. Goals of these studies are the elucidation of bosonic fluctuations essential for the pairing mechanisms, the manifestation of competing orders or hidden phases, and the optical manipulation of superconductivity. The study of collective modes is crucially important for these perspectives as it provides the information on the dynamics of order parameters in non-equilibirium states. Generally, collective modes in ordered phases associated with spontaneous symmetry breaking are classified into 1) gapless phase modes and 2) gapped amplitude modes. In superconductors, the phase mode is eaten by gauge field, according to the Anderson-Higgs mechanism. The remaining amplitude mode is recently termed as Higgs mode from its analogy to the Higgs boson in particle physics. Despite its long history of investigation, unambiguous observation of Higgs mode has remained elusive. This is because the Higgs mode does not have a charge nor electric dipole and therefore it does not couple directly to the electromagnetic field. Here we report on our recent observation of Higgs mode in s-wave superconductors by using THz-pump and THz-probe spectroscopy technique. After nonadiabatic excitation near the superconducting gap energy with monocycle THz pulses, Higgs mode was observed as oscillations in the transmission of THz probe pulse. The resonant nonlinear coupling between the Higgs mode and coherent radiation field was also discovered, resulting in an efficient third order harmonic generation of the incident THz radiation. The extension of experiments to multiband superconductors and unconventional superconductors will be discussed. Time-resolved study of Higgs mode in superconductors.

  18. Mode transition in CF4 + Ar inductively coupled plasma

    NASA Astrophysics Data System (ADS)

    Liu, Wei; Gao, Fei; Zhao, Shu-Xia; Li, Xue-Chun; Wang, You-Nian

    2013-12-01

    The E to H mode transitions are studied by a hairpin probe and optical emission spectroscopy in inductively coupled CF4 + Ar plasmas. Electron density, optical emission intensity of Ar, and the voltage and current are measured during the E to H mode transitions. It is found that the electron density and plasma emission intensity increase continuously at low pressure during the E to H mode transition, while they jump up discontinuously at high pressure. Meanwhile, the transition threshold power and △P (the power interval between E and H mode) increase by increasing the pressure. When the ratio of CF4 increases, the E to H mode transition happens at higher applied power, and meanwhile, the △P also significantly increases. Besides, the effects of CF4 gas ratio on the plasma properties and the circuit electrical properties in both pure E and H modes were also investigated. The electron density and plasma emission intensity both decrease upon increasing the ratio of CF4 at the two modes, due to the stronger electrons loss scheme. The applied voltages at E and H modes both increase as increasing the CF4 gas ratio, however the applied current at two modes behave just oppositely with the gas ratio.

  19. BATSE spectroscopy analysis system

    NASA Technical Reports Server (NTRS)

    Schaefer, Bradley E.; Bansal, Sandhia; Basu, Anju; Brisco, Phil; Cline, Thomas L.; Friend, Elliott; Laubenthal, Nancy; Panduranga, E. S.; Parkar, Nuru; Rust, Brad

    1992-01-01

    The Burst and Transient Source Experiment (BATSE) Spectroscopy Analysis System (BSAS) is the software system which is the primary tool for the analysis of spectral data from BATSE. As such, Guest Investigators and the community as a whole need to know its basic properties and characteristics. Described here are the characteristics of the BATSE spectroscopy detectors and the BSAS.

  20. Hydrogen local vibrational modes in semiconductors

    SciTech Connect

    McCluskey, Matthew D.

    1997-06-01

    Following, a review of experimental techniques, theory, and previous work, the results of local vibrational mode (LVM) spectroscopy on hydrogen-related complexes in several different semiconductors are discussed. Hydrogen is introduced either by annealing in a hydrogen ambient. exposure to a hydrogen plasma, or during growth. The hydrogen passivates donors and acceptors in semiconductors, forming neutral complexes. When deuterium is substituted for hydrogen. the frequency of the LVM decreases by approximately the square root of two. By varying the temperature and pressure of the samples, the microscopic structures of hydrogen-related complexes are determined. For group II acceptor-hydrogen complexes in GaAs, InP, and GaP, hydrogen binds to the host anion in a bond-centered orientation, along the [111] direction, adjacent to the acceptor. The temperature dependent shift of the LVMs are proportional to the lattice thermal energy U(T), a consequence of anharmonic coupling between the LVM and acoustical phonons. In the wide band gap semiconductor ZnSe, epilayers grown by metalorganic chemical vapor phase epitaxy (MOCVD) and doped with As form As-H complexes. The hydrogen assumes a bond-centered orientation, adjacent to a host Zn. In AlSb, the DX centers Se and Te are passivated by hydrogen. The second, third, and fourth harmonics of the wag modes are observed. Although the Se-D complex has only one stretch mode, the Se-H stretch mode splits into three peaks. The anomalous splitting is explained by a new interaction between the stretch LVM and multi-phonon modes of the lattice. As the temperature or pressure is varied, and anti-crossing is observed between LVM and phonon modes.

  1. Mode specific photoionization dynamics in polyatomic molecules

    NASA Astrophysics Data System (ADS)

    Rathbone, Gerald Jeffery

    2002-11-01

    The work presented in this dissertation presents new work on polyatomic photoionization. In these investigations, the broad range behavior of both allowed and forbidden vibrational modes in linear triatomic systems were studied to understand mode specific aspects of photoionization. The current study is made possible by the experimental strategy of exploiting high resolution photoelectron spectroscopy and the high brightness of third generation synchrotron radiation sources. The data is taken typically tens of eV's past the ionization potential. The strategy that I employ is to probe alternative vibrational modes which are frequently affected differently following resonant ionization. Such vibrationally resolved data can be used to understand how the correlation between vibration and electron energy reveals microscopic insights into the photoelectron scattering process. Moreover, the mode specific behavior contains a wealth of information not only regarding allowed transitions, but also contains information on how forbidden transitions gain surprising amounts of intensity. A previously overlooked mechanism for the appearance of forbidden nontotally symmetric vibrations was discovered---resonantly amplified vibronic symmetry breaking. The photoelectron the culprit for the symmetry breaking which induces the excitation of nominally forbidden vibrational excitations. In a more general sense, these results will demonstrate that some fundamental spectroscopic approximations are not always valid, and can lead to surprising consequences.

  2. Majorana Zero Modes in Graphene

    NASA Astrophysics Data System (ADS)

    San-Jose, P.; Lado, J. L.; Aguado, R.; Guinea, F.; Fernández-Rossier, J.

    2015-10-01

    A clear demonstration of topological superconductivity (TS) and Majorana zero modes remains one of the major pending goals in the field of topological materials. One common strategy to generate TS is through the coupling of an s -wave superconductor to a helical half-metallic system. Numerous proposals for the latter have been put forward in the literature, most of them based on semiconductors or topological insulators with strong spin-orbit coupling. Here, we demonstrate an alternative approach for the creation of TS in graphene-superconductor junctions without the need for spin-orbit coupling. Our prediction stems from the helicity of graphene's zero-Landau-level edge states in the presence of interactions and from the possibility, experimentally demonstrated, of tuning their magnetic properties with in-plane magnetic fields. We show how canted antiferromagnetic ordering in the graphene bulk close to neutrality induces TS along the junction and gives rise to isolated, topologically protected Majorana bound states at either end. We also discuss possible strategies to detect their presence in graphene Josephson junctions through Fraunhofer pattern anomalies and Andreev spectroscopy. The latter, in particular, exhibits strong unambiguous signatures of the presence of the Majorana states in the form of universal zero-bias anomalies. Remarkable progress has recently been reported in the fabrication of the proposed type of junctions, which offers a promising outlook for Majorana physics in graphene systems.

  3. Linear and Nonlinear Molecular Spectroscopy with Laser Frequency Combs

    NASA Astrophysics Data System (ADS)

    Picque, Nathalie

    2013-06-01

    The regular pulse train of a mode-locked femtosecond laser can give rise to a comb spectrum of millions of laser modes with a spacing precisely equal to the pulse repetition frequency. Laser frequency combs were conceived a decade ago as tools for the precision spectroscopy of atomic hydrogen. They are now becoming enabling tools for an increasing number of applications, including molecular spectroscopy. Recent experiments of multi-heterodyne frequency comb Fourier transform spectroscopy (also called dual-comb spectroscopy) have demonstrated that the precisely spaced spectral lines of a laser frequency comb can be harnessed for new techniques of linear absorption spectroscopy. The first proof-of-principle experiments have demonstrated a very exciting potential of dual-comb spectroscopy without moving parts for ultra-rapid and ultra-sensitive recording of complex broad spectral bandwidth molecular spectra. Compared to conventional Michelson-based Fourier transform spectroscopy, recording times could be shortened from seconds to microseconds, with intriguing prospects for spectroscopy of short lived transient species. The resolution improves proportionally to the measurement time. Therefore longer recordings allow high resolution spectroscopy of molecules with extreme precision, since the absolute frequency of each laser comb line can be known with the accuracy of an atomic clock. Moreover, since laser frequency combs involve intense ultrashort laser pulses, nonlinear interactions can be harnessed. Broad spectral bandwidth ultra-rapid nonlinear molecular spectroscopy and imaging with two laser frequency combs is demonstrated with coherent Raman effects and two-photon excitation. Real-time multiplex accessing of hyperspectral images may dramatically expand the range of applications of nonlinear microscopy. B. Bernhardt et al., Nature Photonics 4, 55-57 (2010); A. Schliesser et al. Nature Photonics 6, 440-449 (2012); T. Ideguchi et al. arXiv:1201.4177 (2012) T

  4. Two-mode coupling model in a few mode fiber

    NASA Astrophysics Data System (ADS)

    Kaliteevskiy, N. A.; Korolev, A. E.; Koreshkov, K. S.; Nazarov, V. N.; Sterlingov, P. M.

    2013-06-01

    A phenomenological two-mode coupling model in few mode fibers (FMF) is developed. It uses a mode coupling coefficient and the differential modal delay as the input parameters and the split-step approach. The model is consistent with the experimental results demonstrating distributed mode coupling effects in FMF and may be used for multipath interference estimation based on statistical analysis of fluctuations.

  5. Whispering Bloch modes

    PubMed Central

    Craster, R. V.

    2016-01-01

    We investigate eigenvalue problems for the planar Helmholtz equation in open systems with a high order of rotational symmetry. The resulting solutions have similarities with the whispering gallery modes exploited in photonic micro-resonators and elsewhere, but unlike these do not necessarily require a surrounding material boundary, with confinement instead resulting from the geometry of a series of inclusions arranged in a ring. The corresponding fields exhibit angular quasi-periodicity reminiscent of Bloch waves, and hence we refer to them as whispering Bloch modes (WBMs). We show that if the geometry of the system is slightly perturbed such that the rotational symmetry is broken, modes with asymmetric field patterns can be observed, resulting in field enhancement and other potentially desirable effects. We investigate the WBMs of two specific geometries first using expansion methods and then by applying a two-scale asymptotic scheme. PMID:27493564

  6. Violin plate modes.

    PubMed

    Gough, Colin

    2015-01-01

    As the first step toward developing a generic model for the acoustically radiating vibrational modes of the violin and related instruments, the modes of both freely supported and edge-constrained top and back plates have been investigated as functions of shape, arching height, elastic anisotropy, the f-holes and associated island area, thickness graduations, and the additional boundary constraints of the ribs, soundpost, and bass-bar present in the assembled instrument. Comsol shell structure finite element software has been used as a quasi-experimental tool, with physical and geometric properties varied smoothly, often over several orders of magnitude, allowing the development of the plate modes to be followed continuously from those of an initially square plate to those of doubly-arched, guitar-shaped, orthotropic plates and their dependence on all the above factors.

  7. Whispering-mode waveguide

    NASA Astrophysics Data System (ADS)

    Kurnit, N. A.

    Properties of a relatively new type of waveguide structure of potential use of confining infrared radiation to a small mode volume over long path lengths are reviewed. A single guiding surface with curvature radius rho and band radius R allows propagation of a near-grazing incidence whispering mode of transverse width approximately (lambda square root of rho R/pi) sup 1/2 and radial width approximately 1/2 (sq lambda R)/sup 1/3. For sufficiently large rho, the loss per revolution for TE mode propagation is approximately pi A/sub N/, where A/sub N/ is the normal-incidence reflection loss. Results on a number of prototype structures in general agreement with these considerations are described.

  8. Infernal Fishbone Mode

    SciTech Connect

    Ya.I. Kolesnichenko; V.S. Marchenko; R.B. White

    2003-02-11

    A new kind of fishbone instability associated with circulating energetic ions is predicted. The considered instability is essentially the energetic particle mode; it is characterized by m/n not equal to 1 (m and n are the poloidal and toroidal mode numbers, respectively). The mode is localized inside the flux surface where the safety factor (q) is q* = m/n, its amplitude being maximum near q*. The instability arises in plasmas with small shear inside the q* surface and q(0) > 1. A possibility to explain recent experimental observations of the m = 2 fishbone oscillations accompanied by strong changes of the neutron emission during tangential neutral-beam injection in the National Spherical Torus Experiment [M. Ono, et al., Nucl. Fusion 40 (2000) 557] is shown.

  9. Evolution of Plasmonic Metamolecule Modes in the Quantum Tunneling Regime.

    PubMed

    Scholl, Jonathan A; Garcia-Etxarri, Aitzol; Aguirregabiria, Garikoitz; Esteban, Ruben; Narayan, Tarun C; Koh, Ai Leen; Aizpurua, Javier; Dionne, Jennifer A

    2016-01-26

    Plasmonic multinanoparticle systems exhibit collective electric and magnetic resonances that are fundamental for the development of state-of-the-art optical nanoantennas, metamaterials, and surface-enhanced spectroscopy substrates. While electric dipolar modes have been investigated in both the classical and quantum realm, little attention has been given to magnetic and other "dark" modes at the smallest dimensions. Here, we study the collective electric, magnetic, and dark modes of colloidally synthesized silver nanosphere trimers with varying interparticle separation using scanning transmission electron microscopy (STEM) and electron energy-loss spectroscopy (EELS). This technique enables direct visualization and spatially selective excitation of individual trimers, as well as manipulation of the interparticle distance into the subnanometer regime with the electron beam. Our experiments reveal that bonding electric and magnetic modes are significantly impacted by quantum effects, exhibiting a relative blueshift and reduced EELS amplitude compared to classical predictions. In contrast, the trimer's electric dark mode is not affected by quantum tunneling for even Ångström-scale interparticle separations. We employ a quantum-corrected model to simulate the effect of electron tunneling in the trimer which shows excellent agreement with experimental results. This understanding of classical and quantum-influenced hybridized modes may impact the development of future quantum plasmonic materials and devices, including Fano-like molecular sensors and quantum metamaterials.

  10. Disclosing dark mode of femtosecond plasmon with photoemission electron microscopy

    NASA Astrophysics Data System (ADS)

    Ji, Boyu; Wang, Qian; Song, Xiaowei; Tao, Haiyan; Dou, Yinping; Gao, Xun; Hao, Zuoqiang; Lin, Jingquan

    2017-10-01

    The plasmonics dark mode of metal nanorings has potential in the field of e.g. sensing and surface-enhanced Raman spectroscopy (SERS). Most of the investigations on the plasmonics dark mode in a nanoring have been on far-field spectroscopy or near field simulations so far. In this paper, the near-field distribution of the femtosecond dark mode plasmon on an individual gold nanoring is mapped non-invasively using photoemission electron microscopy (PEEM). The experimental results show that strong electron emission distributions in the PEEM images under different polarization directions and wavelengths of femtosecond light are in qualitative agreement with the pattern of quadruple plasmon mode calculated using finite-difference time-domain simulation. In the meantime, it is found that there is a discrepancy in hot spot distribution between the observed PEEM image and the simulated photoelectron emission pattern, which is attributed to some possible factors, such as band structure near the Fermi level of the nanoring material and the temporal profile of femtosecond laser pulse. Real-space near-field imaging of the plasmonics dark mode provides a fundamental understanding of the near field and paves the way for further advancing the applications of dark mode in the field of e.g. sensing and SERS.

  11. Two-dimensional vibrational-electronic spectroscopy

    SciTech Connect

    Courtney, Trevor L.; Fox, Zachary W.; Slenkamp, Karla M.; Khalil, Munira

    2015-10-21

    Two-dimensional vibrational-electronic (2D VE) spectroscopy is a femtosecond Fourier transform (FT) third-order nonlinear technique that creates a link between existing 2D FT spectroscopies in the vibrational and electronic regions of the spectrum. 2D VE spectroscopy enables a direct measurement of infrared (IR) and electronic dipole moment cross terms by utilizing mid-IR pump and optical probe fields that are resonant with vibrational and electronic transitions, respectively, in a sample of interest. We detail this newly developed 2D VE spectroscopy experiment and outline the information contained in a 2D VE spectrum. We then use this technique and its single-pump counterpart (1D VE) to probe the vibrational-electronic couplings between high frequency cyanide stretching vibrations (ν{sub CN}) and either a ligand-to-metal charge transfer transition ([Fe{sup III}(CN){sub 6}]{sup 3−} dissolved in formamide) or a metal-to-metal charge transfer (MMCT) transition ([(CN){sub 5}Fe{sup II}CNRu{sup III}(NH{sub 3}){sub 5}]{sup −} dissolved in formamide). The 2D VE spectra of both molecules reveal peaks resulting from coupled high- and low-frequency vibrational modes to the charge transfer transition. The time-evolving amplitudes and positions of the peaks in the 2D VE spectra report on coherent and incoherent vibrational energy transfer dynamics among the coupled vibrational modes and the charge transfer transition. The selectivity of 2D VE spectroscopy to vibronic processes is evidenced from the selective coupling of specific ν{sub CN} modes to the MMCT transition in the mixed valence complex. The lineshapes in 2D VE spectra report on the correlation of the frequency fluctuations between the coupled vibrational and electronic frequencies in the mixed valence complex which has a time scale of 1 ps. The details and results of this study confirm the versatility of 2D VE spectroscopy and its applicability to probe how vibrations modulate charge and energy transfer in a

  12. Multi-mode horn

    NASA Technical Reports Server (NTRS)

    Neilson, Jeffrey M. (Inventor)

    2002-01-01

    A horn has an input aperture and an output aperture, and comprises a conductive inner surface formed by rotating a curve about a central axis. The curve comprises a first arc having an input aperture end and a transition end, and a second arc having a transition end and an output aperture end. When rotated about the central axis, the first arc input aperture end forms an input aperture, and the second arc output aperture end forms an output aperture. The curve is then optimized to provide a mode conversion which maximizes the power transfer of input energy to the Gaussian mode at the output aperture.

  13. Probing vibrational anisotropy with nuclear resonance vibrational spectroscopy.

    SciTech Connect

    Pavlik, J. W.; Barabanschikov, A.; Oliver, A. G.; Alp, E. E.; Sturhahn, W.; Zhao, J.; Sage, J. T.; Scheidt, W. R.

    2010-06-14

    A NRVS single-crystal study (NRVS=nuclear resonance vibrational spectroscopy) has provided detailed information on the in-plane modes of nitrosyl iron porphyrinate [Fe(oep)(NO)] (see picture; oep=octaethylporphyrin). The axial nitrosyl ligand controls the direction of the in-plane iron motion.

  14. Advanced Undergraduate Laboratory Experiment in Inelastic Electron Tunneling Spectroscopy.

    ERIC Educational Resources Information Center

    White, H. W.; Graves, R. J.

    1982-01-01

    An advanced undergraduate laboratory experiment in inelastic electron tunneling spectroscopy is described. Tunnel junctions were fabricated, the tunneling spectra of several molecules absorbed on the surface of aluminum oxide measured, and mode assignments made for several of the prominent peaks in spectra using results obtained from optical…

  15. The electron spectroscopy for chemical analysis microscopy beamline data acquisition system at ELETTRA

    NASA Astrophysics Data System (ADS)

    Gariazzo, C.; Krempaska, R.; Morrison, G. R.

    1996-07-01

    The electron spectroscopy for chemical analysis (ESCA) microscopy data acquisition system enables the user to control the imaging and spectroscopy modes of operation of the beamline ESCA microscopy at ELETTRA. It allows the user to integrate all experiment, beamline and machine operations in one single environment. The system also provides simple data analysis for both spectra and images data to guide further data acquisition.

  16. Soft-mode spectroscopy in cubic (Ba0.8Sr0.2)Ti0.95(Zn1/3Nb2/3)0.05O3 by hyper-Raman scattering and the mechanism of the phase transition

    NASA Astrophysics Data System (ADS)

    Nabil, Dhifallah; Hehlen, Bernard; El Marssi, Mimoun; Mohamed, Dammak; Khemakhem, Hamadi

    2016-12-01

    This paper presents a survey of soft modes and their relationship to structural phase transitions. After introducing the concept of a soft mode, the origin of softening is considered from a lattice-dynamical point. The Landau theory approach to structural transitions is then discussed, followed by a generalization of the soft-mode concept through the use of the dynamic order-parameter susceptibility. The hyper-Raman spectra in the cubic phase of (Ba0.8Sr0.2)Ti0.95(Zn1/3Nb2/3)0.05O3 are studied with special emphasis on the lowest-frequency phonon mode. The spectral structure is found to change above the Curie temperature (303-873 K). Soft modes were put forward by Cochran and Anderson about 50 years ago as an explanation of structural phase transitions. Extending Landau's theory of phase transitions, their prediction was that the square of the frequency of the soft mode was proportional to ω0 (T) = C √{ T - TC } where Tc is the transition temperature.

  17. Study Mode Negotiation.

    ERIC Educational Resources Information Center

    Vasan, Mani Le; Sargunan, Rajeswary

    This paper outlines a model of study mode negotiation between clients and English Language Training providers that has been developed at the University of Malaya, specifically related to English language writing skills as taught to corporate clients. Negotiation is used to reach decisions concerning the goals and methodology of learning to ensure…

  18. Thermodynamics of Radiation Modes

    ERIC Educational Resources Information Center

    Pina, Eduardo; de la Selva, Sara Maria Teresa

    2010-01-01

    We study the equilibrium thermodynamics of the electromagnetic radiation in a cavity of a given volume and temperature. We found three levels of description, the thermodynamics of one mode, the thermodynamics of the distribution of frequencies in a band by summing over the frequencies in it and the global thermodynamics by summing over all the…

  19. Mode conversion in ITER

    NASA Astrophysics Data System (ADS)

    Jaeger, E. F.; Berry, L. A.; Myra, J. R.

    2006-10-01

    Fast magnetosonic waves in the ion cyclotron range of frequencies (ICRF) can convert to much shorter wavelength modes such as ion Bernstein waves (IBW) and ion cyclotron waves (ICW) [1]. These modes are potentially useful for plasma control through the generation of localized currents and sheared flows. As part of the SciDAC Center for Simulation of Wave-Plasma Interactions project, the AORSA global-wave solver [2] has been ported to the new, dual-core Cray XT-3 (Jaguar) at ORNL where it demonstrates excellent scaling with the number of processors. Preliminary calculations using 4096 processors have allowed the first full-wave simulations of mode conversion in ITER. Mode conversion from the fast wave to the ICW is observed in mixtures of deuterium, tritium and helium3 at 53 MHz. The resulting flow velocity and electric field shear will be calculated. [1] F.W. Perkins, Nucl. Fusion 17, 1197 (1977). [2] E.F. Jaeger, L.A. Berry, J.R. Myra, et al., Phys. Rev. Lett. 90, 195001-1 (2003).

  20. Thermodynamics of Radiation Modes

    ERIC Educational Resources Information Center

    Pina, Eduardo; de la Selva, Sara Maria Teresa

    2010-01-01

    We study the equilibrium thermodynamics of the electromagnetic radiation in a cavity of a given volume and temperature. We found three levels of description, the thermodynamics of one mode, the thermodynamics of the distribution of frequencies in a band by summing over the frequencies in it and the global thermodynamics by summing over all the…

  1. Single mode communication link

    NASA Astrophysics Data System (ADS)

    Cole, Stephen R.; Reid, D. C.; Carpenter, R.

    1990-02-01

    Optical fiber transmission has many features which make it very attractive for military applications. Furthermore, single mode fiber is superior to multimode fiber in terms of bandwidth, attenuation, radiation resistance and cost. The benefits of single mode optical fiber transmission can be further enhanced with the use of wavelength division multiplexing (WDM) technology in which multiple, independent optical signals may be simultaneously transmitted over a single fiber. This permits single fiber transmission of mixed signal traffic (e.g., digital data, voice, video, analog, etc.) as well as parallel digital traffic characteristic of computer data transfer. In addition, this technology creates new system design options and architectural flexibility for local area networks (LANs). This technical report describes the design and development of the critical element for implementing such a communications link - a 16 channel single mode WDM. Specifically, it describes the development and performance of a grating-based single mode WDM system suitable for use with single longitudinal lasers (e.g., distributed feedback lasers (DFB's)). The 16 channel WDM features channels with 3 dB bandwidths of 2.4 nM and separation of 7.2 nM. Any particular channel can be set to a precise wavelength due to the mechanical design features. End-to-End system channel insertion losses of 12.5 dB have been achieved with adjacent channel crosstalk of better than -25 dB.

  2. Alternative Modes of Inquiry.

    ERIC Educational Resources Information Center

    Friedlander, Frank

    1982-01-01

    Suggests that research on small group behavior, in a wide variety of settings, will be enhanced by rethinking alternative modes of enquiry, e.g., a focus on induction, a study of whole systems of human enterprise, the utilization of subjective experience, and trans-causal thinking. (Author/RC)

  3. Two Modes of Sexuality.

    ERIC Educational Resources Information Center

    Firestone, Robert W.

    This paper describes the essential difference between two modes of sexual relating: (1) a personal, outward style of interaction that is the natural extension of affection, tenderness, and companionship between two people; and (2) an impersonal, inward, more masturbatory expression in which sex is used primarily as a narcotic. The origins of…

  4. Theories and Modes

    ERIC Educational Resources Information Center

    Apsche, Jack A.

    2005-01-01

    In his work on the Theory of Modes, Beck (1996) suggested that there were flaws with his cognitive theory. He suggested that though there are shortcomings to his cognitive theory, there were not similar shortcomings to the practice of Cognitive Therapy. The author suggests that if there are shortcomings to cognitive theory the same shortcomings…

  5. Vibrational modes of nanolines

    NASA Astrophysics Data System (ADS)

    Heyliger, Paul R.; Flannery, Colm M.; Johnson, Ward L.

    2008-04-01

    Brillouin-light-scattering spectra previously have been shown to provide information on acoustic modes of polymeric lines fabricated by nanoimprint lithography. Finite-element methods for modeling such modes are presented here. These methods provide a theoretical framework for determining elastic constants and dimensions of nanolines from measured spectra in the low gigahertz range. To make the calculations feasible for future incorporation in inversion algorithms, two approximations of the boundary conditions are employed in the calculations: the rigidity of the nanoline/substrate interface and sinusoidal variation of displacements along the nanoline length. The accuracy of these approximations is evaluated as a function of wavenumber and frequency. The great advantage of finite-element methods over other methods previously employed for nanolines is the ability to model any cross-sectional geometry. Dispersion curves and displacement patterns are calculated for modes of polymethyl methacrylate nanolines with cross-sectional dimensions of 65 nm × 140 nm and rectangular or semicircular tops. The vibrational displacements and dispersion curves are qualitatively similar for the two geometries and include a series of flexural, Rayleigh-like, and Sezawa-like modes. This paper is a contribution of the National Institute of Standards and Technology and is not subject to copyright in the United States.

  6. List-mode likelihood

    PubMed Central

    Barrett, Harrison H.; White, Timothy; Parra, Lucas C.

    2010-01-01

    As photon-counting imaging systems become more complex, there is a trend toward measuring more attributes of each individual event. In various imaging systems the attributes can include several position variables, time variables, and energies. If more than about four attributes are measured for each event, it is not practical to record the data in an image matrix. Instead it is more efficient to use a simple list where every attribute is stored for every event. It is the purpose of this paper to discuss the concept of likelihood for such list-mode data. We present expressions for list-mode likelihood with an arbitrary number of attributes per photon and for both preset counts and preset time. Maximization of this likelihood can lead to a practical reconstruction algorithm with list-mode data, but that aspect is covered in a separate paper [IEEE Trans. Med. Imaging (to be published)]. An expression for lesion detectability for list-mode data is also derived and compared with the corresponding expression for conventional binned data. PMID:9379247

  7. Synthesize Modes and Correlate

    SciTech Connect

    Mayes, Randall Lee; Hensley, Daniel P.

    2005-10-01

    SMAC is an automated experimental modal parameter extraction package which determines the natural frequencies of vibration, viscous damping ratios and mode shapes from experimental accelerance frequency response functions (FRFs). It is written in the MATLAB interpretive matrix language and has a graphical user interface.

  8. Spectroscopy - so what?

    NASA Astrophysics Data System (ADS)

    Stanley, Matthew

    2010-01-01

    The development of astronomical spectroscopy allowed amazing achievements in investigating the composition and motion of celestial bodies. But even beyond specific measurements and results, the fruitfulness and practice of spectroscopy had important ramifications on a more abstract level. This paper will discuss ways in which spectroscopy inspired or boosted new theories of the atom, life, and the universe; redrew the boundaries among scientific disciplines; demonstrated the unity of terrestrial and celestial physical laws; changed what counted as scientific knowledge; and even revealed divine mysteries. Scientists and science writers from the first half-century of astronomical spectroscopy will be discussed, including James Clerk Maxwell, William Thomson (Lord Kelvin), John Tyndall, Agnes Clerke, William Huggins, and Norman Lockyer.

  9. Gluons in hadron spectroscopy

    SciTech Connect

    Karl, G.

    1985-06-30

    Current hadron spectroscopy is concerned with quark and glounic degrees of freedom which are imaged from the many meson resonances and their decay mechanisms. Interest in the J/psi and the phi resonances is discussed.

  10. Spectroscopy - so what?

    NASA Astrophysics Data System (ADS)

    Stanley, Matthew

    2010-07-01

    The development of astronomical spectroscopy allowed amazing achievements in investigating the composition and motion of celestial bodies. But even beyond specific measurements and results, the fruitfulness and practice of spectroscopy had important ramifications on a more abstract level. This paper will discuss ways in which spectroscopy inspired or boosted new theories of the atom, life, and the Universe; redrew the boundaries among scientific disciplines; demonstrated the unity of terrestrial and celestial physical laws; changed what counted as scientific knowledge; and even revealed divine mysteries. Scientists and science writers from the first half-century of astronomical spectroscopy will be discussed, including James Clerk Maxwell, William Crookes, John Tyndall, Agnes Clerke, William Huggins and Norman Lockyer.

  11. Beam-foil spectroscopy

    SciTech Connect

    Berry, H.G.; Hass, M.

    1982-01-01

    A brief survey of some applications of beam-foil spectroscopy is presented. Among the topics covered are lifetime and magnetic moment measurements, nuclear alignment, and polarized light production. (AIP)

  12. Science Experimenter: Reflectance Spectroscopy.

    ERIC Educational Resources Information Center

    Mims, Forrest M., III

    1991-01-01

    Provides construction details for a simple reflectometer that can be utilized for the observational technique known as reflectance spectroscopy. Includes background discussion, applications, calibrating techniques, and typical results. (JJK)

  13. Charmonium spectroscopy, 1987

    SciTech Connect

    Cahn, R.N.

    1987-07-30

    The state of charmonium spectroscopy is reviewed. All analyses proceed from a spin-dependent, non-relativistic Schroedinger equation. Many of the possible branching ratios for charm like states are investigated. 17 refs.

  14. Enhanced Vibrational Spectroscopies as Tools for Small Molecule Biosensing

    PubMed Central

    Boujday, Souhir; Lamy de la Chapelle, Marc; Srajer, Johannes; Knoll, Wolfgang

    2015-01-01

    In this short summary we summarize some of the latest developments in vibrational spectroscopic tools applied for the sensing of (small) molecules and biomolecules in a label-free mode of operation. We first introduce various concepts for the enhancement of InfraRed spectroscopic techniques, including the principles of Attenuated Total Reflection InfraRed (ATR-IR), (phase-modulated) InfraRed Reflection Absorption Spectroscopy (IRRAS/PM-IRRAS), and Surface Enhanced Infrared Reflection Absorption Spectroscopy (SEIRAS). Particular attention is put on the use of novel nanostructured substrates that allow for the excitation of propagating and localized surface plasmon modes aimed at operating additional enhancement mechanisms. This is then be complemented by the description of the latest development in Surface- and Tip-Enhanced Raman Spectroscopies, again with an emphasis on the detection of small molecules or bioanalytes. PMID:26343666

  15. Two-dimensional Raman-terahertz spectroscopy of water

    PubMed Central

    Savolainen, Janne; Ahmed, Saima; Hamm, Peter

    2013-01-01

    Two-dimensional Raman-terahertz (THz) spectroscopy is presented as a multidimensional spectroscopy directly in the far-IR regime. The method is used to explore the dynamics of the collective intermolecular modes of liquid water at ambient temperatures that emerge from the hydrogen-bond networks water forming. Two-dimensional Raman-THz spectroscopy interrogates these modes twice and as such can elucidate couplings and inhomogeneities of the various degrees of freedoms. An echo in the 2D Raman-THz response is indeed identified, indicating that a heterogeneous distribution of hydrogen-bond networks exists, albeit only on a very short 100-fs timescale. This timescale appears to be too short to be compatible with more extended, persistent structures assumed within a two-state model of water. PMID:24297930

  16. Characterization of Biological Molecules with Time-Domain Terahertz Spectroscopy

    NASA Astrophysics Data System (ADS)

    Bechel, Meagan; Deibel, Jason; Hussian, Saber; Smith, Stanley; Ganti, Sayta; Moulton, Michael

    2010-10-01

    Terahertz (THz) spectroscopy is distinctly appealing for characterization of biological molecules because many biological compounds have vibrational modes within the THz range. These vibrational modes often lead to a unique spectrum for each substance, allowing easy differentiation. The aim of this study is to utilize time-domain terahertz spectroscopy to calculate the frequency-dependent absorption coefficient and refractive index for several amino acids and proteins, including bovine and human serum albumin, glycine, and L- and D-histidine. The histidine study seeks to investigate the optical isomer differention capabilities of THz spectroscopy. It is also hoped that the characterization of proteins will lead to further studies examining the conformational changes related to disease detection.

  17. Enhanced Vibrational Spectroscopies as Tools for Small Molecule Biosensing.

    PubMed

    Boujday, Souhir; de la Chapelle, Marc Lamy; Srajer, Johannes; Knoll, Wolfgang

    2015-08-28

    In this short summary we summarize some of the latest developments in vibrational spectroscopic tools applied for the sensing of (small) molecules and biomolecules in a label-free mode of operation. We first introduce various concepts for the enhancement of InfraRed spectroscopic techniques, including the principles of Attenuated Total Reflection InfraRed (ATR-IR), (phase-modulated) InfraRed Reflection Absorption Spectroscopy (IRRAS/PM-IRRAS), and Surface Enhanced Infrared Reflection Absorption Spectroscopy (SEIRAS). Particular attention is put on the use of novel nanostructured substrates that allow for the excitation of propagating and localized surface plasmon modes aimed at operating additional enhancement mechanisms. This is then be complemented by the description of the latest development in Surface- and Tip-Enhanced Raman Spectroscopies, again with an emphasis on the detection of small molecules or bioanalytes.

  18. EDITORIAL: Nano Meets Spectroscopy Nano Meets Spectroscopy

    NASA Astrophysics Data System (ADS)

    Birch, David J. S.

    2012-08-01

    The multidisciplinary two-day Nano Meets Spectroscopy (NMS) event was held at the National Physical Laboratory (NPL), Teddington, UK, in September 2011. The event was planned from the outset to be at the interface of several areas—in particular, spectroscopy and nanoscience, and to bring together topics and people with different approaches to achieving common goals in biomolecular science. Hence the meeting cut across traditional boundaries and brought together researchers using diverse techniques, particularly fluorescence and Raman spectroscopy. Despite engaging common problems, these techniques are frequently seen as mutually exclusive with the two communities rarely interacting at conferences. The meeting was widely seen to have lived up to its billing in good measure. It attracted the maximum capacity of ~120 participants, including 22 distinguished speakers (9 from outside the UK), over 50 posters and a vibrant corporate exhibition comprising 10 leading instrument companies and IOP Publishing. The organizers were Professor David Birch (Chair), Dr Karen Faulds and Professor Duncan Graham of the University of Strathclyde, Professor Cait MacPhee of the University of Edinburgh and Dr Alex Knight of NPL. The event was sponsored by the European Science Foundation, the Institute of Physics, the Royal Society of Chemistry, NPL and the Scottish Universities Physics Alliance. The full programme and abstracts are available at http://sensor.phys.strath.ac.uk/nms/program.php. The programme was quite ambitious in terms of the breadth and depth of scope. The interdisciplinary and synergistic concept of 'X meets Y' played well, cross-fertilization between different fields often being a source of inspiration and progress. Fluorescence and Raman spectroscopy provided the core, but the meeting had little repetition and also attracted contributions on more specialist techniques such as CARS, super-resolution, single molecule and chiral methods. In terms of application the

  19. Spectroscopy of divertor plasmas

    SciTech Connect

    Isler, R.C.

    1995-12-31

    The requirements for divertor spectroscopy are treated with respect to instrumentation and observations on present machines. Emphasis is placed on quantitative measurements.of impurity concentrations from the interpretation of spectral line intensities. The possible influence of non-Maxwellian electron distributions on spectral line excitation in the divertor is discussed. Finally the use of spectroscopy for determining plasma temperature, density, and flows is examined.

  20. Spectroscopy of D Mesons

    SciTech Connect

    Bianco, Stefano

    2006-02-11

    The scenario of heavy quark meson spectroscopy underwent recently a major revolution, after the observation of BABAR and CLEO, confirmed by BELLE, of DsJ L=1 excited states, and by further evidences by SELEX. These experimental results have cast doubts on the incarnations of the ideas of Heavy Quark Effective Theory in heavy quark spectroscopy. I shall review the status of experimental data, discuss implications and sketch an outlook.

  1. Terrestrial imaging spectroscopy

    NASA Technical Reports Server (NTRS)

    Vane, Gregg; Goetz, Alexander F. H.

    1988-01-01

    Recent advances in imaging spectroscopy for remote sensing applications are discussed, reviewing the results of recent investigations. The advantages offered by the higher spectral resolution of imaging spectroscopy relative to scanners such as Landsat MSS and TM are explained; the design and performance of the Airborne Imaging Spectrometer (Vane et al., 1984) are described and illustrated with drawings, photographs, and sample images; data processing and analysis techniques are outlined; and applications to geological and botanical research are considered.

  2. Terahertz multiheterodyne spectroscopy using laser frequency combs

    SciTech Connect

    Yang, Yang; Burghoff, David; Hayton, Darren J.; Gao, Jian -Rong; Reno, John L.; Hu, Qing

    2014-07-01

    The terahertz region is of great importance for spectroscopy since many molecules have absorption fingerprints there. Frequency combs based on terahertz quantum cascade lasers feature broadband coverage and high output powers in a compact package, making them an attractive option for broadband spectroscopy. Here, we demonstrate the first multiheterodyne spectroscopy using two terahertz quantum cascade laser combs. Over a spectral range of 250 GHz, we achieve average signal-to-noise ratios of 34 dB using cryogenic detectors and 24 dB using room-temperature detectors, all in just 100 μs. As a proof of principle, we use these combs to measure the broadband transmission spectrum of etalon samples and show that, with proper signal processing, it is possible to extend the multiheterodyne spectroscopy to quantum cascade laser combs operating in pulsed mode. Here, this greatly expands the range of quantum cascade lasers that could be suitable for these techniques and allows for the creation of completely solid-state terahertz laser spectrometers.

  3. Terahertz multiheterodyne spectroscopy using laser frequency combs

    DOE PAGES

    Yang, Yang; Burghoff, David; Hayton, Darren J.; ...

    2014-07-01

    The terahertz region is of great importance for spectroscopy since many molecules have absorption fingerprints there. Frequency combs based on terahertz quantum cascade lasers feature broadband coverage and high output powers in a compact package, making them an attractive option for broadband spectroscopy. Here, we demonstrate the first multiheterodyne spectroscopy using two terahertz quantum cascade laser combs. Over a spectral range of 250 GHz, we achieve average signal-to-noise ratios of 34 dB using cryogenic detectors and 24 dB using room-temperature detectors, all in just 100 μs. As a proof of principle, we use these combs to measure the broadband transmissionmore » spectrum of etalon samples and show that, with proper signal processing, it is possible to extend the multiheterodyne spectroscopy to quantum cascade laser combs operating in pulsed mode. Here, this greatly expands the range of quantum cascade lasers that could be suitable for these techniques and allows for the creation of completely solid-state terahertz laser spectrometers.« less

  4. Spectroscopy with trapped highly charged ions

    SciTech Connect

    Beiersdorfer, P

    2008-01-23

    We give an overview of atomic spectroscopy performed on electron beam ion traps at various locations throughout the world. Spectroscopy at these facilities contributes to various areas of science and engineering, including but not limited to basic atomic physics, astrophysics, extreme ultraviolet lithography, and the development of density and temperature diagnostics of fusion plasmas. These contributions are accomplished by generating, for example, spectral surveys, making precise radiative lifetime measurements, accounting for radiative power emitted in a given wavelength band, illucidating isotopic effects, and testing collisional-radiative models. While spectroscopy with electron beam ion traps had originally focused on the x-ray emission from highly charged ions interacting with the electron beam, the operating modes of such devices have expanded to study radiation in almost all wavelength bands from the visible to the hard x-ray region; and at several facilities the ions can be studied even in the absence of an electron beam. Photon emission after charge exchange or laser excitation has been observed, and the work is no longer restricted to highly charged ions. Much of the experimental capabilities are unique to electron beam ion traps, and the work performed with these devices cannot be undertaken elsewhere. However, in other areas the work on electron beam ion traps rivals the spectroscopy performed with conventional ion traps or heavy-ion storage rings. The examples we present highlight many of the capabilities of the existing electron beam ion traps and their contributions to physics.

  5. Electronic Spectroscopy & Dynamics

    SciTech Connect

    Mark Maroncelli, Nancy Ryan Gray

    2010-06-08

    The Gordon Research Conference (GRC) on Electronic Spectroscopy and Dynamics was held at Colby College, Waterville, NH from 07/19/2009 thru 07/24/2009. The Conference was well-attended with participants (attendees list attached). The attendees represented the spectrum of endeavor in this field coming from academia, industry, and government laboratories, both U.S. and foreign scientists, senior researchers, young investigators, and students. The GRC on Electronic Spectroscopy & Dynamics showcases some of the most recent experimental and theoretical developments in electronic spectroscopy that probes the structure and dynamics of isolated molecules, molecules embedded in clusters and condensed phases, and bulk materials. Electronic spectroscopy is an important tool in many fields of research, and this GRC brings together experts having diverse backgrounds in physics, chemistry, biophysics, and materials science, making the meeting an excellent opportunity for the interdisciplinary exchange of ideas and techniques. Topics covered in this GRC include high-resolution spectroscopy, biological molecules in the gas phase, electronic structure theory for excited states, multi-chromophore and single-molecule spectroscopies, and excited state dynamics in chemical and biological systems.

  6. Single transverse mode selectively oxidized vertical cavity lasers

    SciTech Connect

    CHOQUETTE,KENT D.

    2000-04-18

    Vertical cavity surface emitting laser (VCSEL) sources have been adopted into Gigabit Ethernet applications in a remarkably short time period. VCSELs are particularly suitable for multimode optical fiber local area networks (LANs), due to their reduced threshold current, circular output beam, and inexpensive and high volume manufacture. Moreover, selectively oxidized VCSELs are nearly ideal LAN sources since the oxide aperture within the laser cavity produces strong electrical and optical confinement which enables high electrical to optical conversion efficiency and minimal modal discrimination allowing emission into multiple transverse optical modes. In addition to the large demand for multimode lasers, VCSELs which emit into a single optical mode are also increasingly sought for emerging applications, which include data communication with single mode optical fiber, bar code scanning, laser printing, optical read/write heads, and modulation spectroscopy. To achieve single mode selectively oxidized VCSELs is a challenging task, since the inherent index confinement within these high performance lasers is very large.

  7. Microfluidic devices for terahertz spectroscopy of biomolecules.

    PubMed

    George, Paul A; Hui, Wallace; Rana, Farhan; Hawkins, Benjamin G; Smith, A Ezekiel; Kirby, Brian J

    2008-02-04

    We demonstrate microfluidic devices for terahertz spectroscopy of biomolecules in aqueous solutions. The devices are fabricated out of a plastic material that is both mechanically rigid and optically transparent with near-zero dispersion in the terahertz frequency range. Using a lowpower terahertz time-domain spectrometer, we experimentally measure the absorption spectra of the vibrational modes of bovine serum albumin from 0.5 - 2.5 THz and find good agreement with previously reported data obtained using large-volume solutions and a high-power free-electron laser. Our results demonstrate the feasibility of performing high sensitivity terahertz spectroscopy of biomolecules in aqueous solutions with detectable molecular quantities as small as 10 picomoles using microfluidic devices.

  8. One-dimensional frequency-based spectroscopy.

    PubMed

    Cygan, Agata; Wcisło, Piotr; Wójtewicz, Szymon; Masłowski, Piotr; Hodges, Joseph T; Ciuryło, Roman; Lisak, Daniel

    2015-06-01

    Recent developments in optical metrology have tremendously improved the precision and accuracy of the horizontal (frequency) axis in measured spectra. However, the vertical (typically absorbance) axis is usually based on intensity measurements that are subject to instrumental errors which limit the spectrum accuracy. Here we report a one-dimensional spectroscopy that uses only the measured frequencies of high-finesse cavity modes to provide complete information about the dispersive properties of the spectrum. Because this technique depends solely on the measurement of frequencies or their differences, it is insensitive to systematic errors in the detection of light intensity and has the potential to become the most accurate of all absorptive and dispersive spectroscopic methods. The experimental results are compared to measurements by two other high-precision cavity-enhanced spectroscopy methods. We expect that the proposed technique will have significant impact in fields such as fundamental physics, gas metrology and environmental remote sensing.

  9. Broadband Phase Spectroscopy over Turbulent Air Paths

    NASA Astrophysics Data System (ADS)

    Giorgetta, Fabrizio R.; Rieker, Gregory B.; Baumann, Esther; Swann, William C.; Sinclair, Laura C.; Kofler, Jon; Coddington, Ian; Newbury, Nathan R.

    2015-09-01

    Broadband atmospheric phase spectra are acquired with a phase-sensitive dual-frequency-comb spectrometer by implementing adaptive compensation for the strong decoherence from atmospheric turbulence. The compensation is possible due to the pistonlike behavior of turbulence across a single spatial-mode path combined with the intrinsic frequency stability and high sampling speed associated with dual-comb spectroscopy. The atmospheric phase spectrum is measured across 2 km of air at each of the 70 000 comb teeth spanning 233 cm-1 across hundreds of near-infrared rovibrational resonances of CO2 , CH4 , and H2O with submilliradian uncertainty, corresponding to a 10-13 refractive index sensitivity. Trace gas concentrations extracted directly from the phase spectrum reach 0.7 ppm uncertainty, demonstrated here for CO2 . While conventional broadband spectroscopy only measures intensity absorption, this approach enables measurement of the full complex susceptibility even in practical open path sensing.

  10. Exponential protection of zero modes in Majorana islands.

    PubMed

    Albrecht, S M; Higginbotham, A P; Madsen, M; Kuemmeth, F; Jespersen, T S; Nygård, J; Krogstrup, P; Marcus, C M

    2016-03-10

    Majorana zero modes are quasiparticle excitations in condensed matter systems that have been proposed as building blocks of fault-tolerant quantum computers. They are expected to exhibit non-Abelian particle statistics, in contrast to the usual statistics of fermions and bosons, enabling quantum operations to be performed by braiding isolated modes around one another. Quantum braiding operations are topologically protected insofar as these modes are pinned near zero energy, with the departure from zero expected to be exponentially small as the modes become spatially separated. Following theoretical proposals, several experiments have identified signatures of Majorana modes in nanowires with proximity-induced superconductivity and atomic chains, with small amounts of mode splitting potentially explained by hybridization of Majorana modes. Here, we use Coulomb-blockade spectroscopy in an InAs nanowire segment with epitaxial aluminium, which forms a proximity-induced superconducting Coulomb island (a 'Majorana island') that is isolated from normal-metal leads by tunnel barriers, to measure the splitting of near-zero-energy Majorana modes. We observe exponential suppression of energy splitting with increasing wire length. For short devices of a few hundred nanometres, sub-gap state energies oscillate as the magnetic field is varied, as is expected for hybridized Majorana modes. Splitting decreases by a factor of about ten for each half a micrometre of increased wire length. For devices longer than about one micrometre, transport in strong magnetic fields occurs through a zero-energy state that is energetically isolated from a continuum, yielding uniformly spaced Coulomb-blockade conductance peaks, consistent with teleportation via Majorana modes. Our results help to explain the trivial-to-topological transition in finite systems and to quantify the scaling of topological protection with end-mode separation.

  11. Exponential protection of zero modes in Majorana islands

    NASA Astrophysics Data System (ADS)

    Albrecht, S. M.; Higginbotham, A. P.; Madsen, M.; Kuemmeth, F.; Jespersen, T. S.; Nygård, J.; Krogstrup, P.; Marcus, C. M.

    2016-03-01

    Majorana zero modes are quasiparticle excitations in condensed matter systems that have been proposed as building blocks of fault-tolerant quantum computers. They are expected to exhibit non-Abelian particle statistics, in contrast to the usual statistics of fermions and bosons, enabling quantum operations to be performed by braiding isolated modes around one another. Quantum braiding operations are topologically protected insofar as these modes are pinned near zero energy, with the departure from zero expected to be exponentially small as the modes become spatially separated. Following theoretical proposals, several experiments have identified signatures of Majorana modes in nanowires with proximity-induced superconductivity and atomic chains, with small amounts of mode splitting potentially explained by hybridization of Majorana modes. Here, we use Coulomb-blockade spectroscopy in an InAs nanowire segment with epitaxial aluminium, which forms a proximity-induced superconducting Coulomb island (a ‘Majorana island’) that is isolated from normal-metal leads by tunnel barriers, to measure the splitting of near-zero-energy Majorana modes. We observe exponential suppression of energy splitting with increasing wire length. For short devices of a few hundred nanometres, sub-gap state energies oscillate as the magnetic field is varied, as is expected for hybridized Majorana modes. Splitting decreases by a factor of about ten for each half a micrometre of increased wire length. For devices longer than about one micrometre, transport in strong magnetic fields occurs through a zero-energy state that is energetically isolated from a continuum, yielding uniformly spaced Coulomb-blockade conductance peaks, consistent with teleportation via Majorana modes. Our results help to explain the trivial-to-topological transition in finite systems and to quantify the scaling of topological protection with end-mode separation.

  12. Microwave-plasma interactions studied via mode diagnostics in ALPHA

    NASA Astrophysics Data System (ADS)

    Friesen, T.; Andresen, G. B.; Ashkezari, M. D.; Baquero-Ruiz, M.; Bertsche, W.; Bowe, P. D.; Butler, E.; Cesar, C. L.; Chapman, S.; Charlton, M.; Eriksson, S.; Fajans, J.; Fujiwara, M. C.; Gill, D. R.; Gutierrez, A.; Hangst, J. S.; Hardy, W. N.; Hayano, R. S.; Hayden, M. E.; Humphries, A. J.; Hydomako, R.; Jonsell, S.; Kurchaninov, L.; Madsen, N.; Menary, S.; Nolan, P.; Olchanski, K.; Olin, A.; Povilus, A.; Pusa, P.; Robicheaux, F.; Sarid, E.; Silveira, D. M.; So, C.; Storey, J. W.; Thompson, R. I.; van der Werf, D. P.; Wurtele, J. S.; Yamazaki, Y.

    The goal of the ALPHA experiment is the production, trapping and spectroscopy of antihydrogen. A direct comparison of the ground state hyperfine spectra in hydrogen and antihydrogen has the potential to be a high-precision test of CPT symmetry. We present a novel method for measuring the strength of a microwave field for hyperfine spectroscopy in a Penning trap. This method incorporates a non-destructive plasma diagnostic system based on electrostatic modes within an electron plasma. We also show how this technique can be used to measure the cyclotron resonance of the electron plasma, which can potentially serve as a non-destructive measurement of plasma temperature.

  13. Microwave-plasma interactions studied via mode diagnostics in ALPHA

    NASA Astrophysics Data System (ADS)

    Friesen, T.; Andresen, G. B.; Ashkezari, M. D.; Baquero-Ruiz, M.; Bertsche, W.; Bowe, P. D.; Butler, E.; Cesar, C. L.; Chapman, S.; Charlton, M.; Eriksson, S.; Fajans, J.; Fujiwara, M. C.; Gill, D. R.; Gutierrez, A.; Hangst, J. S.; Hardy, W. N.; Hayano, R. S.; Hayden, M. E.; Humphries, A. J.; Hydomako, R.; Jonsell, S.; Kurchaninov, L.; Madsen, N.; Menary, S.; Nolan, P.; Olchanski, K.; Olin, A.; Povilus, A.; Pusa, P.; Robicheaux, F.; Sarid, E.; Silveira, D. M.; So, C.; Storey, J. W.; Thompson, R. I.; van der Werf, D. P.; Wurtele, J. S.; Yamazaki, Y.

    2012-12-01

    The goal of the ALPHA experiment is the production, trapping and spectroscopy of antihydrogen. A direct comparison of the ground state hyperfine spectra in hydrogen and antihydrogen has the potential to be a high-precision test of CPT symmetry. We present a novel method for measuring the strength of a microwave field for hyperfine spectroscopy in a Penning trap. This method incorporates a non-destructive plasma diagnostic system based on electrostatic modes within an electron plasma. We also show how this technique can be used to measure the cyclotron resonance of the electron plasma, which can potentially serve as a non-destructive measurement of plasma temperature.

  14. WEAVE: The Next Generation Spectroscopy Facility for the WHT

    NASA Astrophysics Data System (ADS)

    Dalton, G.

    2016-10-01

    WEAVE will provide ˜1000 multiplex spectroscopy, fed by a new 2 degree field of view at prime focus on the WHT. The prime focus positioner hosts 2 sets of single-fiber 1.3'' MOS pickoffs, 20 small integral field units (˜ 11'×12''), and a single large, ˜ 1.3' × 1.5' integral field unit. These fiber modes feed a single, dual-beam spectrograph located within the WHT's GHRIL enclosure. The spectrograph provides R=5000 spectroscopy over the full range from 366 nm to 950 nm, or two smaller ranges at R=20000. These modes are fixed. The intention of WEAVE is to operate in survey mode with a number of community-driven projects merged into joint science observations. In this paper I summarize the instrument design and performance parameters.

  15. Remote Spectroscopy in the Visible Using Fibers on the Optical Internet Network

    ERIC Educational Resources Information Center

    Ribeiro, Rafael A. S.; de Oliveira, Anderson R.; Zilio, Sergio C.

    2010-01-01

    The work presented here demonstrates the feasibility of using the single-mode fibers of an optical Internet network to deliver visible light between separate laboratories as a way to perform remote spectroscopy in the visible for teaching purposes. The coupling of a broadband light source into the single-mode fiber (SMF) and the characterization…

  16. Remote Spectroscopy in the Visible Using Fibers on the Optical Internet Network

    ERIC Educational Resources Information Center

    Ribeiro, Rafael A. S.; de Oliveira, Anderson R.; Zilio, Sergio C.

    2010-01-01

    The work presented here demonstrates the feasibility of using the single-mode fibers of an optical Internet network to deliver visible light between separate laboratories as a way to perform remote spectroscopy in the visible for teaching purposes. The coupling of a broadband light source into the single-mode fiber (SMF) and the characterization…

  17. Auger spectroscopy of fracture surfaces of ceramics

    NASA Technical Reports Server (NTRS)

    Marcus, H. L.; Harris, J. M.; Szalkowski, F. J.

    1974-01-01

    Results of Auger electron spectroscopy (AES) studies of fracture surfaces in a series of ceramic materials, including Al2O3, MgO, and Si3N4, which were formed using different processing techniques. AES on the fractured surface of a lunar sample is also discussed. Scanning electron micrograph fractography is used to relate the surface chemistry to the failure mode. Combined argon ion sputtering and AES studies demonstrate the local variations in chemistry near the fracture surface. The problems associated with doing AES in insulators are also discussed, and the experimental techniques directed toward solving them are described.

  18. High-resolution flurescence spectroscopy in immunoanalysis

    SciTech Connect

    Grubor, Nenad M.

    2005-01-01

    The work presented in this dissertation combines highly sensitive and selective fluorescence line-narrowing spectroscopy (FLNS) detection with various modes of immunoanalytical techniques. It has been shown that FLNS is capable of directly probing molecules immunocomplexed with antibodies, eliminating analytical ambiguities that may arise from interferences that accompany traditional immunochemical techniques. Moreover, the utilization of highly cross-reactive antibodies for highly specific analyte determination has been demonstrated. Finally, they demonstrate the first example of the spectral resolution of diastereomeric analytes based on their interaction with a cross-reactive antibody.

  19. Characterization of Thalidomide using Raman Spectroscopy

    NASA Astrophysics Data System (ADS)

    Cipriani, Penelope; Smith, Candace Y.

    2008-02-01

    Thalidomide is a potent anticancer therapeutic drug whose mechanism of action has not yet been elucidated. In this report, experimental Raman spectroscopy is used to determine and characterize the vibrational frequencies of the drug. These normal modes are then compared to their quantum mechanical counterparts, which have been computed using density functional theory. Upon analysis of the spectra, we found that there was a high level of agreement between the wavenumbers. As such, this spectroscopic technique may be a viable tool for examining the way in which this drug interacts with its target molecules.

  20. Optical spectroscopy of a nitrogen-hydrogen complex in ZnSe

    SciTech Connect

    Wolk, J.A.; Ager, J.W. III; Duxstad, K.J.; Haller, E.E. |; Taskar, N.R.; Dorman, D.R.; Olego, D.J.

    1994-02-01

    We have observed two local vibrational modes related to H bonded to N acceptors in ZnSe samples. grown by metal organic vapor phase epitaxy. The modes have been seen in both infrared and Raman spectroscopy. The new mode seen at 3194 cm{sup {minus}1} is assigned to an N-H stretching vibrational mode and the mode found at 783 cm{sup {minus}1} is tentatively assigned to an N-H wagging, vibrational mode. Polarized Raman spectroscopy was used to determine that the symmetry of the defect complex is C{sub 3v}, which implies that the H atom is in either a bonding or anti-bonding position.