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Sample records for semiclassical sc initial

  1. Graphics processing units accelerated semiclassical initial value representation molecular dynamics

    Energy Technology Data Exchange (ETDEWEB)

    Tamascelli, Dario; Dambrosio, Francesco Saverio [Dipartimento di Fisica, Università degli Studi di Milano, via Celoria 16, 20133 Milano (Italy); Conte, Riccardo [Department of Chemistry and Cherry L. Emerson Center for Scientific Computation, Emory University, Atlanta, Georgia 30322 (United States); Ceotto, Michele, E-mail: michele.ceotto@unimi.it [Dipartimento di Chimica, Università degli Studi di Milano, via Golgi 19, 20133 Milano (Italy)

    2014-05-07

    This paper presents a Graphics Processing Units (GPUs) implementation of the Semiclassical Initial Value Representation (SC-IVR) propagator for vibrational molecular spectroscopy calculations. The time-averaging formulation of the SC-IVR for power spectrum calculations is employed. Details about the GPU implementation of the semiclassical code are provided. Four molecules with an increasing number of atoms are considered and the GPU-calculated vibrational frequencies perfectly match the benchmark values. The computational time scaling of two GPUs (NVIDIA Tesla C2075 and Kepler K20), respectively, versus two CPUs (Intel Core i5 and Intel Xeon E5-2687W) and the critical issues related to the GPU implementation are discussed. The resulting reduction in computational time and power consumption is significant and semiclassical GPU calculations are shown to be environment friendly.

  2. Time-dependent importance sampling in semiclassical initial value representation calculations for time correlation functions.

    Science.gov (United States)

    Tao, Guohua; Miller, William H

    2011-07-14

    An efficient time-dependent importance sampling method is developed for the Monte Carlo calculation of time correlation functions via the initial value representation (IVR) of semiclassical (SC) theory. A prefactor-free time-dependent sampling function weights the importance of a trajectory based on the magnitude of its contribution to the time correlation function, and global trial moves are used to facilitate the efficient sampling the phase space of initial conditions. The method can be generally applied to sampling rare events efficiently while avoiding being trapped in a local region of the phase space. Results presented in the paper for two system-bath models demonstrate the efficiency of this new importance sampling method for full SC-IVR calculations.

  3. Communication: importance sampling including path correlation in semiclassical initial value representation calculations for time correlation functions.

    Science.gov (United States)

    Pan, Feng; Tao, Guohua

    2013-03-07

    Full semiclassical (SC) initial value representation (IVR) for time correlation functions involves a double phase space average over a set of two phase points, each of which evolves along a classical path. Conventionally, the two initial phase points are sampled independently for all degrees of freedom (DOF) in the Monte Carlo procedure. Here, we present an efficient importance sampling scheme by including the path correlation between the two initial phase points for the bath DOF, which greatly improves the performance of the SC-IVR calculations for large molecular systems. Satisfactory convergence in the study of quantum coherence in vibrational relaxation has been achieved for a benchmark system-bath model with up to 21 DOF.

  4. Time-dependent importance sampling in semiclassical initial value representation calculations for time correlation functions. II. A simplified implementation.

    Science.gov (United States)

    Tao, Guohua; Miller, William H

    2012-09-28

    An efficient time-dependent (TD) Monte Carlo (MC) importance sampling method has recently been developed [G. Tao and W. H. Miller, J. Chem. Phys. 135, 024104 (2011)] for the evaluation of time correlation functions using the semiclassical (SC) initial value representation (IVR) methodology. In this TD-SC-IVR method, the MC sampling uses information from both time-evolved phase points as well as their initial values, and only the "important" trajectories are sampled frequently. Even though the TD-SC-IVR was shown in some benchmark examples to be much more efficient than the traditional time-independent sampling method (which uses only initial conditions), the calculation of the SC prefactor-which is computationally expensive, especially for large systems-is still required for accepted trajectories. In the present work, we present an approximate implementation of the TD-SC-IVR method that is completely prefactor-free; it gives the time correlation function as a classical-like magnitude function multiplied by a phase function. Application of this approach to flux-flux correlation functions (which yield reaction rate constants) for the benchmark H + H(2) system shows very good agreement with exact quantum results. Limitations of the approximate approach are also discussed.

  5. Semiclassical initial value treatment of wave functions

    International Nuclear Information System (INIS)

    Kay, Kenneth G.

    2010-01-01

    A semiclassical initial value approximation for time-independent wave functions, previously derived for integrable systems, is rederived in a form which allows it to be applied to more general systems. The wave function is expressed as an integral over a Lagrangian manifold that is constructed by propagating trajectories from an initial manifold formed on a Poincare surface. Even in the case of bound, integrable systems, it is unnecessary to identify action-angle variables or construct quantizing tori. The approximation is numerically tested for separable and highly chaotic two-dimensional quartic oscillator systems. For the separable (but highly anharmonic) system, the accuracy of the approximation is found to be excellent: overlaps of the semiclassical wave functions with the corresponding quantum wave functions exceed 0.999. For the chaotic system, semiclassical-quantum overlaps are found to range from 0.989 to 0.994, indicating accuracy that is still very good, despite the short classical trajectories used in the calculations.

  6. Semiclassical initial value approximation for Green's function.

    Science.gov (United States)

    Kay, Kenneth G

    2010-06-28

    A semiclassical initial value approximation is obtained for the energy-dependent Green's function. For a system with f degrees of freedom the Green's function expression has the form of a (2f-1)-dimensional integral over points on the energy surface and an integral over time along classical trajectories initiated from these points. This approximation is derived by requiring an integral ansatz for Green's function to reduce to Gutzwiller's semiclassical formula when the integrations are performed by the stationary phase method. A simpler approximation is also derived involving only an (f-1)-dimensional integral over momentum variables on a Poincare surface and an integral over time. The relationship between the present expressions and an earlier initial value approximation for energy eigenfunctions is explored. Numerical tests for two-dimensional systems indicate that good accuracy can be obtained from the initial value Green's function for calculations of autocorrelation spectra and time-independent wave functions. The relative advantages of initial value approximations for the energy-dependent Green's function and the time-dependent propagator are discussed.

  7. Nonadiabatic semiclassical dynamics in the mixed quantum-classical initial value representation

    Science.gov (United States)

    Church, Matthew S.; Hele, Timothy J. H.; Ezra, Gregory S.; Ananth, Nandini

    2018-03-01

    We extend the Mixed Quantum-Classical Initial Value Representation (MQC-IVR), a semiclassical method for computing real-time correlation functions, to electronically nonadiabatic systems using the Meyer-Miller-Stock-Thoss (MMST) Hamiltonian in order to treat electronic and nuclear degrees of freedom (dofs) within a consistent dynamic framework. We introduce an efficient symplectic integration scheme, the MInt algorithm, for numerical time evolution of the phase space variables and monodromy matrix under the non-separable MMST Hamiltonian. We then calculate the probability of transmission through a curve crossing in model two-level systems and show that MQC-IVR reproduces quantum-limit semiclassical results in good agreement with exact quantum methods in one limit, and in the other limit yields results that are in keeping with classical limit semiclassical methods like linearized IVR. Finally, exploiting the ability of the MQC-IVR to quantize different dofs to different extents, we present a detailed study of the extents to which quantizing the nuclear and electronic dofs improves numerical convergence properties without significant loss of accuracy.

  8. Semiclassical scattering in Yang-Mills theory

    International Nuclear Information System (INIS)

    Gould, T.M.; Poppitz, E.R.

    1994-01-01

    A classical solution to the Yang-Mills theory is given a semiclassical interpretation. The boundary value problem on a complex time contour which arises from the semiclassical approximation to multiparticle scattering amplitudes is reviewed and applied to the case of Yang-Mills theory. The solution describes a classically forbidden transition between states with a large average number of particles in the limit g→0. It dominates a transition probability with a semiclassical suppression factor equal to twice the action of the well-known BPST instanton. Hence, it is relevant to the problem of high-energy tunnelling. It describes transitions of unit topological charge for an appropriate time contour. Therefore, it may have a direct interpretation in terms of fermion-number violating processes in electroweak theory. The solution describes a transition between an initial state with parametrically fewer particles than the final state. Thus, it may be relevant to the study of semiclassical initial-state corrections in the limit of a small number of initial particles. The implications of these results for multiparticle production in electroweak theory are also discussed. (orig.)

  9. Geometric constraints in semiclassical initial value representation calculations in Cartesian coordinates: accurate reduction in zero-point energy.

    Science.gov (United States)

    Issack, Bilkiss B; Roy, Pierre-Nicholas

    2005-08-22

    An approach for the inclusion of geometric constraints in semiclassical initial value representation calculations is introduced. An important aspect of the approach is that Cartesian coordinates are used throughout. We devised an algorithm for the constrained sampling of initial conditions through the use of multivariate Gaussian distribution based on a projected Hessian. We also propose an approach for the constrained evaluation of the so-called Herman-Kluk prefactor in its exact log-derivative form. Sample calculations are performed for free and constrained rare-gas trimers. The results show that the proposed approach provides an accurate evaluation of the reduction in zero-point energy. Exact basis set calculations are used to assess the accuracy of the semiclassical results. Since Cartesian coordinates are used, the approach is general and applicable to a variety of molecular and atomic systems.

  10. Signatures of unstable semiclassical trajectories in tunneling

    International Nuclear Information System (INIS)

    Levkov, D G; Panin, A G; Sibiryakov, S M

    2009-01-01

    It was found recently that processes of multidimensional tunneling are generally described at high energies by unstable semiclassical trajectories. We study two observational signatures related to the instability of trajectories. First, we find an additional power-law dependence of the tunneling probability on the semiclassical parameter as compared to the standard case of potential tunneling. The second signature is a substantial widening of the probability distribution over final-state quantum numbers. These effects are studied using a modified semiclassical technique which incorporates stabilization of the tunneling trajectories. The technique is derived from first principles. We obtain expressions for the inclusive and exclusive tunneling probabilities in the case of unstable semiclassical trajectories. We also investigate the 'phase transition' between the cases of stable and unstable trajectories across certain 'critical' values of energy. Finally, we derive the relation between the semiclassical probabilities of tunneling from the low-lying and highly excited initial states. This puts on firm ground a conjecture made previously in the semiclassical description of collision-induced tunneling in field theory

  11. Linearized semiclassical initial value time correlation functions with maximum entropy analytic continuation.

    Science.gov (United States)

    Liu, Jian; Miller, William H

    2008-09-28

    The maximum entropy analytic continuation (MEAC) method is used to extend the range of accuracy of the linearized semiclassical initial value representation (LSC-IVR)/classical Wigner approximation for real time correlation functions. LSC-IVR provides a very effective "prior" for the MEAC procedure since it is very good for short times, exact for all time and temperature for harmonic potentials (even for correlation functions of nonlinear operators), and becomes exact in the classical high temperature limit. This combined MEAC+LSC/IVR approach is applied here to two highly nonlinear dynamical systems, a pure quartic potential in one dimensional and liquid para-hydrogen at two thermal state points (25 and 14 K under nearly zero external pressure). The former example shows the MEAC procedure to be a very significant enhancement of the LSC-IVR for correlation functions of both linear and nonlinear operators, and especially at low temperature where semiclassical approximations are least accurate. For liquid para-hydrogen, the LSC-IVR is seen already to be excellent at T=25 K, but the MEAC procedure produces a significant correction at the lower temperature (T=14 K). Comparisons are also made as to how the MEAC procedure is able to provide corrections for other trajectory-based dynamical approximations when used as priors.

  12. Semiclassical modelling of finite-pulse effects on non-adiabatic photodynamics via initial condition filtering: The predissociation of NaI as a test case

    Energy Technology Data Exchange (ETDEWEB)

    Martínez-Mesa, Aliezer [Departmento de Física Teórica, Universidad de la Habana, San Lázaro y L, La Habana 10400 (Cuba); Institut für Chemie, Universität Potsdam, Karl-Liebknecht-Strasse 24-25, D-14476 Potsdam-Golm (Germany); Saalfrank, Peter [Institut für Chemie, Universität Potsdam, Karl-Liebknecht-Strasse 24-25, D-14476 Potsdam-Golm (Germany)

    2015-05-21

    Femtosecond-laser pulse driven non-adiabatic spectroscopy and dynamics in molecular and condensed phase systems continue to be a challenge for theoretical modelling. One of the main obstacles is the “curse of dimensionality” encountered in non-adiabatic, exact wavepacket propagation. A possible route towards treating complex molecular systems is via semiclassical surface-hopping schemes, in particular if they account not only for non-adiabatic post-excitation dynamics but also for the initial optical excitation. One such approach, based on initial condition filtering, will be put forward in what follows. As a simple test case which can be compared with exact wavepacket dynamics, we investigate the influence of the different parameters determining the shape of a laser pulse (e.g., its finite width and a possible chirp) on the predissociation dynamics of a NaI molecule, upon photoexcitation of the A(0{sup +}) state. The finite-pulse effects are mapped into the initial conditions for semiclassical surface-hopping simulations. The simulated surface-hopping diabatic populations are in qualitative agreement with the quantum mechanical results, especially concerning the subpicosend photoinduced dynamics, the main deviations being the relative delay of the non-adiabatic transitions in the semiclassical picture. Likewise, these differences in the time-dependent electronic populations calculated via the semiclassical and the quantum methods are found to have a mild influence on the overall probability density distribution. As a result, the branching ratios between the bound and the dissociative reaction channels and the time-evolution of the molecular wavepacket predicted by the semiclassical method agree with those computed using quantum wavepacket propagation. Implications for more challenging molecular systems are given.

  13. Semiclassical propagation of Wigner functions.

    Science.gov (United States)

    Dittrich, T; Gómez, E A; Pachón, L A

    2010-06-07

    We present a comprehensive study of semiclassical phase-space propagation in the Wigner representation, emphasizing numerical applications, in particular as an initial-value representation. Two semiclassical approximation schemes are discussed. The propagator of the Wigner function based on van Vleck's approximation replaces the Liouville propagator by a quantum spot with an oscillatory pattern reflecting the interference between pairs of classical trajectories. Employing phase-space path integration instead, caustics in the quantum spot are resolved in terms of Airy functions. We apply both to two benchmark models of nonlinear molecular potentials, the Morse oscillator and the quartic double well, to test them in standard tasks such as computing autocorrelation functions and propagating coherent states. The performance of semiclassical Wigner propagation is very good even in the presence of marked quantum effects, e.g., in coherent tunneling and in propagating Schrodinger cat states, and of classical chaos in four-dimensional phase space. We suggest options for an effective numerical implementation of our method and for integrating it in Monte-Carlo-Metropolis algorithms suitable for high-dimensional systems.

  14. On the initial conditions and solutions of the semi-classical Einstein equations in a cosmological scenario

    International Nuclear Information System (INIS)

    Pinamonti, Nicola

    2010-01-01

    In this paper we discuss the backreaction of a massive quantum scalar field on the curvature, the latter treated as a classical field. Furthermore, we deal with this problem in the realm of cosmological spacetime by analyzing the Einstein equations in a semiclassical fashion. More precisely, we show that, at least on small intervals of time, solutions for this interacting system exist. This result is achieved furnishing an iteration scheme and showing that it converges in the appropriate Banach space. Moreover, we show that the quantum states with good ultraviolet behavior (Hadamard property) used in order to obtain the backreaction will be completely individuated by their form on the initial surface if chosen to be lightlike. On large intervals of time the situation is more complicated but, if the spacetime is expanding, we show that the end limiting point of the evolution does not depend strongly on the quantum state, because, in this limit, the expectation values of the matter fields responsible for the backreaction do not depend on the particular homogeneous Hadamard state at all. Finally, we comment on the interpretation of the semiclassical Einstein equations for this kind of problems. Although the fluctuations of the expectation values of pointlike fields diverge, if the spacetime and the quantum state have a large spatial symmetry and if we consider the smeared fields on regions of large spatial volume, they tend to vanish. Assuming this point of view the semiclassical Einstein equations become more reliable. (orig.)

  15. On the initial conditions and solutions of the semi-classical Einstein equations in a cosmological scenario

    Energy Technology Data Exchange (ETDEWEB)

    Pinamonti, Nicola [Hamburg Univ. (Germany). 2. Inst. fuer Theoretische Physik

    2010-01-15

    In this paper we discuss the backreaction of a massive quantum scalar field on the curvature, the latter treated as a classical field. Furthermore, we deal with this problem in the realm of cosmological spacetime by analyzing the Einstein equations in a semiclassical fashion. More precisely, we show that, at least on small intervals of time, solutions for this interacting system exist. This result is achieved furnishing an iteration scheme and showing that it converges in the appropriate Banach space. Moreover, we show that the quantum states with good ultraviolet behavior (Hadamard property) used in order to obtain the backreaction will be completely individuated by their form on the initial surface if chosen to be lightlike. On large intervals of time the situation is more complicated but, if the spacetime is expanding, we show that the end limiting point of the evolution does not depend strongly on the quantum state, because, in this limit, the expectation values of the matter fields responsible for the backreaction do not depend on the particular homogeneous Hadamard state at all. Finally, we comment on the interpretation of the semiclassical Einstein equations for this kind of problems. Although the fluctuations of the expectation values of pointlike fields diverge, if the spacetime and the quantum state have a large spatial symmetry and if we consider the smeared fields on regions of large spatial volume, they tend to vanish. Assuming this point of view the semiclassical Einstein equations become more reliable. (orig.)

  16. Semiclassical limit and well-posedness of nonlinear Schrodinger-Poisson systems

    Directory of Open Access Journals (Sweden)

    Hailiang Li

    2003-09-01

    Full Text Available This paper concerns the well-posedness and semiclassical limit of nonlinear Schrodinger-Poisson systems. We show the local well-posedness and the existence of semiclassical limit of the two models for initial data with Sobolev regularity, before shocks appear in the limit system. We establish the existence of a global solution and show the time-asymptotic behavior of a classical solutions of Schrodinger-Poisson system for a fixed re-scaled Planck constant.

  17. Semiclassical methods for nonseparable systems

    International Nuclear Information System (INIS)

    Garrett, B.C.

    1977-08-01

    Semiclassical techniques have been widely used for describing the dynamics of molecular collisions. The calculation of discrete energy eigenvalue spectra in bound systems has also employed semiclassical methods. Work has been done toward developing semiclassical theories for rate constants in reactive systems and semiclassical eigenvalues in bound systems. Application of these theories have been made to nonseparable multidimensional systems. Transition-state theory has played an important role in chemical kinetics, and is very useful for approximating reaction rate constants for molecular systems. Many shortcomings of transition-state theory can be attributed to the assumption of separability of motion along the reaction coordinate. Semiclassical approximations have been made to the quantum rate expression, and the resulting semiclassical theory has been applied to the reactive H + H 2 system. Comparison of this nonseparable theory with quantum scattering calculations shows agreement which is quite good. Although the quantum condition for one-dimensional bound systems is well-known, generalization of these results to multidimensional nonseparable systems is not obvious. Work has been done toward a semiclassical quantum condition which is closest to the approach of Born. The Hamilton--Jacobi equation for the systems is solved in action--angle variables; in this way the classical Hamiltonian can be expressed as a function of action variables which are constants of motion for the system. Requiring the action variables to be integers provides the semiclassical eigenvalues. Numerical calculations have been performed on a two-dimensional coupled potential well with good agreement with the quantum eigenvalues. 18 figures, 6 tables

  18. Fermions Tunneling from Higher-Dimensional Reissner-Nordström Black Hole: Semiclassical and Beyond Semiclassical Approximation

    Directory of Open Access Journals (Sweden)

    ShuZheng Yang

    2016-01-01

    Full Text Available Based on semiclassical tunneling method, we focus on charged fermions tunneling from higher-dimensional Reissner-Nordström black hole. We first simplify the Dirac equation by semiclassical approximation, and then a semiclassical Hamilton-Jacobi equation is obtained. Using the Hamilton-Jacobi equation, we study the Hawking temperature and fermions tunneling rate at the event horizon of the higher-dimensional Reissner-Nordström black hole space-time. Finally, the correct entropy is calculation by the method beyond semiclassical approximation.

  19. Improved multidimensional semiclassical tunneling theory.

    Science.gov (United States)

    Wagner, Albert F

    2013-12-12

    We show that the analytic multidimensional semiclassical tunneling formula of Miller et al. [Miller, W. H.; Hernandez, R.; Handy, N. C.; Jayatilaka, D.; Willets, A. Chem. Phys. Lett. 1990, 172, 62] is qualitatively incorrect for deep tunneling at energies well below the top of the barrier. The origin of this deficiency is that the formula uses an effective barrier weakly related to the true energetics but correctly adjusted to reproduce the harmonic description and anharmonic corrections of the reaction path at the saddle point as determined by second order vibrational perturbation theory. We present an analytic improved semiclassical formula that correctly includes energetic information and allows a qualitatively correct representation of deep tunneling. This is done by constructing a three segment composite Eckart potential that is continuous everywhere in both value and derivative. This composite potential has an analytic barrier penetration integral from which the semiclassical action can be derived and then used to define the semiclassical tunneling probability. The middle segment of the composite potential by itself is superior to the original formula of Miller et al. because it incorporates the asymmetry of the reaction barrier produced by the known reaction exoergicity. Comparison of the semiclassical and exact quantum tunneling probability for the pure Eckart potential suggests a simple threshold multiplicative factor to the improved formula to account for quantum effects very near threshold not represented by semiclassical theory. The deep tunneling limitations of the original formula are echoed in semiclassical high-energy descriptions of bound vibrational states perpendicular to the reaction path at the saddle point. However, typically ab initio energetic information is not available to correct it. The Supporting Information contains a Fortran code, test input, and test output that implements the improved semiclassical tunneling formula.

  20. Semiclassical soliton ensembles for the focusing nonlinear Schrödinger equation

    CERN Document Server

    Kamvissis, Spyridon; Miller, Peter D

    2003-01-01

    This book represents the first asymptotic analysis, via completely integrable techniques, of the initial value problem for the focusing nonlinear Schrödinger equation in the semiclassical asymptotic regime. This problem is a key model in nonlinear optical physics and has increasingly important applications in the telecommunications industry. The authors exploit complete integrability to establish pointwise asymptotics for this problem's solution in the semiclassical regime and explicit integration for the underlying nonlinear, elliptic, partial differential equations suspected of governing

  1. Design and initial characterization of the SC-200 proteomics standard mixture.

    Science.gov (United States)

    Bauman, Andrew; Higdon, Roger; Rapson, Sean; Loiue, Brenton; Hogan, Jason; Stacy, Robin; Napuli, Alberto; Guo, Wenjin; van Voorhis, Wesley; Roach, Jared; Lu, Vincent; Landorf, Elizabeth; Stewart, Elizabeth; Kolker, Natali; Collart, Frank; Myler, Peter; van Belle, Gerald; Kolker, Eugene

    2011-01-01

    High-throughput (HTP) proteomics studies generate large amounts of data. Interpretation of these data requires effective approaches to distinguish noise from biological signal, particularly as instrument and computational capacity increase and studies become more complex. Resolving this issue requires validated and reproducible methods and models, which in turn requires complex experimental and computational standards. The absence of appropriate standards and data sets for validating experimental and computational workflows hinders the development of HTP proteomics methods. Most protein standards are simple mixtures of proteins or peptides, or undercharacterized reference standards in which the identity and concentration of the constituent proteins is unknown. The Seattle Children's 200 (SC-200) proposed proteomics standard mixture is the next step toward developing realistic, fully characterized HTP proteomics standards. The SC-200 exhibits a unique modular design to extend its functionality, and consists of 200 proteins of known identities and molar concentrations from 6 microbial genomes, distributed into 10 molar concentration tiers spanning a 1,000-fold range. We describe the SC-200's design, potential uses, and initial characterization. We identified 84% of SC-200 proteins with an LTQ-Orbitrap and 65% with an LTQ-Velos (false discovery rate = 1% for both). There were obvious trends in success rate, sequence coverage, and spectral counts with protein concentration; however, protein identification, sequence coverage, and spectral counts vary greatly within concentration levels.

  2. Foundation of the semiclassical approximation by means of path integral methods

    International Nuclear Information System (INIS)

    Krisztinkovics, F.

    1984-01-01

    The aim of our study is to find a technically unique semiclassical treatment to describe the collision processes between heavy ions. Thereby it shall be started from a complete quantum mechanical formulation of the collision process. This aim requires: 1. A completely quantum mechanical initial formulation for the whole system, 2. a unique and conceptually clear transition to semiclassics. In order to fulfil the requirements a method is offered which is in closest connection with the Feynman propagator respectively influence functional. (orig./HSI) [de

  3. Quantum Dynamical Behaviour in Complex Systems - A Semiclassical Approach

    Energy Technology Data Exchange (ETDEWEB)

    Ananth, Nandini [Univ. of California, Berkeley, CA (United States)

    2008-01-01

    One of the biggest challenges in Chemical Dynamics is describing the behavior of complex systems accurately. Classical MD simulations have evolved to a point where calculations involving thousands of atoms are routinely carried out. Capturing coherence, tunneling and other such quantum effects for these systems, however, has proven considerably harder. Semiclassical methods such as the Initial Value Representation (SC-IVR) provide a practical way to include quantum effects while still utilizing only classical trajectory information. For smaller systems, this method has been proven to be most effective, encouraging the hope that it can be extended to deal with a large number of degrees of freedom. Several variations upon the original idea of the SCIVR have been developed to help make these larger calculations more tractable; these range from the simplest, classical limit form, the Linearized IVR (LSC-IVR) to the quantum limit form, the Exact Forward-Backward version (EFB-IVR). In this thesis a method to tune between these limits is described which allows us to choose exactly which degrees of freedom we wish to treat in a more quantum mechanical fashion and to what extent. This formulation is called the Tuning IVR (TIVR). We further describe methodology being developed to evaluate the prefactor term that appears in the IVR formalism. The regular prefactor is composed of the Monodromy matrices (jacobians of the transformation from initial to finial coordinates and momenta) which are time evolved using the Hessian. Standard MD simulations require the potential surfaces and their gradients, but very rarely is there any information on the second derivative. We would like to be able to carry out the SC-IVR calculation without this information too. With this in mind a finite difference scheme to obtain the Hessian on-the-fly is proposed. Wealso apply the IVR formalism to a few problems of current interest. A method to obtain energy eigenvalues accurately for complex

  4. Quantum-mechanical vs. semi-classical spectral-line widths and shifts from the line core in the non-impact region for the Ar-perturbed/ K-radiator system

    International Nuclear Information System (INIS)

    Kreye, W.C.

    2007-01-01

    New quantum-mechanical (QM) and semi-classical (SC) shifts (d's) and widths (HWHM's, w's) were measured from the line core of computed full spectral-line shapes for the Ar-perturbed/K-radiator system (K/Ar). The initial state of our model was based on a 4p 2 P 3/2,1/2 pseudo-potential for the K/Ar system, and the final state on a zero potential. The Fourier transform of the line shape formed the basis for the computations. Excellent agreement was found between the QM and SC values of d and of w in a high-pressure (P) non-impact region, which was characterized by a √P dependence of w and a P dependence of d. These agreements were shown to be another example of a correspondence between classical (SC) quantities and QM quantities in the limit of large quantum numbers. Typically at P=1x10 6 Torr and T=400 K, w QM =448 cm -1 and w SC =479 cm -1 , where the deviation from the mean is ±3.3%. Also, d QM =-3815 cm -1 and d SC =-3716 cm -1 , where the deviation from the mean is ±1.3%. A new general method was formulated which yielded a definite pressure P 0 , which was defined as an upper limit to the low-pressure impact approximation and a lower limit to the non-impact region

  5. Interior design of a two-dimensional semiclassical black hole: Quantum transition across the singularity

    International Nuclear Information System (INIS)

    Levanony, Dana; Ori, Amos

    2010-01-01

    We study the internal structure of a two-dimensional dilatonic evaporating black hole based on the Callan, Giddings, Harvey, and Strominger model. At the semiclassical level, a (weak) spacelike singularity was previously found to develop inside the black hole. We employ here a simplified quantum formulation of spacetime dynamics in the neighborhood of this singularity, using a minisuperspace-like approach. Quantum evolution is found to be regular and well defined at the semiclassical singularity. A well-localized initial wave packet propagating towards the singularity bounces off the latter and retains its well-localized form. Our simplified quantum treatment thus suggests that spacetime may extend semiclassically beyond the singularity, and also signifies the specific extension.

  6. Interior design of a two-dimensional semiclassical black hole: Quantum transition across the singularity

    Science.gov (United States)

    Levanony, Dana; Ori, Amos

    2010-05-01

    We study the internal structure of a two-dimensional dilatonic evaporating black hole based on the Callan, Giddings, Harvey, and Strominger model. At the semiclassical level, a (weak) spacelike singularity was previously found to develop inside the black hole. We employ here a simplified quantum formulation of spacetime dynamics in the neighborhood of this singularity, using a minisuperspace-like approach. Quantum evolution is found to be regular and well defined at the semiclassical singularity. A well-localized initial wave packet propagating towards the singularity bounces off the latter and retains its well-localized form. Our simplified quantum treatment thus suggests that spacetime may extend semiclassically beyond the singularity, and also signifies the specific extension.

  7. Superluminal warp drives are semiclassically unstable

    Energy Technology Data Exchange (ETDEWEB)

    Finazzi, S; Liberati, S [SISSA, via Beirut 2-4, Trieste 34151, Italy and INFN sezione di Trieste (Italy); Barcelo, C, E-mail: finazzi@sissa.i, E-mail: liberati@sissa.i, E-mail: carlos@iaa.e [Instituto de Astrofisica de AndalucIa, CSIC, Camino Bajo de Huetor 50, 18008 Granada (Spain)

    2010-04-01

    Warp drives are very interesting configurations of General Relativity: they provide a way to travel at superluminal speeds, albeit at the cost of requiring exotic matter to build them. Even if one succeeded in providing the necessary exotic matter, it would still be necessary to check whether they would survive to the switching on of quantum effects. Semiclassical corrections to warp-drive geometries created out of an initially flat spacetime have been analyzed in a previous work by the present authors in special locations, close to the wall of the bubble and in its center. Here, we present an exact numerical analysis of the renormalized stress-energy tensor (RSET) in the whole bubble. We find that the the RSET will exponentially grow in time close to the front wall of the superluminal bubble, after some transient terms have disappeared, hence strongly supporting our previous conclusion that the warp-drive geometries are unstable against semiclassical back-reaction. This result seems to implement the chronology protection conjecture, forbiddig the set up of a structure potentially dangerous for causality.

  8. Gaussian and 1/N approximations in semiclassical cosmology

    International Nuclear Information System (INIS)

    Mazzitelli, F.D.; Paz, J.P.

    1989-01-01

    We study the λphi 4 theory and the interacting O(N) model in a curved background using the Gaussian approximation for the former and the large-N approximation for the latter. We obtain the renormalized version of the semiclassical Einstein equations having in mind a future application of these models to investigate the physics of the very early Universe. We show that, while the Gaussian approximation has two different phases, in the large-N limit only one is present. The different features of the two phases are analyzed at the level of the effective field equations. We discuss the initial-value problem and find the initial conditions that make the theory renormalizable. As an example, we study the de Sitter self-consistent solutions of the semiclassical Einstein equations. Finally, for an identically zero mean value of the field we find the evolution equations for the classical field Ω(x) = (λ 2 >)/sup 1/2/ and the spacetime metric. They are very similar to the ones obtained by replacing the classical potential by the one-loop effective potential in the classical equations but do not have the drawbacks of the one-loop approximation

  9. Semiclassical versus exact quantization of the Sinh-Gordon model

    Energy Technology Data Exchange (ETDEWEB)

    Grossehelweg, Juliane

    2009-12-15

    In this work we investigate the semiclassics of the Sinh-Gordon model. The Sinh-Gordon model is integrable, its explicit solutions of the classical and the quantum model are well known. This allows for a comprehensive investigation of the semiclassical quantization of the classical model as well as of the semiclassical limit of the exact quantum solution. Semiclassical means in this case that the key objects of quantum theory are constructed as formal power series. A quantity playing an important role in the quantum theory is the Q-function. The purpose of this work is to investigate to what extend the classical integrability of the model admits of a construction of the semiclassical expansion of the Q-function. Therefore we used two conceptual independent approaches. In the one approach we start from the exact nonperturbative solution of the quantum model and calculate the semiclassical limit up to the next to leading order. Thereby we found the spectral curve, as well as the semiclassical expansion of the Q-function and of the eigenvalue of the monodromy matrix. In the other approach we constructed the first two orders of the semiclassical expansion of the Q-function, starting from the classical solution theory. The results of both approaches coincide. (orig.)

  10. Coherent semiclassical states for loop quantum cosmology

    International Nuclear Information System (INIS)

    Corichi, Alejandro; Montoya, Edison

    2011-01-01

    The spatially flat Friedmann-Robertson-Walker cosmological model with a massless scalar field in loop quantum cosmology admits a description in terms of a completely solvable model. This has been used to prove that: (i) the quantum bounce that replaces the big bang singularity is generic; (ii) there is an upper bound on the energy density for all states, and (iii) semiclassical states at late times had to be semiclassical before the bounce. Here we consider a family of exact solutions to the theory, corresponding to generalized coherent Gaussian and squeezed states. We analyze the behavior of basic physical observables and impose restrictions on the states based on physical considerations. These turn out to be enough to select, from all the generalized coherent states, those that behave semiclassical at late times. We study then the properties of such states near the bounce where the most 'quantum behavior' is expected. As it turns out, the states remain sharply peaked and semiclassical at the bounce and the dynamics is very well approximated by the ''effective theory'' throughout the time evolution. We compare the semiclassicality properties of squeezed states to those of the Gaussian semiclassical states and conclude that the Gaussians are better behaved. In particular, the asymmetry in the relative fluctuations before and after the bounce are negligible, thus ruling out claims of so-called 'cosmic forgetfulness'.

  11. Semiclassical analysis of loop quantum gravity

    International Nuclear Information System (INIS)

    Conrady, F.

    2005-01-01

    In this Ph.D. thesis, we explore and develop new methods that should help in determining an effective semiclassical description of canonical loop quantum gravity and spin foam gravity. A brief introduction to loop quantum gravity is followed by three research papers that present the results of the Ph.D. project. In the first article, we deal with the problem of time and a new proposal for implementing proper time as boundary conditions in a sum over histories: we investigate a concrete realization of this formalism for free scalar field theory. In the second article, we translate semiclassical states of linearized gravity into states of loop quantum gravity. The properties of the latter indicate how semiclassicality manifests itself in the loop framework, and how this may be exploited for doing semiclassical expansions. In the third part, we propose a new formulation of spin foam models that is fully triangulation- and background-independent: by means of a symmetry condition, we identify spin foam models whose triangulation-dependence can be naturally removed. (orig.)

  12. Semiclassical analysis of loop quantum gravity

    Energy Technology Data Exchange (ETDEWEB)

    Conrady, F.

    2005-10-17

    In this Ph.D. thesis, we explore and develop new methods that should help in determining an effective semiclassical description of canonical loop quantum gravity and spin foam gravity. A brief introduction to loop quantum gravity is followed by three research papers that present the results of the Ph.D. project. In the first article, we deal with the problem of time and a new proposal for implementing proper time as boundary conditions in a sum over histories: we investigate a concrete realization of this formalism for free scalar field theory. In the second article, we translate semiclassical states of linearized gravity into states of loop quantum gravity. The properties of the latter indicate how semiclassicality manifests itself in the loop framework, and how this may be exploited for doing semiclassical expansions. In the third part, we propose a new formulation of spin foam models that is fully triangulation- and background-independent: by means of a symmetry condition, we identify spin foam models whose triangulation-dependence can be naturally removed. (orig.)

  13. Semiclassical analysis of the kicked Rydberg atom

    International Nuclear Information System (INIS)

    Yoshida, S.; Persson, E.; Burgdoerfer, J.; Grossmann, F.; Reinhold, C.

    2001-01-01

    Full text: The kicked atom is known as the testing ground for the study of quantum chaos and proven to show the quantum localization as the scarred wavefunction while the corresponding classical counterpart shows chaotic behavior. This apparent contradiction between the ubiquitousness of classical chaotic dynamics and the lack thereof in quantum dynamics brings into focus the open problem of a semiclassical description of quantum localization. We analyze the kicked atom using a semiclassical approximation based on Gaussian wave packets (Herman-Kluk Propagator) and examine the semiclassical manifestation of quantum localization. (author)

  14. Strong semiclassical approximation of Wigner functions for the Hartree dynamics

    KAUST Repository

    Athanassoulis, Agissilaos; Paul, Thierry; Pezzotti, Federica; Pulvirenti, Mario

    2011-01-01

    We consider the Wigner equation corresponding to a nonlinear Schrödinger evolution of the Hartree type in the semiclassical limit h → 0. Under appropriate assumptions on the initial data and the interaction potential, we show that the Wigner function is close in L 2 to its weak limit, the solution of the corresponding Vlasov equation. The strong approximation allows the construction of semiclassical operator-valued observables, approximating their quantum counterparts in Hilbert-Schmidt topology. The proof makes use of a pointwise-positivity manipulation, which seems necessary in working with the L 2 norm and the precise form of the nonlinearity. We employ the Husimi function as a pivot between the classical probability density and the Wigner function, which - as it is well known - is not pointwise positive in general.

  15. Modified semiclassical approximation for trapped Bose gases

    International Nuclear Information System (INIS)

    Yukalov, V.I.

    2005-01-01

    A generalization of the semiclassical approximation is suggested allowing for an essential extension of its region of applicability. In particular, it becomes possible to describe Bose-Einstein condensation of a trapped gas in low-dimensional traps and in traps of low confining dimensions, for which the standard semiclassical approximation is not applicable. The result of the modified approach is shown to coincide with purely quantum-mechanical calculations for harmonic traps, including the one-dimensional harmonic trap. The advantage of the semiclassical approximation is in its simplicity and generality. Power-law potentials of arbitrary powers are considered. The effective thermodynamic limit is defined for any confining dimension. The behavior of the specific heat, isothermal compressibility, and density fluctuations is analyzed, with an emphasis on low confining dimensions, where the usual semiclassical method fails. The peculiarities of the thermodynamic characteristics in the effective thermodynamic limit are discussed

  16. The semiclassical way to dynamics and spectroscopy

    CERN Document Server

    Heller, Eric

    2018-01-01

    Physical systems have been traditionally described in terms of either classical or quantum mechanics. But in recent years, semiclassical methods have developed rapidly, providing deep physical insight and computational tools for quantum dynamics and spectroscopy. In this book, Eric Heller introduces and develops this subject, demonstrating its power with many examples. In the first half of the book, Heller covers relevant aspects of classical mechanics, building from them the semiclassical way through the semiclassical limit of the Feynman path integral. The second half of the book applies this approach to various kinds of spectroscopy, such as molecular spectroscopy and electron imaging and quantum dynamical systems with an emphasis on tunneling. Adopting a distinctly time-dependent viewpoint, Heller argues for semiclassical theories from experimental and theoretical vantage points valuable to research in physics and chemistry. Featuring more than two hundred figures, the book provides a geometric, phase-sp...

  17. Semiclassical dynamics and magnetic Weyl calculus

    International Nuclear Information System (INIS)

    Lein, Maximilian Stefan

    2011-01-01

    Weyl quantization and related semiclassical techniques can be used to study conduction properties of crystalline solids subjected to slowly-varying, external electromagnetic fields. The case where the external magnetic field is constant, is not covered by existing theory as proofs involving usual Weyl calculus break down. This is the regime of the so-called quantum Hall effect where quantization of transverse conductance is observed. To rigorously derive semiclassical equations of motion, one needs to systematically develop a magnetic Weyl calculus which contains a semiclassical parameter. Mathematically, the operators involved in the analysis are magnetic pseudodifferential operators, a topic which by itself is of interest for the mathematics and mathematical physics community alike. Hence, we will devote two additional chapters to further understanding of properties of those operators. (orig.)

  18. Semi-classical quantization of chaotic billiards

    International Nuclear Information System (INIS)

    Smilansky, U.

    1992-02-01

    The semi-classical quantization of chaotic billiards will be developed using scattering theory approach. This will be used to introduce and explain the inherent difficulties in the semi-classical quantization of chaos, and to show some of the modern tools which were developed recently to overcome these difficulties. To this end, we shall first obtain a semi-classical secular equation which is based on a finite number of classical periodic orbits. We shall use it to derive some spectral properties, and in particular to investigate the relationship between spectral statistics of quantum chaotic systems and the predictions of random-matrix theory. We shall finally discuss an important family of chaotic billiard, whose statistics does not follow any of the canonical ensembles, (GOE,GUE,...) but rather, corresponds to a new universality class. (author)

  19. Semiclassical dynamics and magnetic Weyl calculus

    Energy Technology Data Exchange (ETDEWEB)

    Lein, Maximilian Stefan

    2011-01-19

    Weyl quantization and related semiclassical techniques can be used to study conduction properties of crystalline solids subjected to slowly-varying, external electromagnetic fields. The case where the external magnetic field is constant, is not covered by existing theory as proofs involving usual Weyl calculus break down. This is the regime of the so-called quantum Hall effect where quantization of transverse conductance is observed. To rigorously derive semiclassical equations of motion, one needs to systematically develop a magnetic Weyl calculus which contains a semiclassical parameter. Mathematically, the operators involved in the analysis are magnetic pseudodifferential operators, a topic which by itself is of interest for the mathematics and mathematical physics community alike. Hence, we will devote two additional chapters to further understanding of properties of those operators. (orig.)

  20. Semiclassical dynamics

    International Nuclear Information System (INIS)

    Balazs, N.L.

    1979-01-01

    It is pointed out that in semiclassical dynamics one is encouraged to study the evolution of those curves in phase space which classically represent ensembles corresponding to wave functions. It is shown that the fixed points generate new time scales so that for times longer than the critical times, quantum dynamics will profoundly differ from classical dynamics. (P.L.)

  1. On the semiclassical description of rotating nuclei

    International Nuclear Information System (INIS)

    Durand, M.; Kunz, J.; Schuck, P.

    1983-01-01

    The technique of partial h-resummation is used to obtain semiclassical, i.e. average current distributions in the body fixed system of heavy nuclei. It thereby turns out that this average intrinsic current only flows in the nuclear surface. A Strutinsky smoothing of the current is also performed and gives nice agreement with the semiclassical results. We also show how one can incorporate superfluidity into the semiclassical treatment. To lowest order in h we find that the moment of inertia of superfluid nuclei is zero. The same result is obtained by a quantum mechanical calculation if the gap goes to infinity. The importance of including n-corrections is pointed out

  2. Semiclassical description of scattering with internal degrees of freedom

    International Nuclear Information System (INIS)

    Cruz-Barrios, S.; Gomez-Camacho, J.

    1998-01-01

    The scattering of systems with internal degrees of freedom is studied in the semi-classical approximation. It is found that a special set of states, named coherent internal states, are specially relevant for the semi-classical treatment. A classical trajectory is defined for each coherent internal state. The semi-classical expressions obtained satisfy the superposition principle and are valid for arbitrary coupling strength. (orig.)

  3. Semiclassical methods in chemical reaction dynamics

    Energy Technology Data Exchange (ETDEWEB)

    Keshavamurthy, Srihari [Univ. of California, Berkeley, CA (United States)

    1994-12-01

    Semiclassical approximations, simple as well as rigorous, are formulated in order to be able to describe gas phase chemical reactions in large systems. We formulate a simple but accurate semiclassical model for incorporating multidimensional tunneling in classical trajectory simulations. This model is based on the existence of locally conserved actions around the saddle point region on a multidimensional potential energy surface. Using classical perturbation theory and monitoring the imaginary action as a function of time along a classical trajectory we calculate state-specific unimolecular decay rates for a model two dimensional potential with coupling. Results are in good comparison with exact quantum results for the potential over a wide range of coupling constants. We propose a new semiclassical hybrid method to calculate state-to-state S-matrix elements for bimolecular reactive scattering. The accuracy of the Van Vleck-Gutzwiller propagator and the short time dynamics of the system make this method self-consistent and accurate. We also go beyond the stationary phase approximation by doing the resulting integrals exactly (numerically). As a result, classically forbidden probabilties are calculated with purely real time classical trajectories within this approach. Application to the one dimensional Eckart barrier demonstrates the accuracy of this approach. Successful application of the semiclassical hybrid approach to collinear reactive scattering is prevented by the phenomenon of chaotic scattering. The modified Filinov approach to evaluating the integrals is discussed, but application to collinear systems requires a more careful analysis. In three and higher dimensional scattering systems, chaotic scattering is suppressed and hence the accuracy and usefulness of the semiclassical method should be tested for such systems.

  4. Semiclassical methods in chemical reaction dynamics

    International Nuclear Information System (INIS)

    Keshavamurthy, S.

    1994-12-01

    Semiclassical approximations, simple as well as rigorous, are formulated in order to be able to describe gas phase chemical reactions in large systems. We formulate a simple but accurate semiclassical model for incorporating multidimensional tunneling in classical trajectory simulations. This model is based on the existence of locally conserved actions around the saddle point region on a multidimensional potential energy surface. Using classical perturbation theory and monitoring the imaginary action as a function of time along a classical trajectory we calculate state-specific unimolecular decay rates for a model two dimensional potential with coupling. Results are in good comparison with exact quantum results for the potential over a wide range of coupling constants. We propose a new semiclassical hybrid method to calculate state-to-state S-matrix elements for bimolecular reactive scattering. The accuracy of the Van Vleck-Gutzwiller propagator and the short time dynamics of the system make this method self-consistent and accurate. We also go beyond the stationary phase approximation by doing the resulting integrals exactly (numerically). As a result, classically forbidden probabilties are calculated with purely real time classical trajectories within this approach. Application to the one dimensional Eckart barrier demonstrates the accuracy of this approach. Successful application of the semiclassical hybrid approach to collinear reactive scattering is prevented by the phenomenon of chaotic scattering. The modified Filinov approach to evaluating the integrals is discussed, but application to collinear systems requires a more careful analysis. In three and higher dimensional scattering systems, chaotic scattering is suppressed and hence the accuracy and usefulness of the semiclassical method should be tested for such systems

  5. Semiclassical regularization of Vlasov equations and wavepackets for nonlinear Schrödinger equations

    Science.gov (United States)

    Athanassoulis, Agissilaos

    2018-03-01

    We consider the semiclassical limit of nonlinear Schrödinger equations with initial data that are well localized in both position and momentum (non-parametric wavepackets). We recover the Wigner measure (WM) of the problem, a macroscopic phase-space density which controls the propagation of the physical observables such as mass, energy and momentum. WMs have been used to create effective models for wave propagation in: random media, quantum molecular dynamics, mean field limits, and the propagation of electrons in graphene. In nonlinear settings, the Vlasov-type equations obtained for the WM are often ill-posed on the physically interesting spaces of initial data. In this paper we are able to select the measure-valued solution of the 1  +  1 dimensional Vlasov-Poisson equation which correctly captures the semiclassical limit, thus finally resolving the non-uniqueness in the seminal result of Zhang et al (2012 Comm. Pure Appl. Math. 55 582-632). The same approach is also applied to the Vlasov-Dirac-Benney equation with small wavepacket initial data, extending several known results.

  6. Quantum tunneling beyond semiclassical approximation

    International Nuclear Information System (INIS)

    Banerjee, Rabin; Majhi, Bibhas Ranjan

    2008-01-01

    Hawking radiation as tunneling by Hamilton-Jacobi method beyond semiclassical approximation is analysed. We compute all quantum corrections in the single particle action revealing that these are proportional to the usual semiclassical contribution. We show that a simple choice of the proportionality constants reproduces the one loop back reaction effect in the spacetime, found by conformal field theory methods, which modifies the Hawking temperature of the black hole. Using the law of black hole mechanics we give the corrections to the Bekenstein-Hawking area law following from the modified Hawking temperature. Some examples are explicitly worked out.

  7. Second order semiclassics with self-generated magnetic fields

    DEFF Research Database (Denmark)

    Erdös, Laszlo; Fournais, Søren; Solovej, Jan Philip

    2012-01-01

    $ effectively determines the strength of the field. We consider the weak field regime with $\\beta h^{2}\\ge {const}>0$, where $h$ is the semiclassical parameter. For smooth potentials we prove that the semiclassical asymptotics of the total energy is given by the non-magnetic Weyl term to leading order...... with an error bound that is smaller by a factor $h^{1+\\e}$, i.e. the subleading term vanishes. However, for potentials with a Coulomb singularity the subleading term does not vanish due to the non-semiclassical effect of the singularity. Combined with a multiscale technique, this refined estimate is used...

  8. Stochastic semi-classical description of sub-barrier fusion reactions

    Directory of Open Access Journals (Sweden)

    Ayik Sakir

    2011-10-01

    Full Text Available A semi-classical method that incorporates the quantum effects of the low-lying vibrational modes is applied to fusion reactions. The quantum effect is simulated by stochastic sampling of initial zero-point fluctuations of the surface modes. In this model, dissipation of the relative energy into non-collective excitations of nuclei can be included straightforwardly. The inclusion of dissipation is shown to increase the agreement with the fusion cross section data of Ni isotopes.

  9. Coherent and Semiclassical States of a Charged Particle in a Constant Electric Field

    Science.gov (United States)

    Adorno, T. C.; Pereira, A. S.

    2018-05-01

    The method of integrals of motion is used to construct families of generalized coherent states of a nonrelativistic spinless charged particle in a constant electric field. Families of states, differing in the values of their standard deviations at the initial time, are obtained. Depending on the initial values of the standard deviations, and also on the electric field, it turns out to be possible to identify some families with semiclassical states.

  10. Semiclassical theory of plate vibrations

    International Nuclear Information System (INIS)

    Bogomolny, E.; Hugues, E.

    1996-11-01

    The bi-harmonic equation of flexural vibrations of elastic plates is studied by a semiclassical method which can easily be generalized for other models of wave propagation. The surface and perimeter terms of the asymptotic number of levels are derived exactly. The next constant term is also derived. A semiclassical approximation of the quantization condition is obtained. A Berry-Tabor formula and a Gutzwiller trace formula are deduced for the integrable and chaotic cases respectively. From 600 eigenvalues of a clamped stadium plate obtained by a specially developed numerical algorithm, the trace formula is assessed, looking at its Fourier transform compared with the membrane case. (author)

  11. Semiclassical shell structure in rotating Fermi systems

    International Nuclear Information System (INIS)

    Magner, A. G.; Sitdikov, A. S.; Khamzin, A. A.; Bartel, J.

    2010-01-01

    The collective moment of inertia is derived analytically within the cranking model for any rotational frequency of the harmonic-oscillator potential well and at a finite temperature. Semiclassical shell-structure components of the collective moment of inertia are obtained for any potential by using the periodic-orbit theory. We found semiclassically their relation to the free-energy shell corrections through the shell-structure components of the rigid-body moment of inertia of the statistically equilibrium rotation in terms of short periodic orbits. The shell effects in the moment of inertia exponentially disappear with increasing temperature. For the case of the harmonic-oscillator potential, one observes a perfect agreement of the semiclassical and quantum shell-structure components of the free energy and the moment of inertia for several critical bifurcation deformations and several temperatures.

  12. Semiclassical evolution of dissipative Markovian systems

    International Nuclear Information System (INIS)

    Ozorio de Almeida, A M; Rios, P de M; Brodier, O

    2009-01-01

    A semiclassical approximation for an evolving density operator, driven by a 'closed' Hamiltonian operator and 'open' Markovian Lindblad operators, is obtained. The theory is based on the chord function, i.e. the Fourier transform of the Wigner function. It reduces to an exact solution of the Lindblad master equation if the Hamiltonian operator is a quadratic function and the Lindblad operators are linear functions of positions and momenta. Initially, the semiclassical formulae for the case of Hermitian Lindblad operators are reinterpreted in terms of a (real) double phase space, generated by an appropriate classical double Hamiltonian. An extra 'open' term is added to the double Hamiltonian by the non-Hermitian part of the Lindblad operators in the general case of dissipative Markovian evolution. The particular case of generic Hamiltonian operators, but linear dissipative Lindblad operators, is studied in more detail. A Liouville-type equivariance still holds for the corresponding classical evolution in double phase space, but the centre subspace, which supports the Wigner function, is compressed, along with expansion of its conjugate subspace, which supports the chord function. Decoherence narrows the relevant region of double phase space to the neighbourhood of a caustic for both the Wigner function and the chord function. This difficulty is avoided by a propagator in a mixed representation, so that a further 'small-chord' approximation leads to a simple generalization of the quadratic theory for evolving Wigner functions

  13. Semiclassical approaches to nuclear dynamics

    Energy Technology Data Exchange (ETDEWEB)

    Magner, A. G., E-mail: magner@kinr.kiev.ua; Gorpinchenko, D. V. [Institute for Nuclear Research NASU (Ukraine); Bartel, J. [Université de Strasbourg, Institut Pluridisciplinaire Hubert Curien, CNRS/IN2P3 (France)

    2017-01-15

    The extended Gutzwiller trajectory approach is presented for the semiclassical description of nuclear collective dynamics, in line with the main topics of the fruitful activity of V.G. Solovjov. Within the Fermi-liquid droplet model, the leptodermous effective surface approximation was applied to calculations of energies, sum rules, and transition densities for the neutron–proton asymmetry of the isovector giant-dipole resonance and found to be in good agreement with the experimental data. By using the Strutinsky shell correction method, the semiclassical collective transport coefficients, such as nuclear inertia, friction, stiffness, and moments of inertia, can be derived beyond the quantum perturbation approximation of the response function theory and the cranking model. The averaged particle-number dependences of the low-lying collective vibrational states are described in good agreement with the basic experimental data, mainly due to the enhancement of the collective inertia as compared to its irrotational flow value. Shell components of the moment of inertia are derived in terms of the periodic-orbit free-energy shell corrections. A good agreement between the semiclassical extended Thomas–Fermi moments of inertia with shell corrections and the quantum results is obtained for different nuclear deformations and particle numbers. Shell effects are shown to be exponentially dampted out with increasing temperature in all the transport coefficients.

  14. Semiclassical approaches to nuclear dynamics

    International Nuclear Information System (INIS)

    Magner, A. G.; Gorpinchenko, D. V.; Bartel, J.

    2017-01-01

    The extended Gutzwiller trajectory approach is presented for the semiclassical description of nuclear collective dynamics, in line with the main topics of the fruitful activity of V.G. Solovjov. Within the Fermi-liquid droplet model, the leptodermous effective surface approximation was applied to calculations of energies, sum rules, and transition densities for the neutron–proton asymmetry of the isovector giant-dipole resonance and found to be in good agreement with the experimental data. By using the Strutinsky shell correction method, the semiclassical collective transport coefficients, such as nuclear inertia, friction, stiffness, and moments of inertia, can be derived beyond the quantum perturbation approximation of the response function theory and the cranking model. The averaged particle-number dependences of the low-lying collective vibrational states are described in good agreement with the basic experimental data, mainly due to the enhancement of the collective inertia as compared to its irrotational flow value. Shell components of the moment of inertia are derived in terms of the periodic-orbit free-energy shell corrections. A good agreement between the semiclassical extended Thomas–Fermi moments of inertia with shell corrections and the quantum results is obtained for different nuclear deformations and particle numbers. Shell effects are shown to be exponentially dampted out with increasing temperature in all the transport coefficients.

  15. Semi-classical signal analysis

    KAUST Repository

    Laleg-Kirati, Taous-Meriem; Cré peau, Emmanuelle; Sorine, Michel

    2012-01-01

    This study introduces a new signal analysis method, based on a semi-classical approach. The main idea in this method is to interpret a pulse-shaped signal as a potential of a Schrödinger operator and then to use the discrete spectrum

  16. Semiclassical multicomponent wave function

    NARCIS (Netherlands)

    Mostovoy, M.V.

    A consistent method for obtaining the semiclassical multicomponent wave function for any value of adiabatic parameter is discussed and illustrated by examining the motion of a neutral particle in a nonuniform magnetic field. The method generalizes the Bohr-Sommerfeld quantization rule to

  17. Semiclassical calculation for collision induced dissociation. III. Restricted two dimensional Morse oscillator model

    International Nuclear Information System (INIS)

    Rusinek, I.

    1980-01-01

    A semiclassical procedure previously used for collinear CID calculations is applied to the perpendicular collisions (2D, no rotation, zero impact parameter) of a Morse homonuclear diatomic molecule and an atom, interacting via an exponential repulsive potential. Values of the dissociation probability (P/sup diss/) are given as a function of total energy (E/sub t/) and initial vibrational state (n 1 =0,1,3,5) for a system with three identical masses. The results are compared with the P/sup diss/ previously reported for an identical one dimensional system. We find: (a) quasiclassical P/sup diss/ that are a good approximation to the semiclassical ones, if CID is classically allowed, (b) vibrational enhancement of CID, and (c) energetic thresholds for dissociation similar to the ones found in the collinear case

  18. Semi-classical propagation of wavepackets for the phase space Schroedinger equation: interpretation in terms of the Feichtinger algebra

    International Nuclear Information System (INIS)

    Gosson, Maurice A de

    2008-01-01

    The nearby orbit method is a powerful tool for constructing semi-classical solutions of Schroedinger's equation when the initial datum is a coherent state. In this paper, we first extend this method to arbitrary squeezed states and thereafter apply our results to the Schroedinger equation in phase space. This adaptation requires the phase-space Weyl calculus developed in previous work of ours. We also study the regularity of the semi-classical solutions from the point of view of the Feichtinger algebra familiar from the theory of modulation spaces

  19. Error of semiclassical eigenvalues in the semiclassical limit - an asymptotic analysis of the Sinai billiard

    Science.gov (United States)

    Dahlqvist, Per

    1999-10-01

    We estimate the error in the semiclassical trace formula for the Sinai billiard under the assumption that the largest source of error is due to penumbra diffraction: namely, diffraction effects for trajectories passing within a distance Ricons/Journals/Common/cdot" ALT="cdot" ALIGN="TOP"/>O((kR)-2/3) to the disc and trajectories being scattered in very forward directions. Here k is the momentum and R the radius of the scatterer. The semiclassical error is estimated by perturbing the Berry-Keating formula. The analysis necessitates an asymptotic analysis of very long periodic orbits. This is obtained within an approximation originally due to Baladi, Eckmann and Ruelle. We find that the average error, for sufficiently large values of kR, will exceed the mean level spacing.

  20. Semiclassical quantization of nonadiabatic systems with hopping periodic orbits

    International Nuclear Information System (INIS)

    Fujii, Mikiya; Yamashita, Koichi

    2015-01-01

    We present a semiclassical quantization condition, i.e., quantum–classical correspondence, for steady states of nonadiabatic systems consisting of fast and slow degrees of freedom (DOFs) by extending Gutzwiller’s trace formula to a nonadiabatic form. The quantum–classical correspondence indicates that a set of primitive hopping periodic orbits, which are invariant under time evolution in the phase space of the slow DOF, should be quantized. The semiclassical quantization is then applied to a simple nonadiabatic model and accurately reproduces exact quantum energy levels. In addition to the semiclassical quantization condition, we also discuss chaotic dynamics involved in the classical limit of nonadiabatic dynamics

  1. Semiclassical propagator of the Wigner function.

    Science.gov (United States)

    Dittrich, Thomas; Viviescas, Carlos; Sandoval, Luis

    2006-02-24

    Propagation of the Wigner function is studied on two levels of semiclassical propagation: one based on the Van Vleck propagator, the other on phase-space path integration. Leading quantum corrections to the classical Liouville propagator take the form of a time-dependent quantum spot. Its oscillatory structure depends on whether the underlying classical flow is elliptic or hyperbolic. It can be interpreted as the result of interference of a pair of classical trajectories, indicating how quantum coherences are to be propagated semiclassically in phase space. The phase-space path-integral approach allows for a finer resolution of the quantum spot in terms of Airy functions.

  2. Semiclassical strings and non-Abelian T-duality

    Directory of Open Access Journals (Sweden)

    S. Zacarías

    2014-10-01

    Full Text Available We study semiclassical strings in the Klebanov–Witten and in the non-Abelian T-dual Klebanov–Witten backgrounds. We show that both backgrounds share a subsector of equivalent states up to conditions on the T-dual coordinates. We also analyse string configurations where the strings are stretched along the T-dual coordinates. This semiclassical analysis predicts the existence of (almost chiral primary operators for the dual superconformal field theory whose (anomalous bare dimensions depend on the T-dual coordinates. We briefly discuss the Penrose limit of the dualised background.

  3. Semiclassical analysis of quantum localization of the periodically kicked Rydberg atom

    International Nuclear Information System (INIS)

    Yoshida, S.; Persson, E.; Burgdoerfer, J.; Grossmann, F.

    2004-01-01

    The periodically kicked Rydberg atom displays quantum localization, features of which depend on the orientation and strength of the unidirectional kicks. They include scarring of the wave function, localization by cantori, and exponential localization in the regime of strong perturbation resembling dynamical localization. Using the semiclassical Herman-Kluk propagator we investigate the degree to which semiclassical dynamics can mimic quantum localization. While the semiclassical approximation has difficulties to reproduce the scarred wave functions, the exponential tail which is a typical signature of the dynamical localization is well represented in the case of strong classical diffusion. Also the localization by broken tori is observed in the semiclassical recurrence probability for short times but the deviation from the corresponding quantum dynamics becomes more pronounced for the long-time evolution

  4. Time dependent semiclassical tunneling through one dimensional barriers using only real valued trajectories

    International Nuclear Information System (INIS)

    Herman, Michael F.

    2015-01-01

    The time independent semiclassical treatment of barrier tunneling has been understood for a very long time. Several semiclassical approaches to time dependent tunneling through barriers have also been presented. These typically involve trajectories for which the position variable is a complex function of time. In this paper, a method is presented that uses only real valued trajectories, thus avoiding the complications that can arise when complex trajectories are employed. This is accomplished by expressing the time dependent wave packet as an integration over momentum. The action function in the exponent in this expression is expanded to second order in the momentum. The expansion is around the momentum, p 0 * , at which the derivative of the real part of the action is zero. The resulting Gaussian integral is then taken. The stationary phase approximation requires that the derivative of the full action is zero at the expansion point, and this leads to a complex initial momentum and complex tunneling trajectories. The “pseudo-stationary phase” approximation employed in this work results in real values for the initial momentum and real valued trajectories. The transmission probabilities obtained are found to be in good agreement with exact quantum results

  5. Time dependent semiclassical tunneling through one dimensional barriers using only real valued trajectories

    Energy Technology Data Exchange (ETDEWEB)

    Herman, Michael F. [Department of Chemistry, Tulane University, New Orleans, Louisiana 70118 (United States)

    2015-10-28

    The time independent semiclassical treatment of barrier tunneling has been understood for a very long time. Several semiclassical approaches to time dependent tunneling through barriers have also been presented. These typically involve trajectories for which the position variable is a complex function of time. In this paper, a method is presented that uses only real valued trajectories, thus avoiding the complications that can arise when complex trajectories are employed. This is accomplished by expressing the time dependent wave packet as an integration over momentum. The action function in the exponent in this expression is expanded to second order in the momentum. The expansion is around the momentum, p{sub 0{sup *}}, at which the derivative of the real part of the action is zero. The resulting Gaussian integral is then taken. The stationary phase approximation requires that the derivative of the full action is zero at the expansion point, and this leads to a complex initial momentum and complex tunneling trajectories. The “pseudo-stationary phase” approximation employed in this work results in real values for the initial momentum and real valued trajectories. The transmission probabilities obtained are found to be in good agreement with exact quantum results.

  6. Interparticle interaction and transport processes in dense semiclassical plasmas

    International Nuclear Information System (INIS)

    Baimbetov, F.B.; Giniyatova, Sh.G.

    2005-01-01

    On the basis of the density response formalism an expression for the pseudopotential of dense semiclassical plasma, which takes account of quantum-mechanical effects, local field corrections, and electronic screening effects is obtained. The static structure factors taking into account both local fields and quantum-mechanical effects are calculated. An electrical conductivity, thermal conductivity, and viscosity of dense semiclassical plasma are studied

  7. Semiclassical regime of Regge calculus and spin foams

    International Nuclear Information System (INIS)

    Bianchi, Eugenio; Satz, Alejandro

    2009-01-01

    Recent attempts to recover the graviton propagator from spin foam models involve the use of a boundary quantum state peaked on a classical geometry. The question arises whether beyond the case of a single simplex this suffices for peaking the interior geometry in a semiclassical configuration. In this paper we explore this issue in the context of quantum Regge calculus with a general triangulation. Via a stationary phase approximation, we show that the boundary state succeeds in peaking the interior in the appropriate configuration, and that boundary correlations can be computed order by order in an asymptotic expansion. Further, we show that if we replace at each simplex the exponential of the Regge action by its cosine-as expected from the semiclassical limit of spin foam models-then the contribution from the sign-reversed terms is suppressed in the semiclassical regime and the results match those of conventional Regge calculus

  8. Semiclassical theory for the nuclear response function

    International Nuclear Information System (INIS)

    Stroth, U.

    1986-01-01

    In the first part of this thesis it was demonstrated how on a semiclassical base a RPA theory is developed and applied to electron scattering. It was shown in which fields of nuclear physics this semiclassical theory can be applied and how it is to be understood. In this connection we dedicated an extensive discussion to the Fermi gas model. From the free response function we calculated the RPA response with a finite-range residual interaction which we completely antisymmetrize. In the second part of this thesis we studied with our theory (e,e') data for the separated response functions. (orig./HSI) [de

  9. Semiclassical calculation for collision induced dissociation. II. Morse oscillator model

    International Nuclear Information System (INIS)

    Rusinek, I.; Roberts, R.E.

    1978-01-01

    A recently developed semiclassical procedure for calculating collision induced dissociation probabilities P/sup diss/ is applied to the collinear collision between a particle and a Morse oscillator diatomic. The particle--diatom interaction is described with a repulsive exponential potential function. P/sup diss/ is reported for a system of three identical particles, as a function of collision energy E/sub t/ and initial vibrational state of the diatomic n 1 . The results are compared with the previously reported values for the collision between a particle and a truncated harmonic oscillator. The two studies show similar features, namely: (a) there is an oscillatory structure in the P/sup diss/ energy profiles, which is directly related to n 1 ; (b) P/sup diss/ becomes noticeable (> or approx. =10 -3 ) for E/sub t/ values appreciably higher than the energetic threshold; (c) vibrational enhancement (inhibition) of collision induced dissociation persists at low (high) energies; and (d) good agreement between the classical and semiclassical results is found above the classical dynamic threshold. Finally, the convergence of P/sup diss/ for increasing box length is shown to be rapid and satisfactory

  10. Stellar Equilibrium in Semiclassical Gravity.

    Science.gov (United States)

    Carballo-Rubio, Raúl

    2018-02-09

    The phenomenon of quantum vacuum polarization in the presence of a gravitational field is well understood and is expected to have a physical reality, but studies of its backreaction on the dynamics of spacetime are practically nonexistent outside of the specific context of homogeneous cosmologies. Building on previous results of quantum field theory in curved spacetimes, in this Letter we first derive the semiclassical equations of stellar equilibrium in the s-wave Polyakov approximation. It is highlighted that incorporating the polarization of the quantum vacuum leads to a generalization of the classical Tolman-Oppenheimer-Volkoff equation. Despite the complexity of the resulting field equations, it is possible to find exact solutions. Aside from being the first known exact solutions that describe relativistic stars including the nonperturbative backreaction of semiclassical effects, these are identified as a nontrivial combination of the black star and gravastar proposals.

  11. Spurious Excitations in Semiclassical Scattering Theory.

    Science.gov (United States)

    Gross, D. H. E.; And Others

    1980-01-01

    Shows how through proper handling of the nonuniform motion of semiclassical coordinates spurious excitation terms are eliminated. An application to the problem of nuclear Coulomb excitation is presented as an example. (HM)

  12. Stability and semiclassics in self-generated fields

    DEFF Research Database (Denmark)

    Erdös, Laszlo; Fournais, Søren; Solovej, Jan Philip

    2013-01-01

    We consider non-interacting particles subject to a fixed external potential V and a self-generated magnetic field B. The total energy includes the field energy β∫B^2 and we minimize over all particle states and magnetic fields. In the case of spin-1/2 particles this minimization leads...... measuring the field strength in the semiclassical limit is κ=βh. We are not able to give the exact leading order semiclassical asymptotics uniformly in κ or even for fixed κ. We do however give upper and lower bounds on E with almost matching dependence on κ. In the simultaneous limit h→0 and κ→∞ we show...

  13. A semi-classical analysis of Dirac fermions in 2+1 dimensions

    International Nuclear Information System (INIS)

    Maiti, Moitri; Shankar, R

    2012-01-01

    We investigate the semi-classical dynamics of massless Dirac fermions in 2+1 dimensions in the presence of external electromagnetic fields. By generalizing the α matrices by two generators of the SU(2) group in the (2S + 1)-dimensional representation and doing a certain scaling, we formulate an S → ∞ limit where the orbital and the spinor degrees become classical. We solve for the classical trajectories for a free particle on a cylinder and a particle in a constant magnetic field. We compare the semi-classical spectrum, obtained by Bohr–Sommerfeld quantization with the exact quantum spectrum for low values of S. For the free particle, the semi-classical spectrum is exact. For the particle in a constant magnetic field, the semi-classical spectrum reproduces all the qualitative features of the exact quantum spectrum at all S. The quantitative fit for S = 1/2 is reasonably good. (paper)

  14. Semiclassical approach to mesoscopic systems classical trajectory correlations and wave interference

    CERN Document Server

    Waltner, Daniel

    2012-01-01

    This volume describes mesoscopic systems with classically chaotic dynamics using semiclassical methods which combine elements of classical dynamics and quantum interference effects. Experiments and numerical studies show that Random Matrix Theory (RMT) explains physical properties of these systems well. This was conjectured more than 25 years ago by Bohigas, Giannoni and Schmit for the spectral properties. Since then, it has been a challenge to understand this connection analytically.  The author offers his readers a clearly-written and up-to-date treatment of the topics covered. He extends previous semiclassical approaches that treated spectral and conductance properties. He shows that RMT results can in general only be obtained semiclassically when taking into account classical configurations not considered previously, for example those containing multiply traversed periodic orbits. Furthermore, semiclassics is capable of describing effects beyond RMT. In this context he studies the effect of a non-zero Eh...

  15. Microscopic and semi-classical treatments of octupole deformation in the light actinides

    International Nuclear Information System (INIS)

    Chasman, R.R.

    1984-01-01

    Microscopic and semi-classical descriptions of octupole deformation are compared. New semi-classical results, obtained with the use of a Woods-Saxon potential are presented. Comparisons with experiment are made. 21 references

  16. Wigner measure and semiclassical limits of nonlinear Schrödinger equations

    CERN Document Server

    Zhang, Ping

    2008-01-01

    This book is based on a course entitled "Wigner measures and semiclassical limits of nonlinear Schrödinger equations," which the author taught at the Courant Institute of Mathematical Sciences at New York University in the spring of 2007. The author's main purpose is to apply the theory of semiclassical pseudodifferential operators to the study of various high-frequency limits of equations from quantum mechanics. In particular, the focus of attention is on Wigner measure and recent progress on how to use it as a tool to study various problems arising from semiclassical limits of Schrödinger-ty

  17. Renormalized semiclassical quantization for rescalable Hamiltonians

    International Nuclear Information System (INIS)

    Takahashi, Satoshi; Takatsuka, Kazuo

    2004-01-01

    A renormalized semiclassical quantization method for rescalable Hamiltonians is proposed. A classical Hamilton system having a potential function that consists of homogeneous polynomials like the Coulombic potential can have a scale invariance in its extended phase space (phase space plus time). Consequently, infinitely many copies of a single trajectory constitute a one-parameter family that is characterized in terms of a scaling factor. This scaling invariance in classical dynamics is lost in quantum mechanics due to the presence of the Planck constant. It is shown that in a system whose classical motions have a self-similarity in the above sense, classical trajectories adopted in the semiclassical scheme interact with infinitely many copies of their own that are reproduced by the relevant scaling procedure, thereby undergoing quantum interference among themselves to produce a quantized spectrum

  18. Semiclassical geometry of integrable systems

    Science.gov (United States)

    Reshetikhin, Nicolai

    2018-04-01

    The main result of this paper is a formula for the scalar product of semiclassical eigenvectors of two integrable systems on the same symplectic manifold. An important application of this formula is the Ponzano–Regge type of asymptotic of Racah–Wigner coefficients. Dedicated to the memory of P P Kulish.

  19. Ab-initio studies of the Sc adsorption and the ScN thin film formation on the GaN(000-1)-(2 × 2) surface

    International Nuclear Information System (INIS)

    Guerrero-Sánchez, J.; Sánchez-Ochoa, F.; Cocoletzi, Gregorio H.; Rivas-Silva, J.F.; Takeuchi, Noboru

    2013-01-01

    First principles total energy calculations have been performed to investigate the initial stages of the Sc adsorption and ScN thin film formation on the GaN(000-1)-(2 × 2) surface. Studies are done within the periodic density functional theory as implemented in the PWscf code of the Quantum ESPRESSO package. The Sc adsorption at high symmetry sites results in the bridge site as the most stable structure. When a Sc monolayer is deposited above the surface the T4 site results as the most stable geometry. The Sc migration into the first Ga monolayer induces the Ga displaced ad-atom to be adsorbed at the T4-2 site. A ScN bilayer may be obtained under the Ga monolayer. Finally a ScN bilayer may be formed in the wurtzite phase above the surface. The formation energy plots show that in the moderate Ga-rich conditions we obtain the formation of a ScN bilayer under the gallium monolayer. However at N-rich conditions the formation of ScN bilayer above the surface is the most favorable structure. We report the density of states to explain the electronic structure of the most favorable geometries. - Highlights: • Studies of the initial stages in the formation of Sc and ScN structures on GaN • In the adsorption of Sc on the GaN the Br site is the most favorable geometry. • When a Sc replaces a Ga of the first monolayer the displaced Ga occupies a T4-2 site. • For Ga-rich conditions there is formation of ScN under the Ga monolayer. • In N-rich conditions there is formation of ScN in the wurtzite phase

  20. Regularized semiclassical limits: Linear flows with infinite Lyapunov exponents

    KAUST Repository

    Athanassoulis, Agissilaos; Katsaounis, Theodoros; Kyza, Irene

    2016-01-01

    Semiclassical asymptotics for Schrödinger equations with non-smooth potentials give rise to ill-posed formal semiclassical limits. These problems have attracted a lot of attention in the last few years, as a proxy for the treatment of eigenvalue crossings, i.e. general systems. It has recently been shown that the semiclassical limit for conical singularities is in fact well-posed, as long as the Wigner measure (WM) stays away from singular saddle points. In this work we develop a family of refined semiclassical estimates, and use them to derive regularized transport equations for saddle points with infinite Lyapunov exponents, extending the aforementioned recent results. In the process we answer a related question posed by P.L. Lions and T. Paul in 1993. If we consider more singular potentials, our rigorous estimates break down. To investigate whether conical saddle points, such as -|x|, admit a regularized transport asymptotic approximation, we employ a numerical solver based on posteriori error control. Thus rigorous upper bounds for the asymptotic error in concrete problems are generated. In particular, specific phenomena which render invalid any regularized transport for -|x| are identified and quantified. In that sense our rigorous results are sharp. Finally, we use our findings to formulate a precise conjecture for the condition under which conical saddle points admit a regularized transport solution for the WM. © 2016 International Press.

  1. Regularized semiclassical limits: Linear flows with infinite Lyapunov exponents

    KAUST Repository

    Athanassoulis, Agissilaos

    2016-08-30

    Semiclassical asymptotics for Schrödinger equations with non-smooth potentials give rise to ill-posed formal semiclassical limits. These problems have attracted a lot of attention in the last few years, as a proxy for the treatment of eigenvalue crossings, i.e. general systems. It has recently been shown that the semiclassical limit for conical singularities is in fact well-posed, as long as the Wigner measure (WM) stays away from singular saddle points. In this work we develop a family of refined semiclassical estimates, and use them to derive regularized transport equations for saddle points with infinite Lyapunov exponents, extending the aforementioned recent results. In the process we answer a related question posed by P.L. Lions and T. Paul in 1993. If we consider more singular potentials, our rigorous estimates break down. To investigate whether conical saddle points, such as -|x|, admit a regularized transport asymptotic approximation, we employ a numerical solver based on posteriori error control. Thus rigorous upper bounds for the asymptotic error in concrete problems are generated. In particular, specific phenomena which render invalid any regularized transport for -|x| are identified and quantified. In that sense our rigorous results are sharp. Finally, we use our findings to formulate a precise conjecture for the condition under which conical saddle points admit a regularized transport solution for the WM. © 2016 International Press.

  2. Closed almost-periodic orbits in semiclassical quantization of generic polygons

    Science.gov (United States)

    Biswas

    2000-05-01

    Periodic orbits are the central ingredients of modern semiclassical theories and corrections to these are generally nonclassical in origin. We show here that, for the class of generic polygonal billiards, the corrections are predominantly classical in origin owing to the contributions from closed almost-periodic (CAP) orbit families. Furthermore, CAP orbit families outnumber periodic families but have comparable weights. They are hence indispensable for semiclassical quantization.

  3. A zeta function approach to the semiclassical quantization of maps

    International Nuclear Information System (INIS)

    Smilansky, Uzi.

    1993-11-01

    The quantum analogue of an area preserving map on a compact phase space is a unitary (evolution) operator which can be represented by a matrix of dimension L∝ℎ -1 . The semiclassical theory for spectrum of the evolution operator will be reviewed with special emphasize on developing a dynamical zeta function approach, similar to the one introduced recently for a semiclassical quantization of hamiltonian systems. (author)

  4. Numerical indications on the semiclassical limit of the flipped vertex

    Energy Technology Data Exchange (ETDEWEB)

    Magliaro, Elena; Perini, Claudio; Rovelli, Carlo [Centre de Physique Theorique de Luminy , Case 907, F-13288 Marseille (France)

    2008-05-07

    We introduce a technique for testing the semiclassical limit of a quantum gravity vertex amplitude. The technique is based on the propagation of a semiclassical wave packet. We apply this technique to the newly introduced 'flipped' vertex in loop quantum gravity, in order to test the intertwiner dependence of the vertex. Under some drastic simplifications, we find very preliminary, but surprisingly good numerical evidence for the correct classical limit.

  5. Dispersions in Semi-Classical Dynamics

    International Nuclear Information System (INIS)

    Zielinska-Pfabe, M.; Gregoire, C.

    1987-01-01

    Dispersions around mean values of one-body observables are obtained by restoring classical many-body correlations in Vlasov and Landau-Vlasov dynamics. The method is applied to the calculation of fluctuations in mass, charge and linear momentum in heavy-ion collisions. Results are compared to those obtained by the Balian-Veneroni variational principle in semi-classical approximation

  6. Semiclassical analysis of quasiexact solvability

    International Nuclear Information System (INIS)

    Bender, C.M.; Dunne, G.V.; Moshe, M.

    1997-01-01

    Higher-order WKB methods are used to investigate the border between the solvable and insolvable portions of the spectrum of quasiexactly solvable quantum-mechanical potentials. The analysis reveals scaling and factorization properties that are central to quasiexact solvability. These two properties define a new class of semiclassically quasiexactly solvable potentials. copyright 1997 The American Physical Society

  7. Some applications of semiclassical methods to quantum chaos

    International Nuclear Information System (INIS)

    Mouchet, A.

    1996-01-01

    This thesis is made of four chapters. The first chapter is devoted to the description of the band structure, using the semiclassical periodic orbit theory, for a one electron system in a two-dimensional crystal with a high magnetic field perpendicular to the crystal plane. Complex orbits turn out to be fundamental for a proper description of the band structure since they incorporate conduction processes through tunneling mechanisms. In the second part, the author focuses on the role played in semiclassical expansions by complex orbits. They give exponentially small contribution when h is small only in a precise situation. In all other cases, complex orbits give birth to corrections in powers in h but unlike the extreme case they are hidden in the shadow of usual Gutzwiller contributions of real orbits. In the third chapter, a semiclassical expansion of the Berry two-form in terms of finite number of periodic orbits for a discrete chaotic map defined on a compact phase space and governed by external parameters is given. Besides, when dealing with a toroidal geometry, the author gives a similar expansion for the Chern index of any Bloch band of the quasi-energy spectrum and is thus led to a semiclassical interpretation of the Hall effect. In the last chapter, the author sets out a mechanism to explain how symmetries can create Berry phase shifts higher than 2π in a 3D-adiabatic transport. He shows how one can understand in a topological point of view why these shifts are necessarily integer multiple of 2π. An explicit construction of such arbitrary large phase shifts is finally proposed. (N.T.)

  8. Moments of inertia in a semiclassical approach

    International Nuclear Information System (INIS)

    Benchein, K.

    1993-01-01

    Semiclassical calculations have been performed for 31 nuclei. As a result of preliminary non-fully self-consistent calculations, the moments of inertia in investigated nuclei abd spin degrees of freedom are found

  9. Semiclassical unimodular gravity

    International Nuclear Information System (INIS)

    Fiol, Bartomeu; Garriga, Jaume

    2010-01-01

    Classically, unimodular gravity is known to be equivalent to General Relativity (GR), except for the fact that the effective cosmological constant Λ has the status of an integration constant. Here, we explore various formulations of unimodular gravity beyond the classical limit. We first consider the non-generally covariant action formulation in which the determinant of the metric is held fixed to unity. We argue that the corresponding quantum theory is also equivalent to General Relativity for localized perturbative processes which take place in generic backgrounds of infinite volume (such as asymptotically flat spacetimes). Next, using the same action, we calculate semiclassical non-perturbative quantities, which we expect will be dominated by Euclidean instanton solutions. We derive the entropy/area ratio for cosmological and black hole horizons, finding agreement with GR for solutions in backgrounds of infinite volume, but disagreement for backgrounds with finite volume. In deriving the above results, the path integral is taken over histories with fixed 4-volume. We point out that the results are different if we allow the 4-volume of the different histories to vary over a continuum range. In this ''generalized'' version of unimodular gravity, one recovers the full set of Einstein's equations in the classical limit, including the trace, so Λ is no longer an integration constant. Finally, we consider the generally covariant theory due to Henneaux and Teitelboim, which is classically equivalent to unimodular gravity. In this case, the standard semiclassical GR results are recovered provided that the boundary term in the Euclidean action is chosen appropriately

  10. Decoherence and back reaction: The origin of the semiclassical Einstein equations

    International Nuclear Information System (INIS)

    Paz, J.P.; Sinha, S.

    1991-01-01

    Two basic properties defining classical behavior are ''decoherence'' and ''correlations between coordinates and momenta.'' We study how the correlations that define the semiclassical decohering histories of the relevant cosmological variables are affected by the interaction with an environment formed by unobserved (''irrelevant'') degrees of freedom. For some quantum cosmological models we analyze under what conditions the semiclassical coarse-grained histories obey the so-called semiclassical Einstein's equations (i.e., G μν =κ left-angle T μν right-angle). These equations are shown to be valid only as a description of adiabatic regions of histories for which the interference effects have been suppressed. We also discuss the problem related to the existence of divergences in the decoherence factor of various quantum cosmological models

  11. Semi-classical signal analysis

    KAUST Repository

    Laleg-Kirati, Taous-Meriem

    2012-09-30

    This study introduces a new signal analysis method, based on a semi-classical approach. The main idea in this method is to interpret a pulse-shaped signal as a potential of a Schrödinger operator and then to use the discrete spectrum of this operator for the analysis of the signal. We present some numerical examples and the first results obtained with this method on the analysis of arterial blood pressure waveforms. © 2012 Springer-Verlag London Limited.

  12. Semiclassical S-matrix for black holes

    CERN Document Server

    Bezrukov, Fedor; Sibiryakov, Sergey

    2015-01-01

    We propose a semiclassical method to calculate S-matrix elements for two-stage gravitational transitions involving matter collapse into a black hole and evaporation of the latter. The method consistently incorporates back-reaction of the collapsing and emitted quanta on the metric. We illustrate the method in several toy models describing spherical self-gravitating shells in asymptotically flat and AdS space-times. We find that electrically neutral shells reflect via the above collapse-evaporation process with probability exp(-B), where B is the Bekenstein-Hawking entropy of the intermediate black hole. This is consistent with interpretation of exp(B) as the number of black hole states. The same expression for the probability is obtained in the case of charged shells if one takes into account instability of the Cauchy horizon of the intermediate Reissner-Nordstrom black hole. Our semiclassical method opens a new systematic approach to the gravitational S-matrix in the non-perturbative regime.

  13. A semiclassical approach to many-body interference in Fock-space

    Energy Technology Data Exchange (ETDEWEB)

    Engl, Thomas

    2015-11-01

    Many-body systems draw ever more physicists' attention. Such an increase of interest often comes along with the development of new theoretical methods. In this thesis, a non-perturbative semiclassical approach is developed, which allows to analytically study many-body interference effects both in bosonic and fermionic Fock space and is expected to be applicable to many research areas in physics ranging from Quantum Optics and Ultracold Atoms to Solid State Theory and maybe even High Energy Physics. After the derivation of the semiclassical approximation, which is valid in the limit of large total number of particles, first applications manifesting the presence of many-body interference effects are shown. Some of them are confirmed numerically thus verifying the semiclassical predictions. Among these results are coherent back-/forward-scattering in bosonic and fermionic Fock space as well as a many-body spin echo, to name only the two most important ones.

  14. Semiclassical shell structure of moments of inertia in deformed Fermi systems

    International Nuclear Information System (INIS)

    Magner, A.G.; Gzhebinsky, A.M.; Sitdikov, A.S.; Khamzin, A.A.; Bartel, J.

    2010-01-01

    The collective moment of inertia is derived analytically within the cranking model in the adiabatic mean-field approximation at finite temperature. Using the nonperturbative periodic-orbit theory the semiclassical shell-structure components of the collective moment of inertia are obtained for any potential well. Their relation to the free-energy shell corrections are found semiclassically as being given through the shell-structure components of the rigid-body moment of inertia of the statistically equilibrium rotation in terms of short periodic orbits. Shell effects in the moment of inertia disappear exponentially with increasing temperature. For the case of the harmonic-oscillator potential one observes a perfect agreement between semiclassical and quantum shell-structure components of the free energy and the moment of inertia for several critical bifurcation deformations and several temperatures. (author)

  15. Equivalence between the semiclassical and effective approaches to gravity

    International Nuclear Information System (INIS)

    Paszko, Ricardo; Accioly, Antonio

    2010-01-01

    Semiclassical and effective theories of gravitation are quite distinct from each other as far as the approximation scheme employed is concerned. In fact, while in the semiclassical approach gravity is a classical field and the particles and/or remaining fields are quantized, in the effective approach everything is quantized, including gravity, but the Feynman amplitude is expanded in terms of the momentum exchanged between the particles and/or fields. In this paper, we show that these approaches, despite being radically different, lead to equivalent results if one of the masses under consideration is much greater than all the other energies involved.

  16. Electrochemical Characterization of Ni/(Sc)YSZ Electrodes

    DEFF Research Database (Denmark)

    Ramos, Tania; Thydén, Karl Tor Sune; Mogensen, Mogens Bjerg

    2010-01-01

    Investigations of Ni/(Sc)YSZ cermets for solid oxide cells (SOCs) were performed by electrochemical impedance spectroscopy (EIS), under varying experimental conditions and upon redox cycling, using three different designs of symmetric cells. The deconvolution and fitting of the obtained impedance...... parameters. Initial degradation results for both Ni/ScYSZ and Ni/YSZ based anodes under very high steam content are also reported. ©2010 COPYRIGHT ECS - The Electrochemical Society...

  17. Semiclassical propagation: Hilbert space vs. Wigner representation

    Science.gov (United States)

    Gottwald, Fabian; Ivanov, Sergei D.

    2018-03-01

    A unified viewpoint on the van Vleck and Herman-Kluk propagators in Hilbert space and their recently developed counterparts in Wigner representation is presented. Based on this viewpoint, the Wigner Herman-Kluk propagator is conceptually the most general one. Nonetheless, the respective semiclassical expressions for expectation values in terms of the density matrix and the Wigner function are mathematically proven here to coincide. The only remaining difference is a mere technical flexibility of the Wigner version in choosing the Gaussians' width for the underlying coherent states beyond minimal uncertainty. This flexibility is investigated numerically on prototypical potentials and it turns out to provide neither qualitative nor quantitative improvements. Given the aforementioned generality, utilizing the Wigner representation for semiclassical propagation thus leads to the same performance as employing the respective most-developed (Hilbert-space) methods for the density matrix.

  18. Semiclassical quantization of the nonlinear Schrodinger equation

    International Nuclear Information System (INIS)

    Nohl, C.R.

    1976-01-01

    Using the functional integral technique of Dashen, Hasslacher, and Neveu, we perform a semiclassical quantization of the nonlinear Schrodinger equation (NLSE), which reproduces McGuire's exact result for the energy levels of the bound states of the theory. We show that the stability angle formalism leads to the one-loop normal ordering and self-energy renormalization expected from perturbation theory, and demonstrate that taking into account center-of-mass motion gives the correct nonrelativistic energy--momentum relation. We interpret the classical solution in the context of the quantum theory, relating it to the matrix element of the field operator between adjacent bound states in the limit of large quantum numbers. Finally, we quantize the NLSE as a theory of N component fermion fields and show that the semiclassical method yields the exact energy levels and correct degeneracies

  19. Semiclassical use of action-angle variables in the presence of tunnelling

    International Nuclear Information System (INIS)

    Carvalho, R.E. de; Almeida, A.M.O. de

    1988-01-01

    Semiclassical approximations of quantum mechanics are known to be invariant with respect to classical cannonical transformations even though these are not in general isomorphic to unitary transformations in quantum mechanics. It is verified computationally that the energy eigenlevels of a resonant system computed in a harmonic oscillator basis are in good agreement with the semiclassical values obtained with the use of action-angle variables. (A.C.A.S.) [pt

  20. Semi-classical description of matter wave interferometers and hybrid quantum systems

    Energy Technology Data Exchange (ETDEWEB)

    Schneider, Mathias

    2015-02-16

    This work considers the semi-classical description of two applications involving cold atoms. This is, on one hand, the behavior of a BOSE-EINSTEIN condensate in hybrid systems, i.e. in contact with a microscopic object (carbon nanotubes, fullerenes, etc.). On the other, the evolution of phase space distributions in matter wave interferometers utilizing ray tracing methods was discussed. For describing condensates in hybrid systems, one can map the GROSS-PITAEVSKII equation, a differential equation in the complex-valued macroscopic wave function, onto a system of two differential equations in density and phase. Neglecting quantum dispersion, one obtains a semiclassical description which is easily modified to incorporate interactions between condensate and microscopical object. In our model, these interactions comprise attractive forces (CASIMIR-POLDER forces) and loss of condensed atoms due to inelastic collisions at the surface of the object. Our model exhibited the excitation of sound waves that are triggered by the object's rapid immersion, and spread across the condensate thereafter. Moreover, local particle loss leads to a shrinking of the bulk condensate. We showed that the total number of condensed particles is decreasing potentially in the beginning (large condensate, strong mean field interaction), while it decays exponentially in the long-time limit (small condensate, mean field inetraction negligible). For representing the physics of matter wave interferometers in phase space, we utilized the WIGNER function. In semi-classical approximation, which again consists in ignoring the quantum dispersion, this representation is subject to the same equation of motion as classical phase space distributions, i.e. the LIOUVILLE equation. This implies that time evolution of theWIGNER function follows a phase space flow that consists of classical trajectories (classical transport). This means, for calculating a time-evolved distribution, one has know the initial

  1. Semiclassical approximation to time-dependent Hartree--Fock theory

    International Nuclear Information System (INIS)

    Dworzecka, M.; Poggioli, R.

    1976-01-01

    Working within a time-dependent Hartree-Fock framework, one develops a semiclassical approximation appropriate for large systems. It is demonstrated that the standard semiclassical approach, the Thomas-Fermi approximation, is inconsistent with Hartree-Fock theory when the basic two-body interaction is short-ranged (as in nuclear systems, for example). However, by introducing a simple extension of the Thomas-Fermi approximation, one overcomes this problem. One also discusses the infinite nuclear matter problem and point out that time-dependent Hartree-Fock theory yields collective modes of the zero sound variety instead of ordinary hydrodynamic (first) sound. One thus emphasizes that one should be extremely circumspect when attempting to cast the equations of motion of time-dependent Hartree-Fock theory into a hydrodynamic-like form

  2. Semiclassical theory of resonance inelastic electron-molecule collisions

    International Nuclear Information System (INIS)

    Kazanskij, A.K.

    1986-01-01

    Semiclassical approach to the theory of resonance electron-molecule collisions, unlocal with respect to interatomic distance was developed. Two problems were considered: modified adiabatic approach for sigle-pole approximation of R-matrix and Fano-Feshbach-Bardsley theory. It is shown that these problems are similar in semiclassical approximation. A simple equation system with coefficients expressed in quadratures was obtained. It enables to determine amplitudes of all processes (including dissociation adhesion, association ejection, free-free and free-bound transitions) in energetic representation with respect to nucleus vibrations in molecule with allowance for both descrete and continuous spectra of nucleus motion in molecule. Quantitative investigation of the system results to the notion of dynamic energy curve of intermediate state, generalizing the motion of such curve in boomerang theory

  3. Qutrit squeezing via semiclassical evolution

    International Nuclear Information System (INIS)

    Klimov, Andrei B; Dinani, Hossein Tavakoli; Medendorp, Zachari E D; Guise, Hubert de

    2011-01-01

    We introduce a concept of squeezing in collective qutrit systems through a geometrical picture connected to the deformation of the isotropic fluctuations of su(3) operators when evaluated in a coherent state. This kind of squeezing can be generated by Hamiltonians nonlinear in the generators of su(3) algebra. A simplest model of such a nonlinear evolution is analyzed in terms of semiclassical evolution of the SU(3) Wigner function. (paper)

  4. Semiclassical approach to fidelity amplitude

    International Nuclear Information System (INIS)

    García-Mata, Ignacio; Vallejos, Raúl O; Wisniacki, Diego A

    2011-01-01

    The fidelity amplitude (FA) is a quantity of paramount importance in echo-type experiments. We use semiclassical theory to study the average FA for quantum chaotic systems under external perturbation. We explain analytically two extreme cases: the random dynamics limit - attained approximately by strongly chaotic systems - and the random perturbation limit, which shows a Lyapunov decay. Numerical simulations help us to bridge the gap between both the extreme cases. (paper)

  5. Studies on a one-dimensional model for the spontaneous emission in the semiclassical approximation

    International Nuclear Information System (INIS)

    Crestana, S.

    1983-01-01

    Some generalization are made on the spontaneous emission by a plane of excited atoms, described by two level atom-model, in the Δ1=1, Δm=1, transition and using the semiclassical radiation approximation -both discussed in the text. Initially, the radiation rate of an infinite plane of excited atoms is investigated, using Δ1=0, Δm=0, transition. It is shown that we can observe a limit solution depending on the coupling between field and matter. (author)

  6. Quantum flesh on classical bones: Semiclassical bridges across the quantum-classical divide

    Energy Technology Data Exchange (ETDEWEB)

    Bokulich, Alisa [Center for Philosophy and History of Science, Boston University, Boston, MA (United States)

    2014-07-01

    Traditionally quantum mechanics is viewed as having made a sharp break from classical mechanics, and the concepts and methods of these two theories are viewed as incommensurable with one another. A closer examination of the history of quantum mechanics, however, reveals that there is a strong sense in which quantum mechanics was built on the backbone of classical mechanics. As a result, there is a considerable structural continuity between these two theories, despite their important differences. These structural continuities provide a ground for semiclassical methods in which classical structures, such as trajectories, are used to investigate and model quantum phenomena. After briefly tracing the history of semiclassical approaches, I show how current research in semiclassical mechanics is revealing new bridges across the quantum-classical divide.

  7. Recent developments in semiclassical mechanics: eigenvalues and reaction rate constants

    International Nuclear Information System (INIS)

    Miller, W.H.

    1976-04-01

    A semiclassical treatment of eigenvalues for a multidimensional non-separable potential function and of the rate constant for a chemical reaction with an activation barrier is presented. Both phenomena are seen to be described by essentially the same semiclassical formalism, which is based on a construction of the total Hamiltonian in terms of the complete set of ''good'' action variables (or adiabatic invariants) associated with the minimum in the potential energy surface for the eigenvalue case, or the saddle point in the potential energy surface for the case of chemical reaction

  8. Wave packets, Maslov indices, and semiclassical quantization

    International Nuclear Information System (INIS)

    Littlejohn, R.G.

    1989-01-01

    The Bohr-Sommerfeld quantization condition, as refined by Keller and Maslov, reads I=(n+m/4)h, where I is the classical action, n is the quantum number, and where m is the Maslov index, an even integer. The occurrence of the integers n and m in this formula is a reflection of underlying topological features of semiclassical quantization. In particular, the work of Arnold and others has shown that m/2 is a winding number of closed curves on the classical symplectic group manifold, Sp(2N). Wave packets provide a simple and elegant means of establishing the connection between semiclassical quantization and the homotopy classes of Sp(2N), as well as a practical way of calculating Maslov indices in complex problems. Topological methods can also be used to derive general formulas for the Maslov indices of invariant tori in the classical phase space corresponding to resonant motion. (orig.)

  9. Semiclassical description of hot nuclear systems

    International Nuclear Information System (INIS)

    Brack, M.

    1984-01-01

    We present semiclassical density variational calculations for highly excited nuclear systems. We employ the newly derived functionals tau[rho] and sigma[rho] of the extended Thomas-Fermi (ETF) model, generalized to finite temperatures. Excellent agreement is reached with Hartree-Fock (HF) results. We also calculated the fission barrier of 240 Pu as a function of the nuclear temperature

  10. Lasing in nanowires: Ab initio semiclassical model

    DEFF Research Database (Denmark)

    Bordo, Vladimir

    2013-01-01

    The semiclassical equations which describe lasing in nanowires are derived from first principles. Both the lasing threshold condition and the steady-state regime of operation are discussed. It is shown that the lasing is governed by the Fourier coefficients of the field susceptibility averaged ov...

  11. Semiclassical expansion of quantum characteristics for many-body potential scattering problem

    International Nuclear Information System (INIS)

    Krivoruchenko, M.I.; Fuchs, C.; Faessler, A.

    2007-01-01

    In quantum mechanics, systems can be described in phase space in terms of the Wigner function and the star-product operation. Quantum characteristics, which appear in the Heisenberg picture as the Weyl's symbols of operators of canonical coordinates and momenta, can be used to solve the evolution equations for symbols of other operators acting in the Hilbert space. To any fixed order in the Planck's constant, many-body potential scattering problem simplifies to a statistical-mechanical problem of computing an ensemble of quantum characteristics and their derivatives with respect to the initial canonical coordinates and momenta. The reduction to a system of ordinary differential equations pertains rigorously at any fixed order in ℎ. We present semiclassical expansion of quantum characteristics for many-body scattering problem and provide tools for calculation of average values of time-dependent physical observables and cross sections. The method of quantum characteristics admits the consistent incorporation of specific quantum effects, such as non-locality and coherence in propagation of particles, into the semiclassical transport models. We formulate the principle of stationary action for quantum Hamilton's equations and give quantum-mechanical extensions of the Liouville theorem on conservation of the phase-space volume and the Poincare theorem on conservation of 2p-forms. The lowest order quantum corrections to the Kepler periodic orbits are constructed. These corrections show the resonance behavior. (Abstract Copyright [2007], Wiley Periodicals, Inc.)

  12. Semiclassical mechanics with molecular applications

    CERN Document Server

    Child, M S

    2014-01-01

    Semiclassical mechanics, which stems from the old quantum theory, has seen a remarkable revival in recent years as a physically intuitive and computationally accurate scheme for the interpretation of modern experiments. The main text concentrates less on the mathematical foundations than on the global influence of the classical phase space structures on the quantum mechanical observables. Further mathematical detail is contained in the appendices. Worked problem sets are included as an aid to the student.

  13. Semiclassical force for electroweak baryogenesis three-dimensional derivation

    CERN Document Server

    Kainulainen, K; Schmidt, M G; Weinstock, S; Kainulainen, Kimmo; Prokopec, Tomislav; Schmidt, Michael G.; Weinstock, Steffen

    2002-01-01

    We derive a semiclassical transport equation for fermions propagating in the presence of a CP-violating planar bubble wall at a first order electroweak phase transition. Starting from the Kadanoff-Baym (KB) equation for the two-point (Wightman) function we perform an expansion in gradients, or equivalently in the Planck constant h-bar. We show that to first order in h-bar the KB equations have a spectral solution, which allows for an on-shell description of the plasma excitations. The CP-violating force acting on these excitations is found to be enhanced by a boost factor in comparison with the 1+1-dimensional case studied in a former paper. We find that an identical semiclassical force can be obtained by the WKB method. Applications to the MSSM are also mentioned.

  14. SC*994C>T causes the Sc(null) phenotype in Pacific Islanders and successful transfusion of Sc3+ blood to a patient with anti-Sc3.

    Science.gov (United States)

    Reid, Marion E; Hue-Roye, Kim; Velliquette, Randall W; Larimore, Kathleen; Moscarelli, Sue; Ohswaldt, Nicolas; Lomas-Francis, Christine

    2013-01-01

    Antigens in the SC blood group system are expressed by the human erythrocyte membrane-associated protein (ERMAP).Two molecular bases have been reported for the Sc,un phenotype:SC*307del2 and SC*994C>T. We report our investigation of the molecular background of five Sc,n1 individuals from the Pacific Islands and describe the successful transfusion of Sc3+ blood to a patient with anti-Sc3 in her plasma. SC (ERMAP) exons 2,3, and 12 and their flanking intronic regions were analyzed. TheSC*994C>T change introduces a restriction enzyme cleavage site for Tsp45I, and polymerase chain reaction (PCR) products from exon 12 were subjected to this PCR-restriction fragment length polymorphism (RFLP) assay. The five samples had the variant SC*994T/T. One sample, from a first cousin of one Marshallese proband, was heterozygous for SC*1514C/T (in the 3' untranslated region); the other four samples were SC*1514C/C(consensus sequence). Samples from white donors (n = 100) and African American donors (n = 99) were tested using the Tsp45IPCR-RFLP assay; all gave a banding pattern that was consistent with the SC*994C/C consensus sequence. In all five samples,our analyses showed homozygosity for the nonsense nucleotide change SC*994C>Tin an allele carrying the nucleotide associated with SLd. Further investigation determined that one of the probands reported previously with the SC*994C>T change was from the Marshall Islands (which form part of the Micronesian Pacific Islands) and the other was from an unspecified location within the large collection of Pacific Islands. Taken together, the five known probands with the SC*994C>T silencing nucleotide change were from the Pacific Islands.

  15. Semiclassics for matrix Hamiltonians: The Gutzwiller trace formula with applications to graphene-type systems

    Science.gov (United States)

    Vogl, M.; Pankratov, O.; Shallcross, S.

    2017-07-01

    We present a tractable and physically transparent semiclassical theory of matrix-valued Hamiltonians, i.e., those that describe quantum systems with internal degrees of freedoms, based on a generalization of the Gutzwiller trace formula for a n ×n dimensional Hamiltonian H (p ̂,q ̂) . The classical dynamics is governed by n Hamilton-Jacobi (HJ) equations that act in a phase space endowed with a classical Berry curvature encoding anholonomy in the parallel transport of the eigenvectors of H (p ,q ) ; these vectors describe the internal structure of the semiclassical particles. At the O (ℏ1) level and for nondegenerate HJ systems, this curvature results in an additional semiclassical phase composed of (i) a Berry phase and (ii) a dynamical phase resulting from the classical particles "moving through the Berry curvature". We show that the dynamical part of this semiclassical phase will, generally, be zero only for the case in which the Berry phase is topological (i.e., depends only on the winding number). We illustrate the method by calculating the Landau spectrum for monolayer graphene, the four-band model of AB bilayer graphene, and for a more complicated matrix Hamiltonian describing the silicene band structure. Finally, we apply our method to an inhomogeneous system consisting of a strain engineered one-dimensional moiré in bilayer graphene, finding localized states near the Dirac point that arise from electron trapping in a semiclassical moiré potential. The semiclassical density of states of these localized states we show to be in perfect agreement with an exact quantum mechanical calculation of the density of states.

  16. Semiclassical relations and IR effects in de Sitter and slow-roll space-times

    DEFF Research Database (Denmark)

    B. Giddings, Steven; Sloth, Martin Snoager

    2010-01-01

    We calculate IR divergent graviton one-loop corrections to scalar correlators in de Sitter space, and show that the leading IR contribution may be reproduced via simple semiclassical consistency relations. One can likewise use such semiclassical relations to calculate leading IR corrections to co...... with a sharp perturbative calculation of "missing information" in Hawking radiation....

  17. Uniform semiclassical approximation for absorptive scattering systems

    International Nuclear Information System (INIS)

    Hussein, M.S.; Pato, M.P.

    1987-07-01

    The uniform semiclassical approximation of the elastic scattering amplitude is generalized to absorptive systems. An integral equation is derived which connects the absorption modified amplitude to the absorption free one. Division of the amplitude into a diffractive and refractive components is then made possible. (Author) [pt

  18. A new approach to the semi-classical relativistic two-body problem for charged fermions

    International Nuclear Information System (INIS)

    Leiter, D.

    1978-01-01

    Generalizing from a recently developed hybrid formulation of classical electrodynamics with ''direct (charge-field) action'' structure an analogous semi-classical Dirac formulation of the theory is constructed, which is capable of describing the semi-classical quantum mechanics of two identical spin-1/2 particles. This semi-classical formulation is to be used as a heuristic aid in searching for the theoretical structure of a fully ''second quantized'' theory. The Pauli exclusion principle is incorporated by making the interaction fields (in the action principle) antisymmetric with respect to ''charge-field'' labeling. In this manner, ''position correlation'' effects associated with ''configuration interaction'' can also be accounted for. By studying the nature of the stationary-state solutions, the formalism is compared with the conventional quantum-mechanical one (to understand the similarities and the differences between this approach and the usual correlated Hartree-Fock approximation of ordinary relativistic quantum theory). The stationary-state solutions to the semi-classical formalism are shown to closely approximate the usual quantum-mechanical solutions when the wave functions are represented as a superposition of Slater determinants of Dirac-Coulombic-type wave functions with radial parts having a form which extremizes the total Breit energy. The manner in which this semi-classical theory might be extended to a fully ''second quantized'' formalism is sketched. (author)

  19. Semiclassical methods in curved spacetime and black hole thermodynamics

    International Nuclear Information System (INIS)

    Camblong, Horacio E.; Ordonez, Carlos R.

    2005-01-01

    Improved semiclassical techniques are developed and applied to a treatment of a real scalar field in a D-dimensional gravitational background. This analysis, leading to a derivation of the thermodynamics of black holes, is based on the simultaneous use of (i) a near-horizon description of the scalar field in terms of conformal quantum mechanics; (ii) a novel generalized WKB framework; and (iii) curved-spacetime phase-space methods. In addition, this improved semiclassical approach is shown to be asymptotically exact in the presence of hierarchical expansions of a near-horizon type. Most importantly, this analysis further supports the claim that the thermodynamics of black holes is induced by their near-horizon conformal invariance

  20. Semiclassical approximations for gravity and the issue of backreaction

    International Nuclear Information System (INIS)

    Padmanabhan, T.

    1989-01-01

    Semiclassical approximations, which are useful in the study of a quantum system interacting with a classical system, are studied and compared. In particular, we consider the Born-Oppenheimer approximation (BOA) (corresponding to G → O at fixed ℎ), the effective action approach (ℎ → O at fixed G) and their combinations. We show that in the strict BOA limit there is no backreaction on gravity. In the effective action approach one can obtain a semi-classical description of gravity, if certain stringent requirements are satisfied. In most situations of interest these conditions will not be met and the O(ℎ) contribution from gravitons will be comparable to that from quantum fields. (author)

  1. Sc-W-Si and Sc-W-Ge ternary systems

    International Nuclear Information System (INIS)

    Kotur, B.Ya.; Voznyak, O.M.; Bodak, O.I.

    1989-01-01

    Phase equilibria in Sc-W-Si and Sc-W-Ge ternary systems are investigated at 1070 K. Sc 2+x W 3-x Si 4 ternary compound (0≤x≤1) is determined, its crystal structure (Ce 2 Sc 3 Si 4 structural type), as well as, change of elementary cell parameters and microhardness within homogeneity range are determined. Regularities of component interaction within Sc-M-Si(Ge) (M-Cr, Mo, W) ternary system are determined. Ternary systems with Mo and W are more closer to each other according to the phase equilibria character, than to ternary systems with Cr

  2. Symplectic and semiclassical aspects of the Schläfli identity

    Science.gov (United States)

    Hedeman, Austin; Kur, Eugene; Littlejohn, Robert G.; Haggard, Hal M.

    2015-03-01

    The Schläfli identity, which is important in Regge calculus and loop quantum gravity, is examined from a symplectic and semiclassical standpoint in the special case of flat, three-dimensional space. In this case a proof is given, based on symplectic geometry. A series of symplectic and Lagrangian manifolds related to the Schläfli identity, including several versions of a Lagrangian manifold of tetrahedra, are discussed. Semiclassical interpretations of the various steps are provided. Possible generalizations to three-dimensional spaces of constant (nonzero) curvature, involving Poisson-Lie groups and q-deformed spin networks, are discussed.

  3. Semi-classical limit of relativistic quantum mechanics

    Indian Academy of Sciences (India)

    It is shown that the semi-classical limit of solutions to the Klein–Gordon equation gives the particle probability density that is in direct proportion to the inverse of the particle velocity. It is also shown that in the case of the Dirac equation a different result is obtained.

  4. Aldehyde dehydrogenase 1 is a marker for normal and malignant human colonic stem cells (SC) and tracks SC overpopulation during colon tumorigenesis.

    Science.gov (United States)

    Huang, Emina H; Hynes, Mark J; Zhang, Tao; Ginestier, Christophe; Dontu, Gabriela; Appelman, Henry; Fields, Jeremy Z; Wicha, Max S; Boman, Bruce M

    2009-04-15

    Although the concept that cancers originate from stem cells (SC) is becoming scientifically accepted, mechanisms by which SC contribute to tumor initiation and progression are largely unknown. For colorectal cancer (CRC), investigation of this problem has been hindered by a paucity of specific markers for identification and isolation of SC from normal and malignant colon. Accordingly, aldehyde dehydrogenase 1 (ALDH1) was investigated as a possible marker for identifying colonic SC and for tracking them during cancer progression. Immunostaining showed that ALDH1(+) cells are sparse and limited to the normal crypt bottom, where SCs reside. During progression from normal epithelium to mutant (APC) epithelium to adenoma, ALDH1(+) cells increased in number and became distributed farther up the crypt. CD133(+) and CD44(+) cells, which are more numerous and broadly distributed in normal crypts, showed similar changes during tumorigenesis. Flow cytometric isolation of cancer cells based on enzymatic activity of ALDH (Aldefluor assay) and implantation of these cells in nonobese diabetic-severe combined immunodeficient mice (a) generated xenograft tumors (Aldefluor(-) cells did not), (b) generated them after implanting as few as 25 cells, and (c) generated them dose dependently. Further isolation of cancer cells using a second marker (CD44(+) or CD133(+) serially) only modestly increased enrichment based on tumor-initiating ability. Thus, ALDH1 seems to be a specific marker for identifying, isolating, and tracking human colonic SC during CRC development. These findings also support our original hypothesis, derived previously from mathematical modeling of crypt dynamics, that progressive colonic SC overpopulation occurs during colon tumorigenesis and drives CRC development.

  5. Semiclassical universe from first principles

    International Nuclear Information System (INIS)

    Ambjorn, J.; Jurkiewicz, J.; Loll, R.

    2005-01-01

    Causal dynamical triangulations in four dimensions provide a background-independent definition of the sum over space-time geometries in non-perturbative quantum gravity. We show that the macroscopic four-dimensional world which emerges in the Euclidean sector of this theory is a bounce which satisfies a semiclassical equation. After integrating out all degrees of freedom except for a global scale factor, we obtain the ground state wave function of the universe as a function of this scale factor

  6. Generalized Gibbs distribution and energy localization in the semiclassical FPU problem

    Science.gov (United States)

    Hipolito, Rafael; Danshita, Ippei; Oganesyan, Vadim; Polkovnikov, Anatoli

    2011-03-01

    We investigate dynamics of the weakly interacting quantum mechanical Fermi-Pasta-Ulam (qFPU) model in the semiclassical limit below the stochasticity threshold. Within this limit we find that initial quantum fluctuations lead to the damping of FPU oscillations and relaxation of the system to a slowly evolving steady state with energy localized within few momentum modes. We find that in large systems this state can be described by the generalized Gibbs ensemble (GGE), with the Lagrange multipliers being very weak functions of time. This ensembles gives accurate description of the instantaneous correlation functions, both quadratic and quartic. Based on these results we conjecture that GGE generically appears as a prethermalized state in weakly non-integrable systems.

  7. Hydrogen atom in a magnetic field: Ghost orbits, catastrophes, and uniform semiclassical approximations

    International Nuclear Information System (INIS)

    Main, J.; Wunner, G.

    1997-01-01

    Applying closed-orbit theory to the recurrence spectra of the hydrogen atom in a magnetic field, one can interpret most, but not all, structures semiclassically in terms of closed classical orbits. In particular, conventional closed-orbit theory fails near bifurcations of orbits where semiclassical amplitudes exhibit unphysical divergences. Here we analyze the role of ghost orbits living in complex phase space. The ghosts can explain resonance structures in the spectra of the hydrogen atom in a magnetic field at positions where no real orbits exist. For three different types of catastrophes, viz. fold, cusp, and butterfly catastrophes, we construct uniform semiclassical approximations and demonstrate that these solutions are completely determined by classical parameters of the real orbits and complex ghosts. copyright 1997 The American Physical Society

  8. Modified method of perturbed stationary states. II. Semiclassical and low-velocity quantal approximations

    International Nuclear Information System (INIS)

    Green, T.A.

    1978-10-01

    For one-electron heteropolar systems, the wave-theoretic Lagrangian of Paper I 2 is simplified in two distinct approximations. The first is semiclassical; the second is quantal, for velocities below those for which the semiclassical treatment is reliable. For each approximation, unitarity and detailed balancing are discussed. Then, the variational method as described by Demkov is used to determine the coupled equations for the radial functions and the Euler-Lagrange equations for the translational factors which are part of the theory. Specific semiclassical formulae for the translational factors are given in a many-state approximation. Low-velocity quantal formulae are obtained in a one-state approximation. The one-state results of both approximations agree with an earlier determination by Riley. 14 references

  9. Some peculiarities of ScFe2 and ScNi2 interaction with ammonia in the presence of NH4Cl

    International Nuclear Information System (INIS)

    Shilkin, S.P.; Fokin, V.N.; Fokina, Eh.Eh.; Tarasov, B.P.; Korobkov, I.I.

    2000-01-01

    Interaction of ScFe 2 and ScNi 2 intermetallic compounds with ammonia in the presence of NH 4 Cl (10 mass % from intermetallide introduced in reaction) as an activator of the process in initial ammonia pressure 0.6-0.8 MPa is investigated. Possibility of preparation of crystalline intermetallide hydrides and amorphous products in highly dispersed state at different temperature are shown. It is established that intermetallides decompose in ammonia medium at ≥ 450 Deg C [ru

  10. Semiclassical scattering theory

    International Nuclear Information System (INIS)

    Di Salvo, A.

    1985-01-01

    It is intended to write the semiclassical scattering amplitude as a sum of terms, each of them being associated to trajectory. First of all the classical equations of motion are studied, considering both the analytical (real and complex) solutions and a certain type of singular solutions, which behave similary to the difracted rays in optics; in particular, in the case of a central nuclear potential, classical effects like rainbow and orbiting and also wave effects like diffraction and direct reflection are singled out. Successively, considering the Debye expansion of the scattering amplitude relative to a central nuclear potential, and evaluating asymptotically each term by means of the saddle point technique, the decay exponents and difraction coefficients relative to such a potential are determined

  11. Nonlinear dynamics of semiclassical coherent states in periodic potentials

    International Nuclear Information System (INIS)

    Carles, Rémi; Sparber, Christof

    2012-01-01

    We consider nonlinear Schrödinger equations with either local or nonlocal nonlinearities. In addition, we include periodic potentials as used, for example, in matter wave experiments in optical lattices. By considering the corresponding semiclassical scaling regime, we construct asymptotic solutions, which are concentrated both in space and in frequency around the effective semiclassical phase-space flow induced by Bloch’s spectral problem. The dynamics of these generalized coherent states is governed by a nonlinear Schrödinger model with effective mass. In the case of nonlocal nonlinearities, we establish a novel averaging-type result in the critical case. This article is part of a special issue of Journal of Physics A: Mathematical and Theoretical devoted to ‘Coherent states: mathematical and physical aspects’. (paper)

  12. A semiclassical treatment of correlation energy for nuclear systems

    International Nuclear Information System (INIS)

    Nielsen, M.

    1988-01-01

    Starting with the separation of the many-body density operator in two parts, one describing the one-body aspects of the full density and the other containing all dynamic correlations information, the semiclassical approximation for the system correlation energy, was calculated. It is showm that, in this case, the Gaussian Wave Packets Phase Space Representation is more convenient than the Wely-Wigner Rrepresentation for the analysis of the semiclassical correlation energy. Using a phenomenological interaction, the correlation energy to the nuclear matter and some simmetric finite nucleus was calculated. The Fermi Surface Diffusivity, was also calculated. Finally, from the relation between this theory and the pertubation theory, we have done some considerations about the viability on the local densities expansion for energy functionals. (author) [pt

  13. A self-consistent semiclassical sum rule approach to the average properties of giant resonances

    International Nuclear Information System (INIS)

    Li Guoqiang; Xu Gongou

    1990-01-01

    The average energies of isovector giant resonances and the widths of isoscalar giant resonances are evaluated with the help of a self-consistent semiclassical Sum rule approach. The comparison of the present results with the experimental ones justifies the self-consistent semiclassical sum rule approach to the average properties of giant resonances

  14. Semiclassical description of soliton-antisoliton pair production in particle collisions

    Energy Technology Data Exchange (ETDEWEB)

    Demidov, S.V.; Levkov, D.G. [Institute for Nuclear Research of the Russian Academy of Sciences,60th October Anniversary prospect 7a, Moscow 117312 (Russian Federation)

    2015-11-10

    We develop a consistent semiclassical method to calculate the probability of topological soliton-antisoliton pair production in collisions of elementary particles. In our method one adds an auxiliary external field pulling the soliton and antisoliton in the opposite directions. This transforms the original scattering process into a Schwinger pair creation of the solitons induced by the particle collision. One describes the Schwinger process semiclassically and recovers the original scattering probability in the limit of vanishing external field. We illustrate the method in (1+1)-dimensional scalar field model where the suppression exponents of soliton-antisoliton production in the multiparticle and two-particle collisions are computed numerically.

  15. Chaos in the Dicke model: quantum and semiclassical analysis

    International Nuclear Information System (INIS)

    Bastarrachea-Magnani, Miguel Angel; Hirsch, Jorge G; López-del-Carpio, Baldemar; Lerma-Hernández, Sergio

    2015-01-01

    The emergence of chaos in an atom-field system is studied employing both semiclassical and numerical quantum techniques, taking advantage of the algebraic character of the Hamiltonian. A semiclassical Hamiltonian is obtained by considering the expectation value of the quantum Hamiltonian in Glauber (for the field) and Bloch (for the atoms) coherent states. Regular and chaotic regions are identified by looking at the Poincaré sections for different energies and parameter values. An analytical expression for the semiclassical energy density of states is obtained by integrating the available phase space, which provides an exact unfolding to extract the fluctuations in the level statistics. Quantum chaos is recognized in these fluctuations, as a function of the coupling strength, for different regions in the energy spectrum, evaluating the Anderson–Darling (A–D) parameter, which distinguishes the Wigner- or Poisson-like distributions. Peres lattices play a role similar to the Poincaré section for quantum states. They are calculated employing efficient numerical solutions and are a powerful visual tool to identify individual states belonging to a regular or chaotic region, classified by utilizing the Poincaré sections and the A–D parameter. Finally, the quantum Husimi function for selected excited states is shown to have a noticeable similitude with the Poincaré sections at the same energy. (invited comment)

  16. Comparative study of quantal and semiclassical treatments of charge transfer between O+ and He

    Science.gov (United States)

    Zhao, L. B.; Joseph, D. C.; Saha, B. C.; Liebermann, H. P.; Funke, P.; Buenker, R. J.

    2009-03-01

    A comparative study for the electron capture process O+(S40,D20,P20)+He→O(P3)+He+ is reported. The cross sections are calculated using fully quantal and semiclassical molecular-orbital close-coupling (MOCC) approaches in the adiabatic representation. Detailed comparison of transition probabilities and cross sections is made from both MOCC approaches and displays close agreement above ˜125eV/u . The remarkable discrepancies between the earlier semiclassical and quantal MOCC approaches may be attributed to the insufficient step-size resolution in their semiclassical calculation [M. Kimura , Phys. Rev. A 50, 4854 (1994)]. Our results have also been compared with experiment and found to be in good agreement.

  17. Semi-classical approximation and the problem of boundary conditions in the theory of relativistic particle radiation

    International Nuclear Information System (INIS)

    Akhiezer, A.I.; Shul'ga, N.F.

    1991-01-01

    The process of relativistic particle radiation in an external field has been studied in the semi-classical approximation rather extensively. The main problem arising in the studies is in expressing the formula of the quantum theory of radiation in terms of classical quantities, for example of the classical trajectories. However, it still remains unclear how the particle trajectory is assigned, that is which particular initial or boundary conditions determine the trajectory in semi-classical approximation quantum theory of radiation. We shall try to solve this problem. Its importance comes from the fact that in some cases one and the same boundary conditions may give rise to two or more trajectories. We demonstrate that this fact must necessarily be taken into account on deriving the classical limit for the formulae of the quantum theory of radiation, since it leads to a specific interference effect in radiation. The method we used to deal with the problem is similar to the method employed by Fock to analyze the problem of a canonical transformation in classical and quantum mechanics. (author)

  18. Instanton and noninstanton tunneling in periodically perturbed barriers: semiclassical and quantum interpretations.

    Science.gov (United States)

    Takahashi, Kin'ya; Ikeda, Kensuke S

    2012-11-01

    In multidimensional barrier tunneling, there exist two different types of tunneling mechanisms, instanton-type tunneling and noninstanton tunneling. In this paper we investigate transitions between the two tunneling mechanisms from the semiclassical and quantum viewpoints taking two simple models: a periodically perturbed Eckart barrier for the semiclassical analysis and a periodically perturbed rectangular barrier for the quantum analysis. As a result, similar transitions are observed with change of the perturbation frequency ω for both systems, and we obtain a comprehensive scenario from both semiclassical and quantum viewpoints for them. In the middle range of ω, in which the plateau spectrum is observed, noninstanton tunneling dominates the tunneling process, and the tunneling amplitude takes the maximum value. Noninstanton tunneling explained by stable-unstable manifold guided tunneling (SUMGT) from the semiclassical viewpoint is interpreted as multiphoton-assisted tunneling from the quantum viewpoint. However, in the limit ω→0, instanton-type tunneling takes the place of noninstanton tunneling, and the tunneling amplitude converges on a constant value depending on the perturbation strength. The spectrum localized around the input energy is observed, and there is a scaling law with respect to the width of the spectrum envelope, i.e., the width ∝ℏω. In the limit ω→∞, the tunneling amplitude converges on that of the unperturbed system, i.e., the instanton of the unperturbed system.

  19. Semiclassical treatment of nuclear effects in Coulomb excitation

    Energy Technology Data Exchange (ETDEWEB)

    Canto, L F; Donangelo, R [Universidade Federal do Rio de Janeiro, RJ (Brazil). Inst. de Fisica; Rasmussen, J O; Ring, P; Stoyer, M A [Lawrence Berkeley Lab., CA (USA). Nuclear Science Div.

    1990-09-27

    We introduce the effects of the nuclear potential in the semiclassical Alder-Winther-de Boer method, both in the coupling matrix elements and as corrections to the Rutherford orbit. We compare our results to those of pure Coulomb excitation and to coupled-channel calculations. (orig.).

  20. Resolution of potential ambiguities through farside angular structure: Semiclassical analysis

    International Nuclear Information System (INIS)

    Fricke, S.H.; Brandan, M.E.; McVoy, K.W.

    1988-01-01

    The optical potential fits summarized in the preceding paper are subjected to a semiclassical analysis of the Ford-Wheeler--Knoll-Schaeffer type. The important broad dips in their farside cross sections, which are essential in greatly reducing potential ambiguities, are found (in partial agreement with a suggestion of Goldberg's) to be mainly weak ''Airy'' or rainbow minima, that serve to identify deeply penetrating trajectories. The semiclassical analysis also permits the identification and understanding of a new category of discrete and continuous potential ambiguities, and suggests the manner in which specific features of the angular distributions (such as spacings and depths of various angular minima) determine the Woods-Saxon parameters found by a chi-squared search

  1. Classical properties and semiclassical quantization of a spherical nuclear potential

    International Nuclear Information System (INIS)

    Carbonell, J.; Brut, F.; Arvieu, R.; Touchard, J.

    1984-03-01

    The geometrical properties of the classical energy-action surface are studied for a nuclear Woods-Saxon-like spherical potential, in connection with the E.B.K. semiclassical method of quantization. Comparisons are made with other well known cases: the spherical harmonic oscillator and the spherical billiard. The shift of single particle energies from A = 208 to A = 16 is calculated by a simple method inspired by the Erhenfest adiabatic invariants. Semiclassical results are then compared with exact Schroedinger energies. It is seen that the most significant features of the single particle spectrum are explained by local properties of the energy action surface (curvature, slope) and by their evolution with the particle number

  2. Newtonian semiclassical gravity in the Ghirardi–Rimini–Weber theory with matter density ontology

    International Nuclear Information System (INIS)

    Derakhshani, Maaneli

    2014-01-01

    We propose a Newtonian semiclassical gravity theory based on the GRW collapse theory with matter density ontology (GRWm), which we term GRWmN. The theory is proposed because, as we show from previous arguments in the literature, the standard Newtonian semiclassical gravity theory based on the Schroedinger–Newton equations does not have a consistent Born rule probability interpretation for gravitationally self-interacting particles and implies gravitational cat states for macroscopic mass superpositions. By contrast, we show that GRWmN has a consistent statistical description of gravitationally self-interacting particles and adequately suppresses the cat states for macroscopic superpositions. Two possible routes to experimentally testing GRWmN are also considered. We conclude with a discussion of possible variants of GRWmN, what a general relativistic extension would involve, and various objections that might be raised against semiclassical gravity theories like GRWmN.

  3. Newtonian semiclassical gravity in the Ghirardi–Rimini–Weber theory with matter density ontology

    Energy Technology Data Exchange (ETDEWEB)

    Derakhshani, Maaneli, E-mail: maanelid@yahoo.com

    2014-03-01

    We propose a Newtonian semiclassical gravity theory based on the GRW collapse theory with matter density ontology (GRWm), which we term GRWmN. The theory is proposed because, as we show from previous arguments in the literature, the standard Newtonian semiclassical gravity theory based on the Schroedinger–Newton equations does not have a consistent Born rule probability interpretation for gravitationally self-interacting particles and implies gravitational cat states for macroscopic mass superpositions. By contrast, we show that GRWmN has a consistent statistical description of gravitationally self-interacting particles and adequately suppresses the cat states for macroscopic superpositions. Two possible routes to experimentally testing GRWmN are also considered. We conclude with a discussion of possible variants of GRWmN, what a general relativistic extension would involve, and various objections that might be raised against semiclassical gravity theories like GRWmN.

  4. Quantum versus semiclassical description of selftrapping: anharmonic effects

    International Nuclear Information System (INIS)

    Raghavan, S.; Bishop, A.R.; Kenkre, V.M.

    1998-09-01

    Selftrapping has been traditionally studied on the assumption that quasiparticles interact with harmonic phonons and that this interaction is linear in the displacement of the phonon. To complement recent semiclassical studies of anharmonicity and nonlinearity in this context, we present below a fully quantum mechanical analysis of a two-site system, where the oscillator is described by a tunably anharmonic potential, with a square well with infinite walls and the harmonic potential as its extreme limits, and wherein the interaction is nonlinear in the oscillator displacement. We find that even highly anharmonic polarons behave similar to their harmonic counterparts in that selftrapping is preserved for long times in the limit of strong coupling, and that the polaronic tunneling time scale depends exponentially on the polaron binding energy. Further, in agreement with earlier results related to harmonic polarons, the semiclassical approximation agrees with the full quantum result in the massive oscillator limit of small oscillator frequency and strong quasiparticle-oscillator coupling. (author)

  5. Semiclassical model of cross section for fast neutrons

    International Nuclear Information System (INIS)

    Rosato, A.; D'Oliveira, A.A.

    1977-01-01

    A study for main aspects of fast neutron scattering is presented and, a semiclassical approximation applying to several pratic cases is described. The obtained results are compared with experimental data for deformed nuclei, and, with theoretical data based on optical model without treatment of deformations. (M.C.K.) [pt

  6. Structures in semiclassical spectra: a question of scale

    International Nuclear Information System (INIS)

    Berry, M.V.

    1984-01-01

    Theories of semiclassical bound state spectra for systems with N freedoms are reviewed, emphasizing the different features occurring on successively finer scales of energy E, measured in terms of h/2π, and attempting to correlate these with whether the underlying classical motion is regular or irregular. (Auth.)

  7. Structure and bonding of ScCN and ScNC: Ground and low-lying states

    International Nuclear Information System (INIS)

    Kalemos, Apostolos; Metropoulos, Aristophanes; Mavridis, Aristides

    2012-01-01

    Graphical abstract: The experimentally unknown systems ScCN and ScNC have been studied through single reference CISD and CCSD(T) methods. A total of 20 = 10 (ScCN) + 10 (ScNC) states were examined. All states are quite ionic whereas ScNC(X ∼3 Δ) is stabler than ScCN(X ∼3 Δ) by ∼5 kcal/mol. Display Omitted Highlights: ► We have studied through ab initio methods the polytopic system Sc[CN]. ► A series of low lying states for both isomeric forms have been examined. ► Around equilibrium the system displays a pronounced Sc + [CN] − ionic character. - Abstract: We have studied the experimentally unknown Sc[CN] molecular system in both its isomeric forms, scandium cyanide (ScCN) and isocyanide (ScNC), through ab initio computations. We report energetics, geometries, harmonic frequencies, and dipole moments for the first 20 Sc[CN] states correlating diabatically to Sc + ( 3 D, 1 D, 3 F) + CN − (X 1 Σ + ). Both isomers have a pronounced ionic character around equilibrium due to the high electron affinity of the CN group and the low ionization energy of the Sc atom. According to our calculations the ScNC isomer (X ∼3 Δ) is stabler than the ScCN(X ∼3 Δ) by ∼5 kcal/mol.

  8. Mathematical and computational methods for semiclassical Schrödinger equations

    KAUST Repository

    Jin, Shi

    2011-04-28

    We consider time-dependent (linear and nonlinear) Schrödinger equations in a semiclassical scaling. These equations form a canonical class of (nonlinear) dispersive models whose solutions exhibit high-frequency oscillations. The design of efficient numerical methods which produce an accurate approximation of the solutions, or at least of the associated physical observables, is a formidable mathematical challenge. In this article we shall review the basic analytical methods for dealing with such equations, including WKB asymptotics, Wigner measure techniques and Gaussian beams. Moreover, we shall give an overview of the current state of the art of numerical methods (most of which are based on the described analytical techniques) for the Schrödinger equation in the semiclassical regime. © 2011 Cambridge University Press.

  9. Semiclassical approximation in Batalin-Vilkovisky formalism

    International Nuclear Information System (INIS)

    Schwarz, A.

    1993-01-01

    The geometry of supermanifolds provided with a Q-structure (i.e. with an odd vector field Q satisfying {Q, Q}=0), a P-structure (odd symplectic structure) and an S-structure (volume element) or with various combinations of these structures is studied. The results are applied to the analysis of the Batalin-Vilkovisky approach to the quantization of gauge theories. In particular the semiclassical approximation in this approach is expressed in terms of Reidemeister torsion. (orig.)

  10. Semiclassical quantization of integrable systems of few interacting anyons in a strong magnetic field

    International Nuclear Information System (INIS)

    Sivan, N.; Levit, S.

    1992-01-01

    We present a semiclassical theory of charged interacting anyons in a strong magnetic field. We derive the appropriate generalization of the WKB quantization conditions and determine the corresponding wave functions for non separable integrable anyonic systems. This theory is applies to a system of two interacting anyons, two interacting anyons in the presence of an impurity and three interacting anyons. We calculate the dependence of the semiclassical energy levels on the statistical parameter and find regions in which dependence follows very different patterns. The semiclassical treatment allows to find the correlation between these patterns and the change in the character of the classical motion of the system. We also test the accuracy of the mean field approximation for low and high energy states of the three anyons. (author)

  11. Semiclassical approximations in a mean-field theory with collision terms

    International Nuclear Information System (INIS)

    Galetti, D.

    1986-01-01

    Semiclassical approximations in a mean-field theory with collision terms are discussed taking the time dependent Hartree-Fock method as framework in the obtainment of the relevant parameters.(L.C.) [pt

  12. Semiclassical interpretation of the Aharonov-Bohm effect

    International Nuclear Information System (INIS)

    Weisz, J.F.

    1990-10-01

    A semiclassical calculation gives the exact answer for the Aharonov-Bohm phase shift due to a magnetic field; either in free space or in metallic or semiconducting rings. The magnetic vector potential is not required. The effect is interpretable as a special case of energy conservation involving the Lorentz force. The effect is nonlocal because conservation of energy is nonlocal. (author). 11 refs, 2 figs

  13. Sc-45 nuclear magnetic resonance analysis of precipitation in dilute Al-Sc alloys

    NARCIS (Netherlands)

    Celotto, S; Bastow, TJ

    Nuclear magnetic resonance (NMR) with Sc-45 is used to determine the solid solubility of scandium in aluminium and to follow the precipitation of Al3Sc during the ageing of an Al-0.06 at.% Sc alloy via the two fully resolved peaks, corresponding to Sc in the solid solution Al matrix and to Sc in the

  14. Morphologies and growth mechanisms of the eutectic particles in as-cast Al-Mg-Sc alloy; Morphologien und Wachstumsmechanismen eutektischer Partikel in Al-Mg-Sc-Legierung im Gusszustand

    Energy Technology Data Exchange (ETDEWEB)

    Pan, Dejiang; Zhou, Shi' ang; Li, Heng [Hefei Univ. of Technology (China); Zhang, Zhen; Wu, Yucheng [Laboratories of Nonferrous Metal Material and Processing Engineering of Anhui Province, Hefei (China); Li, Ming [Anhui Jianghuai Automobile Co., Ltd, Hefei (China)

    2017-04-15

    Primary particles with faceted cubic morphology were produced in as-cast Al-Mg alloy due to the addition of Sc. The cross-section of the particles revealed some eutectic structure composed of multilayer of 'Al{sub 3}Sc + α-Al + Al{sub 3}Sc..'. At the cooling rate of 200 - 300 K/s, Al{sub 3}Sc primary phase nucleated initially on oxides within the melt and developed to a cubic structure with a 'cellular-dendritic' mode of growth. The formation of α-Al structural shells was attributed as a reason for the segregation of Mg-rich lamellar dendrites at later stages. A growth mechanism for multilayer structure was proposed using the results presented.

  15. Coherent state methods for semi-classical heavy-ion physics

    International Nuclear Information System (INIS)

    Remaud, B.; Sebille, F.; Raffray, Y.

    1985-01-01

    A semi-classical model of many fermion systems is developed in view of solving the Vlasov equation; it provides an unified description of both static and dynamic properties of the system. The phase space distribution functions are written as convolution products of generalized coherent state distributions with semi-probabilistic weight functions. The generalized coherent states are defined from the local constants of motion of the dynamical system; they may reduce to the usuel ones (eigen states of the annihilation operator) only at the harmonic limit. Solving the Vlasov equation consists in two steps: (i) search for weight functions which properly describe the initial density distributions (ii) calculation of the evolutions of the coherent state set which acts as a moving basis for the Vlasov equation solutions. Sample applications to statics are analyzed: fermions in a harmonic field, self-consistent nuclear slabs. Outlooks of dynamical applications are discussed with a special attention to the fast nucleon emission in heavy-ion reactions

  16. Semiclassical description of resonant tunneling

    International Nuclear Information System (INIS)

    Bogomolny, E.B.; Rouben, D.C.

    1996-01-01

    A semiclassical formula is calculated for the tunneling current of electrons trapped in a potential well which can tunnel into and across a wide quantum well. The tunneling current is measured at the second interface of this well and the calculations idealized an experimental situation where a strong magnetic field tilted with respect to an electric field was used. It is shown that the contribution to the tunneling current, due to trajectories which begin at the first interface and end on the second, is dominant for periodic orbits which hit both walls of the quantum well. (author)

  17. Semiclassical scalar propagators in curved backgrounds: Formalism and ambiguities

    International Nuclear Information System (INIS)

    Grain, J.; Barrau, A.

    2007-01-01

    The phenomenology of quantum systems in curved space-times is among the most fascinating fields of physics, allowing--often at the gedankenexperiment level--constraints on tentative theories of quantum gravity. Determining the dynamics of fields in curved backgrounds remains, however, a complicated task because of the highly intricate partial differential equations involved, especially when the space metric exhibits no symmetry. In this article, we provide--in a pedagogical way--a general formalism to determine this dynamics at the semiclassical order. To this purpose, a generic expression for the semiclassical propagator is computed and the equation of motion for the probability four-current is derived. Those results underline a direct analogy between the computation of the propagator in general relativistic quantum mechanics and the computation of the propagator for stationary systems in nonrelativistic quantum mechanics. A possible application of this formalism to curvature-induced quantum interferences is also discussed

  18. Semiclassical shell structure and nuclear double-humped fission barriers

    Directory of Open Access Journals (Sweden)

    A. G. Magner

    2010-09-01

    Full Text Available We derived the semiclassical trace formulas for the level density as sums over periodic-orbit families and isolated orbits within the improved stationary phase method. Averaged level-density shell corrections and shell-structure energies are continuous through all symmetry-breaking (bifurcation points with the correct asymptotics of the standard stationary phase approach accounting for continuous symmetries. We found enhancement of the nuclear shell structure near bifurcations in the superdeformed region. Our semiclassical results for the averaged level densities with the gross-shell and more thin-shell structures and the energy shell corrections for critical deformations are in good agreement with the quantum calculations for several single-particle Hamiltonians, in particular for the potentials with a sharp spheroidal shape. Enhancement of the shell structure owing to bifurcations of the shortest 3-dimensional orbits from equatorial orbits is responsible for the second well of fission barrier in a superdeformation region.

  19. Crystal structure and phase stability of AlSc in the near-equiatomic Al–Sc alloy

    Energy Technology Data Exchange (ETDEWEB)

    Li, Juan; Huang, Li; Liang, Yongfeng [State Key Laboratory for Advanced Metals and Materials, University of Science and Technology Beijing, 30 Xueyuan Road, Beijing 100083 (China); Ye, Feng, E-mail: yefeng@skl.ustb.edu.cn [State Key Laboratory for Advanced Metals and Materials, University of Science and Technology Beijing, 30 Xueyuan Road, Beijing 100083 (China); Lin, Junpin [State Key Laboratory for Advanced Metals and Materials, University of Science and Technology Beijing, 30 Xueyuan Road, Beijing 100083 (China); Shang, Shunli; Liu, Zikui [Department of Materials Science and Engineering, The Pennsylvania State University, University Park, PA 16802 (United States)

    2015-01-05

    Highlights: • Two lattice structures of equiatomic Al–Sc compounds are confirmed. • Al–Sc phase at Sc 50 at.% has a space group of Pbam. • Al–Sc phase at Sc 55 at.% has a space group of B2. • B2 AlSc is a metastable phase with Sc 50 at.%. • Lattice transition between two compounds is proposed under local thermal stress. - Abstract: Intermetallic compound AlSc is found in the equiatomic Al–Sc binary alloy. The present work indicates that the orthorhombic AlSc with the Au{sub 2}CuZn-type structure can be formed at 50 at.% Sc, while the CsCl-type (B2) AlSc will be formed at 55 at.% Sc. After annealing at 1100 °C, some orthorhombic AlSc grains transit to the B2 structure, and the annealing at lower temperatures leads to the disappearance of B2 phase, indicating that the B2 AlSc is also a metastable phase in the alloy at lower Sc content (<50 at.%). First-principle calculations at 0 K reveal that the orthorhombic AlSc is more stable than the B2 AlSc with the energy difference between them being 5.4 meV/atom. The fast transition between these two phases, which cannot be interpreted by the mechanism of atomic diffusion, was tentatively analyzed by the volume change based on the calculated atomic positions of these two phases.

  20. Semiclassical quantum gravity: statistics of combinatorial Riemannian geometries

    International Nuclear Information System (INIS)

    Bombelli, L.; Corichi, A.; Winkler, O.

    2005-01-01

    This paper is a contribution to the development of a framework, to be used in the context of semiclassical canonical quantum gravity, in which to frame questions about the correspondence between discrete spacetime structures at ''quantum scales'' and continuum, classical geometries at large scales. Such a correspondence can be meaningfully established when one has a ''semiclassical'' state in the underlying quantum gravity theory, and the uncertainties in the correspondence arise both from quantum fluctuations in this state and from the kinematical procedure of matching a smooth geometry to a discrete one. We focus on the latter type of uncertainty, and suggest the use of statistical geometry as a way to quantify it. With a cell complex as an example of discrete structure, we discuss how to construct quantities that define a smooth geometry, and how to estimate the associated uncertainties. We also comment briefly on how to combine our results with uncertainties in the underlying quantum state, and on their use when considering phenomenological aspects of quantum gravity. (Abstract Copyright [2005], Wiley Periodicals, Inc.)

  1. A time-dependent semiclassical wavepacket method using a fast Fourier transform (FFT) algorithm

    International Nuclear Information System (INIS)

    Gauss, J.; Heller, E.J.

    1991-01-01

    A new semiclassical propagator based on a local expansion of the potential up to second order around the moving center of the wavepackt is proposed. Formulas for the propagator are derived and the implementation using grid and fast Fourier transform (FFT) methods is discussed. The semiclassical propagator can be improved up to the exact quantum mechanical limit by including anharmonic corrections using a split operator approach. Preliminary applications to the CH 3 I photodissociation problem show the applicability and accuracy of the proposed method. (orig.)D

  2. Semiclassical moment of inertia shell-structure within the phase-space approach

    International Nuclear Information System (INIS)

    Gorpinchenko, D V; Magner, A G; Bartel, J; Blocki, J P

    2015-01-01

    The moment of inertia for nuclear collective rotations is derived within a semiclassical approach based on the cranking model and the Strutinsky shell-correction method by using the non-perturbative periodic-orbit theory in the phase-space variables. This moment of inertia for adiabatic (statistical-equilibrium) rotations can be approximated by the generalized rigid-body moment of inertia accounting for the shell corrections of the particle density. A semiclassical phase-space trace formula allows us to express the shell components of the moment of inertia quite accurately in terms of the free-energy shell corrections for integrable and partially chaotic Fermi systems, which is in good agreement with the corresponding quantum calculations. (paper)

  3. 46 CFR 7.70 - Folly Island, SC to Hilton Head Island, SC.

    Science.gov (United States)

    2010-10-01

    ... 46 Shipping 1 2010-10-01 2010-10-01 false Folly Island, SC to Hilton Head Island, SC. 7.70 Section... BOUNDARY LINES Atlantic Coast § 7.70 Folly Island, SC to Hilton Head Island, SC. (a) A line drawn from the...′ W. (Port Royal Sound Lighted Whistle Buoy “2PR”); thence to the easternmost extremity of Hilton Head...

  4. Semiclassical delta self-energy

    International Nuclear Information System (INIS)

    Voutier, E.

    1992-01-01

    We present a semiclassical approach in the Δ self-energy. We show that the in-medium corrections of the Δ width issued from the Pauli blocking and the coupling to the 2N-1h continuum are in good agreement with the previous approaches and particularly with the quantum Δ-h model even for light nuclei. We separate out the different sources of the imaginary part of the self-energy. The predominant corrections come from two antagonistic origins: The Pauli blocking and the contribution to the two-nucleon emission channel, the latter being model dependent. We further show that the non-diagonal spin matrix elements of the self-energy, generated by its tensor component, are mostly due to the Pauli blocking. (orig.)

  5. Quantum complex rotation and uniform semiclassical calculations of complex energy eigenvalues

    International Nuclear Information System (INIS)

    Connor, J.N.L.; Smith, A.D.

    1983-01-01

    Quantum and semiclassical calculations of complex energy eigenvalues have been carried out for an exponential potential of the form V 0 r 2 exp(-r) and Lennard-Jones (12,6) potential. A straightforward method, based on the complex coordinate rotation technique, is described for the quantum calculation of complex eigenenergies. For singular potentials, the method involves an inward and outward integration of the radial Schroedinger equation, followed by matching of the logarithmic derivatives of the wave functions at an intermediate point. For regular potentials, the method is simpler, as only an inward integration is required. Attention is drawn to the World War II researches of Hartree and co-workers who anticipated later quantum mechanical work on the complex rotation method. Complex eigenenergies are also calculated from a uniform semiclassical three turning point quantization formula, which allows for the proximity of the outer pair of complex turning points. Limiting cases of this formula, which are valid for very narrow or very broad widths, are also used in the calculations. We obtain good agreement between the semiclassical and quantum results. For the Lennard-Jones (12,6) potential, we compare resonance energies and widths from the complex energy definition of a resonance with those obtained from the time delay definition

  6. "Divide-and-conquer" semiclassical molecular dynamics: An application to water clusters

    Science.gov (United States)

    Di Liberto, Giovanni; Conte, Riccardo; Ceotto, Michele

    2018-03-01

    We present an investigation of vibrational features in water clusters performed by means of our recently established divide-and-conquer semiclassical approach [M. Ceotto, G. Di Liberto, and R. Conte, Phys. Rev. Lett. 119, 010401 (2017)]. This technique allows us to simulate quantum vibrational spectra of high-dimensional systems starting from full-dimensional classical trajectories and projection of the semiclassical propagator onto a set of lower dimensional subspaces. The potential energy surface employed is a many-body representation up to three-body terms, in which monomers and two-body interactions are described by the high level Wang-Huang-Braams-Bowman (WHBB) water potential, while, for three-body interactions, calculations adopt a fast permutationally invariant ab initio surface at the same level of theory of the WHBB 3-body potential. Applications range from the water dimer up to the water decamer, a system made of 84 vibrational degrees of freedom. Results are generally in agreement with previous variational estimates in the literature. This is particularly true for the bending and the high-frequency stretching motions, while estimates of modes strongly influenced by hydrogen bonding are red shifted, in a few instances even substantially, as a consequence of the dynamical and global picture provided by the semiclassical approach.

  7. Semi-classical calculation of the spin-isospin response functions

    International Nuclear Information System (INIS)

    Chanfray, G.

    1987-03-01

    We present a semi-classical calculation of the nuclear response functions beyond the Thomas-Fermi approximation. We apply our formalism to the spin-isospin responses and show that the surface peaked h/2π corrections considerably decrease the ratio longitudinal/transverse as obtained through hadronic probes

  8. High-resolution clean-sc

    NARCIS (Netherlands)

    Sijtsma, P.; Snellen, M.

    2016-01-01

    In this paper a high-resolution extension of CLEAN-SC is proposed: HR-CLEAN-SC. Where CLEAN-SC uses peak sources in “dirty maps” to define so-called source components, HR-CLEAN-SC takes advantage of the fact that source components can likewise be derived from points at some distance from the peak,

  9. The semiclassical S-matrix theory of three body Coulomb break-up

    International Nuclear Information System (INIS)

    Chocian, P.

    1999-01-01

    Using semiclassical methods we investigate the threshold behaviour for 3-particle break-up of a system with one particle of charge Z and two other particles of charge -q. For the particular case where the ratio of the charges of the third particle to the wing particles is Z/q = 1/4, the Wannier exponent for break-up diverges and it is found that the threshold law changes from a power law to an exponential law of the form exp(-λ/√E) which is in agreement with other results. Wannier's threshold theory is extended analytically to above threshold energies and it is found that the classical law for the divergent case is identical to an analytical result from the quantal hidden crossing theory. Corrections to the threshold behaviour for hydrogen from the above-threshold derivation are compared with those predicted by a calculation from hidden crossing theory. Excellent agreement is found which confirms the success of our classical derivation. The threshold behaviour is tested using semiclassical S-matrix theory above the region of divergence and it is found that for Z/q - of the initial states in S-matrix theory translates to a uniform distribution of outgoing trajectories on the boundary of the reaction zone. Observations of classical trajectories suggest that the radius of the reaction zone (R b ) is dependent on the total energy of the system. R b is determined numerically from ionization trajectories. When the dependence on R b is included in half-collision calculations, cross sections are produced which are in excellent agreement with full-collision S-matrix results for all values of Z > 0.25. (author)

  10. Quantization ambiguity, ergodicity and semiclassics

    International Nuclear Information System (INIS)

    Kaplan, Lev

    2002-01-01

    It is well known that almost all eigenstates of a classically ergodic system are individually ergodic on coarse-grained scales. This has important implications for the quantization ambiguity in ergodic systems: the difference between alternative quantizations is suppressed compared with the O( h-bar 2 ) ambiguity in the integrable or regular case. For two-dimensional ergodic systems in the high-energy regime, individual eigenstates are independent of the choice of quantization procedure, in contrast with the regular case, where even the ordering of eigenlevels is ambiguous. Surprisingly, semiclassical methods are shown to be much more precise in any dimension for chaotic than for integrable systems

  11. Semiclassical instability of warp drives

    Energy Technology Data Exchange (ETDEWEB)

    Barcelo, C [Instituto de Astrofisica de Andalucia, IAA-CSIC, Glorieta de la Astronomia s/n, 18008 Granada (Spain); Finazzi, S; Liberati, S, E-mail: carlos@iaa.e, E-mail: finazzi@sissa.i, E-mail: liberati@sissa.i

    2010-05-01

    Warp drives, at least theoretically, provide a way to travel at superluminal speeds. However, even if one succeeded in providing the necessary exotic matter to construct them, it would still be necessary to check whether they would survive to the switching on of quantum effects. In this contribution we will report on the behaviour of the Renormalized Stress-Energy Tensor (RSET) in the spacetimes associated with superluminal warp drives. We find that the RSET will exponentially grow in time close to the front wall of the superluminal bubble, hence strongly supporting the conclusion that the warp-drive geometries are unstable against semiclassical back-reaction.

  12. Semi-classical scalar propagators in curved backgrounds: formalism and ambiguities

    Energy Technology Data Exchange (ETDEWEB)

    Grain, J. [Laboratory for Subatomic Physics and Cosmology, Grenoble Universites, CNRS, IN2P3, 53, avenue de Martyrs, 38026 Grenoble cedex (France)]|[AstroParticle and Cosmology, Universite Paris 7, CNRS, IN2P3, 10, rue Alice Domon et Leonie Duquet, 75205 Paris cedex 13 (France); Barrau, A. [Laboratory for Subatomic Physics and Cosmology, Grenoble Universites, CNRS, IN2P3, 53, avenue de Martyrs, 38026 Grenoble cedex (France)

    2007-05-15

    The phenomenology of quantum systems in curved space-times is among the most fascinating fields of physics, allowing - often at the Gedanken experiment level - constraints on tentative theories of quantum gravity. Determining the dynamics of fields in curved backgrounds remains however a complicated task because of the highly intricate partial differential equations involved, especially when the space metric exhibits no symmetry. In this article, we provide - in a pedagogical way - a general formalism to determine this dynamics at the semi-classical order. To this purpose, a generic expression for the semi-classical propagator is computed and the equation of motion for the probability four-current is derived. Those results underline a direct analogy between the computation of the propagator in general relativistic quantum mechanics and the computation of the propagator for stationary systems in non-relativistic quantum mechanics. (authors)

  13. Semi-classical scalar propagators in curved backgrounds: formalism and ambiguities

    International Nuclear Information System (INIS)

    Grain, J.; Barrau, A.

    2007-05-01

    The phenomenology of quantum systems in curved space-times is among the most fascinating fields of physics, allowing - often at the Gedanken experiment level - constraints on tentative theories of quantum gravity. Determining the dynamics of fields in curved backgrounds remains however a complicated task because of the highly intricate partial differential equations involved, especially when the space metric exhibits no symmetry. In this article, we provide - in a pedagogical way - a general formalism to determine this dynamics at the semi-classical order. To this purpose, a generic expression for the semi-classical propagator is computed and the equation of motion for the probability four-current is derived. Those results underline a direct analogy between the computation of the propagator in general relativistic quantum mechanics and the computation of the propagator for stationary systems in non-relativistic quantum mechanics. (authors)

  14. Remnants of semiclassical bistability in the few-photon regime of cavity QED.

    Science.gov (United States)

    Kerckhoff, Joseph; Armen, Michael A; Mabuchi, Hideo

    2011-11-21

    Broadband homodyne detection of the light transmitted by a Fabry-Perot cavity containing a strongly-coupled (133)Cs atom is used to probe the dynamic optical response in a regime where semiclassical theory predicts bistability but strong quantum corrections should apply. While quantum fluctuations destabilize true equilibrium bistability, our observations confirm the existence of metastable states with finite lifetimes and a hysteretic response is apparent when the optical drive is modulated on comparable timescales. Our experiment elucidates remnant semiclassical behavior in the attojoule (~10 photon) regime of single-atom cavity QED, of potential significance for ultra-low power photonic signal processing. © 2011 Optical Society of America

  15. Non-trapping condition for semiclassical Schr dinger operators with matrix-valued potentials.

    CERN Document Server

    Jecko, T

    2004-01-01

    We consider semiclassical Schr dinger operators with matrix-valued, long-range, smooth potential, for which different eigenvalues may cross on a codimension one submanifold. We denote by h the semiclassical parameter and we consider energies above the bottom of the essential spectrum. Under some invariance condition on the matricial structure of the potential near the eigenvalues crossing and some structure condition at infinity, we prove that the boundary values of the resolvent at energy lambda, as bounded operators on suitable weighted spaces, are O(1/h) if and only if lambda is a non-trapping energy for all the Hamilton flows generated by the eigenvalues of the operator's symbol.

  16. Spectral statistics in semiclassical random-matrix ensembles

    International Nuclear Information System (INIS)

    Feingold, M.; Leitner, D.M.; Wilkinson, M.

    1991-01-01

    A novel random-matrix ensemble is introduced which mimics the global structure inherent in the Hamiltonian matrices of autonomous, ergodic systems. Changes in its parameters induce a transition between a Poisson and a Wigner distribution for the level spacings, P(s). The intermediate distributions are uniquely determined by a single scaling variable. Semiclassical constraints force the ensemble to be in a regime with Wigner P(s) for systems with more than two freedoms

  17. Nonlocal effective actions in semiclassical gravity: Thermal effects in stationary geometries

    Science.gov (United States)

    Elías, M.; Mazzitelli, F. D.; Trombetta, L. G.

    2017-11-01

    We compute the gravitational effective action by integrating out quantum matter fields in a weak gravitational field, using the Schwinger-Keldysh (in-in) formalism. We pay particular attention to the role of the initial quantum state in the structure of the nonlocal terms in the effective action, with an eye to nonlinear completions of the theory that may be relevant in astrophysics and cosmology. In this first paper we consider a quantum scalar field in thermal equilibrium, in a stationary gravitational field. We obtain a covariant expression for the nonlocal effective action, which can be expressed in terms of the curvature tensor, the four-velocity of the thermal bath, and the local Tolman temperature. We discuss the connection between the results for ultrastatic and static metrics through conformal transformations, and the main features of the thermal corrections to the semiclassical Einstein equations.

  18. A semiclassical study of optical potentials - potential resonances -

    International Nuclear Information System (INIS)

    Lee, S.Y.; Takigawa, N.; Marty, C.

    1977-01-01

    A semiclassical method is used to analyze resonances produced by complex potentials. The absorption plays a central role: when it is not too great, resonances manifest themselves by enhancement of cross sections near π. The reverse is not necessarily true, for instance the anomalous large angle scattering for α-Ca is due to a coherent superposition of many partial waves

  19. On the late-time behavior of Virasoro blocks and a classification of semiclassical saddles

    Energy Technology Data Exchange (ETDEWEB)

    Fitzpatrick, A. Liam [Department of Physics, Boston University,Commonwealth Avenue, Boston, MA 02215 (United States); Kaplan, Jared [Department of Physics and Astronomy, Johns Hopkins University,Charles Street, Baltimore, MD 21218 (United States)

    2017-04-12

    Recent work has demonstrated that black hole thermodynamics and information loss/restoration in AdS{sub 3}/CFT{sub 2} can be derived almost entirely from the behavior of the Virasoro conformal blocks at large central charge, with relatively little dependence on the precise details of the CFT spectrum or OPE coefficients. Here, we elaborate on the non-perturbative behavior of Virasoro blocks by classifying all ‘saddles’ that can contribute for arbitrary values of external and internal operator dimensions in the semiclassical large central charge limit. The leading saddles, which determine the naive semiclassical behavior of the Virasoro blocks, all decay exponentially at late times, and at a rate that is independent of internal operator dimensions. Consequently, the semiclassical contribution of a finite number of high-energy states cannot resolve a well-known version of the information loss problem in AdS{sub 3}. However, we identify two infinite classes of sub-leading saddles, and one of these classes does not decay at late times.

  20. Relativeness in quantum gravity: limitations and frame dependence of semiclassical descriptions

    International Nuclear Information System (INIS)

    Nomura, Yasunori; Sanches, Fabio; Weinberg, Sean J.

    2015-01-01

    Consistency between quantum mechanical and general relativistic views of the world is a longstanding problem, which becomes particularly prominent in black hole physics. We develop a coherent picture addressing this issue by studying the quantum mechanics of an evolving black hole. After interpreting the Bekenstein-Hawking entropy as the entropy representing the degrees of freedom that are coarse-grained to obtain a semiclassical description from the microscopic theory of quantum gravity, we discuss the properties these degrees of freedom exhibit when viewed from the semiclassical standpoint. We are led to the conclusion that they show features which we call extreme relativeness and spacetime-matter duality — a nontrivial reference frame dependence of their spacetime distribution and the dual roles they play as the “constituents” of spacetime and as thermal radiation. We describe black hole formation and evaporation processes in distant and infalling reference frames, showing that these two properties allow us to avoid the arguments for firewalls and to make the existence of the black hole interior consistent with unitary evolution in the sense of complementarity. Our analysis provides a concrete answer to how information can be preserved at the quantum level throughout the evolution of a black hole, and gives a basic picture of how general coordinate transformations may work at the level of full quantum gravity beyond the approximation of semiclassical theory.

  1. Sign and other aspects of semiclassical Casimir energies

    International Nuclear Information System (INIS)

    Schaden, Martin

    2006-01-01

    The Casimir energy of a massless scalar field is semiclassically given by contributions due to classical periodic rays. The required subtractions in the spectral density are determined explicitly. The semiclassical Casimir energies so defined coincide with those of zeta function regularization in the cases studied. Poles in the analytic continuation of zeta function regularization are related to nonuniversal subtractions in the spectral density. The sign of the Casimir energy of a scalar field on a smooth manifold is estimated by the sign of the contribution due to the shortest periodic rays only. Demanding continuity of the Casimir energy under small deformations of the manifold, the method is extended to integrable systems. The Casimir energy of a massless scalar field on a manifold with boundaries includes contributions due to periodic rays that lie entirely within the boundaries. These contributions in general depend on the boundary conditions. Although the Casimir energy due to a massless scalar field may be sensitive to the physical dimensions of manifolds with boundary. In favorable cases its sign can, contrary to conventional wisdom, be inferred without calculation of the Casimir energy

  2. Coherent and semiclassical states in a magnetic field in the presence of the Aharonov-Bohm solenoid

    Energy Technology Data Exchange (ETDEWEB)

    Bagrov, V G [Department of Physics, Tomsk State University, 634050 Tomsk (Russian Federation); Gavrilov, S P; Gitman, D M; Filho, D P Meira, E-mail: bagrov@phys.tsu.ru, E-mail: gavrilovsergeyp@yahoo.com, E-mail: gitman@dfn.if.usp.br, E-mail: dmeira@dfn.if.usp.br [Institute of Physics, University of Sao Paulo, CP 66318, CEP 05315-970 Sao Paulo, SP (Brazil)

    2011-02-04

    A new approach to constructing coherent states (CS) and semiclassical states (SS) in a magnetic-solenoid field is proposed. The main idea is based on the fact that the AB solenoid breaks the translational symmetry in the xy-plane; this has a topological effect such that there appear two types of trajectories which embrace and do not embrace the solenoid. Due to this fact, one has to construct two different kinds of CS/SS which correspond to such trajectories in the semiclassical limit. Following this idea, we construct CS in two steps, first the instantaneous CS (ICS) and then the time-dependent CS/SS as an evolution of the ICS. The construction is realized for nonrelativistic and relativistic spinning particles both in (2 + 1) and (3 + 1) dimensions and gives a non-trivial example of SS/CS for systems with a nonquadratic Hamiltonian. It is stressed that CS depending on their parameters (quantum numbers) describe both pure quantum and semiclassical states. An analysis is represented that classifies parameters of the CS in such respect. Such a classification is used for the semiclassical decompositions of various physical quantities.

  3. Coherent and semiclassical states in a magnetic field in the presence of the Aharonov-Bohm solenoid

    International Nuclear Information System (INIS)

    Bagrov, V G; Gavrilov, S P; Gitman, D M; Filho, D P Meira

    2011-01-01

    A new approach to constructing coherent states (CS) and semiclassical states (SS) in a magnetic-solenoid field is proposed. The main idea is based on the fact that the AB solenoid breaks the translational symmetry in the xy-plane; this has a topological effect such that there appear two types of trajectories which embrace and do not embrace the solenoid. Due to this fact, one has to construct two different kinds of CS/SS which correspond to such trajectories in the semiclassical limit. Following this idea, we construct CS in two steps, first the instantaneous CS (ICS) and then the time-dependent CS/SS as an evolution of the ICS. The construction is realized for nonrelativistic and relativistic spinning particles both in (2 + 1) and (3 + 1) dimensions and gives a non-trivial example of SS/CS for systems with a nonquadratic Hamiltonian. It is stressed that CS depending on their parameters (quantum numbers) describe both pure quantum and semiclassical states. An analysis is represented that classifies parameters of the CS in such respect. Such a classification is used for the semiclassical decompositions of various physical quantities.

  4. Semiclassical expansions for confined N fermion systems

    International Nuclear Information System (INIS)

    Krivine, H.; Martorell, J.; Casas, M.

    1989-01-01

    A new derivation of the Wigner Kirkwood expansion for N-fermion systems is presented, showing explicitly the connection to the WKB approximation for a single level. This allows to study separately the two ansatz required to obtain the semiclassical expansions: the asymptotic expansions in powers of ℎ and the smoothing of quantal effects. We discuss the one dimensional and three dimensional, with spherical symmetry, cases. Applications for standard potentials used in nuclear physics are described in detail

  5. Semiclassical limit of the FZZT Liouville theory

    International Nuclear Information System (INIS)

    Hadasz, Leszek; Jaskolski, Zbigniew

    2006-01-01

    The semiclassical limit of the FZZT Liouville theory on the upper half plane with bulk operators of arbitrary type and with elliptic boundary operators is analyzed. We prove the Polyakov conjecture for an appropriate classical Liouville action. This action is calculated in a number of cases: One bulk operator of arbitrary type, one bulk and one boundary, and two boundary elliptic operators. The results are in agreement with the classical limits of the corresponding quantum correlators

  6. Semiclassical limit of the FZZT Liouville theory

    Science.gov (United States)

    Hadasz, Leszek; Jaskólski, Zbigniew

    2006-11-01

    The semiclassical limit of the FZZT Liouville theory on the upper half plane with bulk operators of arbitrary type and with elliptic boundary operators is analyzed. We prove the Polyakov conjecture for an appropriate classical Liouville action. This action is calculated in a number of cases: One bulk operator of arbitrary type, one bulk and one boundary, and two boundary elliptic operators. The results are in agreement with the classical limits of the corresponding quantum correlators.

  7. Semiclassical limit of the FZZT Liouville theory

    OpenAIRE

    Hadasz, Leszek; Jaskolski, Zbigniew

    2006-01-01

    The semiclassical limit of the FZZT Liouville theory on the upper half plane with bulk operators of arbitrary type and with elliptic boundary operators is analyzed. We prove the Polyakov conjecture for an appropriate classical Liouville action. This action is calculated in a number of cases: one bulk operator of arbitrary type, one bulk and one boundary, and two boundary elliptic operators. The results are in agreement with the classical limits of the corresponding quantum correlators.

  8. Semiclassical limit of the FZZT Liouville theory

    Energy Technology Data Exchange (ETDEWEB)

    Hadasz, Leszek [Physikalisches Institut, Rheinische Friedrich-Wilhelms-Universitaet, Nussallee 12, 53115 Bonn (Germany); M. Smoluchowski Institute of Physics, Jagiellonian University, W. Reymonta 4, 30-059 Cracow (Poland)]. E-mail: hadasz@th.if.uj.edu.pl; Jaskolski, Zbigniew [Institute of Theoretical Physics, University of Wroclaw, pl. M. Borna 9, 50-204 Wroclaw (Poland)]. E-mail: jask@ift.uni.wroc.pl

    2006-11-27

    The semiclassical limit of the FZZT Liouville theory on the upper half plane with bulk operators of arbitrary type and with elliptic boundary operators is analyzed. We prove the Polyakov conjecture for an appropriate classical Liouville action. This action is calculated in a number of cases: One bulk operator of arbitrary type, one bulk and one boundary, and two boundary elliptic operators. The results are in agreement with the classical limits of the corresponding quantum correlators.

  9. Quasinormal modes of semiclassical electrically charged black holes

    Energy Technology Data Exchange (ETDEWEB)

    Fernandez Piedra, Owen Pavel [Departamento de Fisica y Quimica, Facultad de Mecanica, Universidad de Cienfuegos, Carretera a Rodas, km 4, Cuatro Caminos, Cienfuegos (Cuba); De Oliveira, Jeferson, E-mail: opavel@ucf.edu.cu, E-mail: jeferson@fma.if.usp.br [Instituto de Fisica, Universidade de Sao Paulo, CP 66318, 05315-970, Sao Paulo (Brazil)

    2011-04-21

    We report the results concerning the influence of vacuum polarization due to quantum massive vector, scalar and spinor fields on the scalar sector of quasinormal modes in spherically symmetric charged black holes. The vacuum polarization from quantized fields produces a shift in the values of the quasinormal frequencies, and correspondingly the semiclassical system becomes a better oscillator with respect to the classical Reissner-Nordstroem black hole.

  10. Domain shape dependence of semiclassical corrections to energy

    International Nuclear Information System (INIS)

    Kwiatkowski, Grzegorz

    2017-01-01

    Stationary solution of a one-dimensional sine-Gordon system is embedded in a multidimensional theory with an explicitly finite domain in the added spatial dimensions. Semiclassical corrections to energy are calculated for a static kink solution with emphasis on the impact of the scale of the domain as well as the choice of boundary conditions on the results for a rectangular cross-section. (paper)

  11. Evasive levels in quantisation through wavepacket coupling: a semi-classical investigation

    International Nuclear Information System (INIS)

    Amiot, P.; Giraud, B.

    1984-01-01

    A new method is presented to introduce classical mechanics elements into the problem of obtaining the spectrum of an operator H-circumflex(p-circumflex, q-circumflex). A finite-rank functional space is created by centering complex wavepackets on a discrete number of points on an equi-energy of the classical H(p,q) and by placing real wavepackets in the classically forbidden region. The latter span the active subspace, P, and the former the inactive subspace, Q, for an application of the method of Bloch-Horowitz. A semi-classical study of the Green function in the inactive subspace Q, classically allowed, gives a clear explanation of this phenomenon and sheds new light on the significance of this semi-classical approximation for the propagator. An extension to the problem of barrier penetration is proposed. (author)

  12. Few-body semiclassical approach to nucleon transfer and emission reactions

    Directory of Open Access Journals (Sweden)

    Sultanov Renat A.

    2014-04-01

    Full Text Available A three-body semiclassical model is proposed to describe the nucleon transfer and emission reactions in a heavy-ion collision. In this model the two heavy particles, i.e. nuclear cores A1(ZA1, MA1 and A2(ZA2, MA2, move along classical trajectories R→1(t${{\\vec R}_1}\\left( t \\right$ and R→2(t${{\\vec R}_2}\\left( t \\right$ respectively, while the dynamics of the lighter neutron (n is considered from a quantum mechanical point of view. Here, Mi are the nucleon masses and Zi are the Coulomb charges of the heavy nuclei (i = 1, 2. A Faddeev-type semiclassical formulation using realistic paired nuclear-nuclear potentials is applied so that all three channels (elastic, rearrangement and break-up are described in a unified manner. In order to solve the time-dependent equations the Faddeev components of the total three-body wave-function are expanded in terms of the input and output channel target eigenfunctions. In the special case, when the nuclear cores are identical (A1 ≡ A2 and also the two-level approximation in the expansion over the target (subsystem functions is used, the time-dependent semiclassical Faddeev equations are resolved in an explicit way. To determine the realistic R→1(t${{\\vec R}_1}\\left( t \\right$ and R→2(t${{\\vec R}_2}\\left( t \\right$ trajectories of the nuclear cores, a self-consistent approach based on the Feynman path integral theory is applied.

  13. Regular black holes from semi-classical down to Planckian size

    Science.gov (United States)

    Spallucci, Euro; Smailagic, Anais

    In this paper, we review various models of curvature singularity free black holes (BHs). In the first part of the review, we describe semi-classical solutions of the Einstein equations which, however, contains a “quantum” input through the matter source. We start by reviewing the early model by Bardeen where the metric is regularized by-hand through a short-distance cutoff, which is justified in terms of nonlinear electro-dynamical effects. This toy-model is useful to point-out the common features shared by all regular semi-classical black holes. Then, we solve Einstein equations with a Gaussian source encoding the quantum spread of an elementary particle. We identify, the a priori arbitrary, Gaussian width with the Compton wavelength of the quantum particle. This Compton-Gauss model leads to the estimate of a terminal density that a gravitationally collapsed object can achieve. We identify this density to be the Planck density, and reformulate the Gaussian model assuming this as its peak density. All these models, are physically reliable as long as the BH mass is big enough with respect to the Planck mass. In the truly Planckian regime, the semi-classical approximation breaks down. In this case, a fully quantum BH description is needed. In the last part of this paper, we propose a nongeometrical quantum model of Planckian BHs implementing the Holographic Principle and realizing the “classicalization” scenario recently introduced by Dvali and collaborators. The classical relation between the mass and radius of the BH emerges only in the classical limit, far away from the Planck scale.

  14. Determination of Sc and Th in ScI3-NaI-ThI4 sample

    International Nuclear Information System (INIS)

    Yuan Hui; Yang Zhihong

    1999-01-01

    Determination of Sc and Th in ScI 3 -NaI-ThI 4 sample is studied by X-ray fluorescence and complexometry. The effect of working condition of Sc on X-ray fluorescence spectrometer and different sample-making method on the determination of Sc and Th are studied experimentally. The X-ray fluorescence analysis of determination of Sc and Th is developed by polyester film sample-making technique, the measuring precision of Sc and Th is better than 4%. The effect of acidity and temperature on the determining end point of titration is obvious. The results of different complexometric methods are compared. The precision of Sc and Th is less than 2% by comlexometry, it is fit for the routine analysis of ScI 3 -NaI-ThI 4 sample

  15. The Geometry of the Semiclassical Wave Front Set for Schrödinger Eigenfunctions on the Torus

    Energy Technology Data Exchange (ETDEWEB)

    Cardin, Franco, E-mail: cardin@math.unipd.it; Zanelli, Lorenzo, E-mail: lzanelli@math.unipd.it [University of Padova, Department of Mathematics “Tullio Levi Civita” (Italy)

    2017-06-15

    This paper deals with the phase space analysis for a family of Schrödinger eigenfunctions ψ{sub ℏ} on the flat torus #Mathematical Double-Struck Capital T#{sup n} = (ℝ/2πℤ){sup n} by the semiclassical Wave Front Set. We study those ψ{sub ℏ} such that WF{sub ℏ}(ψ{sub ℏ}) is contained in the graph of the gradient of some viscosity solutions of the Hamilton-Jacobi equation. It turns out that the semiclassical Wave Front Set of such Schrödinger eigenfunctions is stable under viscous perturbations of Mean Field Game kind. These results provide a further viewpoint, and in a wider setting, of the link between the smooth invariant tori of Liouville integrable Hamiltonian systems and the semiclassical localization of Schrödinger eigenfunctions on the torus.

  16. The symmetric = ω -semi-classical orthogonal polynomials of class one

    Science.gov (United States)

    Maroni, P.; Mejri, M.

    2008-12-01

    We give the system of Laguerre-Freud equations associated with the = ω -semi-classical functionals of class one, where = ω is the divided difference operator. This system is solved in the symmetric case. There are essentially two canonical cases. The corresponding integral representations are given.

  17. Quantum versus semiclassical description of self-trapping: Anharmonic effects

    International Nuclear Information System (INIS)

    Raghavan, S.; Bishop, A.R.; Kenkre, V.M.

    1999-01-01

    Self-trapping has been traditionally studied on the assumption that quasiparticles interact with harmonic phonons and that this interaction is linear in the displacement of the phonon. To complement recent semiclassical studies of anharmonicity and nonlinearity in this context, we present below a fully quantum-mechanical analysis of a two-site system, where the oscillator is described by a tunably anharmonic potential, with a square well with infinite walls and the harmonic potential as its extreme limits, and wherein the interaction is nonlinear in the oscillator displacement. We find that even highly anharmonic polarons behave similar to their harmonic counterparts in that self-trapping is preserved for long times in the limit of strong coupling, and that the polaronic tunneling time scale depends exponentially on the polaron binding energy. Further, in agreement, with earlier results related to harmonic polarons, the semiclassical approximation agrees with the full quantum result in the massive oscillator limit of small oscillator frequency and strong quasiparticle-oscillator coupling. copyright 1999 The American Physical Society

  18. Semiclassical analysis of jm → j'm' transitions in rotationally inelastic collisions in cell experiments

    Science.gov (United States)

    Price, T. J.; Hickman, A. P.

    2018-02-01

    Recent quantum calculations of rotationally inelastic collisions of NaK (A1Σ+) with He or Ar in a cell experiment are analyzed using semiclassical approximations valid for large quantum numbers. The results suggest a physical interpretation of jm → j'm' transitions based on the vector model and lead to expressions that explicitly involve the initial and final polar angles of the angular momentum of the target molecule. The relation between the polar angle θ and the azimuthal quantum number m links the semiclassical results for the change in polar angle (θ → θ') to quantum results for an m → m' transition. Analytic formulas are derived that relate the location and width of peaks in the final polar angle distribution (PAD) to the K-dependence of the coefficients dK(j, j'), which are proportional to tensor cross sections σK(j → j'). Several special cases are treated that lead to final PADs that are approximately Lorentzian or sinc functions centered at θ' = θ. Another interesting case, "angular momentum reversal," was observed in the calculations for He. This phenomenon, which involves a reversal of the direction of the target's angular momentum, is shown to be associated with oscillatory behavior of the dK for certain transitions. Finally, several strategies for obtaining the dK coefficients from experimental data are discussed.

  19. The Wigner transform and the semi-classical approximations

    International Nuclear Information System (INIS)

    Shlomo, S.

    1985-01-01

    The Wigner transform provides a reformulation of quantum mechanics in terms of classical concepts. Some properties of the Wigner transform of the density matrix which justify its interpretation as the quantum-mechanical analog of the classical phase-space distribution function are presented. Considering some applications, it is demonstrated that the Wigner distribution function serves as a good starting point for semi-classical approximations to properties of the (nuclear) many-body system

  20. Relative criterion for validity of a semiclassical approach to the dynamics near quantum critical points.

    Science.gov (United States)

    Wang, Qian; Qin, Pinquan; Wang, Wen-ge

    2015-10-01

    Based on an analysis of Feynman's path integral formulation of the propagator, a relative criterion is proposed for validity of a semiclassical approach to the dynamics near critical points in a class of systems undergoing quantum phase transitions. It is given by an effective Planck constant, in the relative sense that a smaller effective Planck constant implies better performance of the semiclassical approach. Numerical tests of this relative criterion are given in the XY model and in the Dicke model.

  1. Measurement of the elastic tensor of SmScO3 and NdScO3 using resonant ultrasound spectroscopy with ab initio calculations

    Directory of Open Access Journals (Sweden)

    K. A. Pestka II

    2011-09-01

    Full Text Available The complete elastic tensors of SmScO3 and NdScO3 were measured using resonant ultrasound spectroscopy (RUS in combination with ab-initio calculations. Measurement of the elastic tensor of these recently synthesized single crystal RE scandates is essential for understanding dynamic lattice applications including phonon confinement, strain induced thin film growth and superlattice construction. On average, the experimental elastic constants differed by less than 5% of the theoretical values, further validating the accuracy of modern ab-initio calculations as a means of estimating the initial elastic constants used in RUS measurements.

  2. Semiclassical analysis, Witten Laplacians, and statistical mechanis

    CERN Document Server

    Helffer, Bernard

    2002-01-01

    This important book explains how the technique of Witten Laplacians may be useful in statistical mechanics. It considers the problem of analyzing the decay of correlations, after presenting its origin in statistical mechanics. In addition, it compares the Witten Laplacian approach with other techniques, such as the transfer matrix approach and its semiclassical analysis. The author concludes by providing a complete proof of the uniform Log-Sobolev inequality. Contents: Witten Laplacians Approach; Problems in Statistical Mechanics with Discrete Spins; Laplace Integrals and Transfer Operators; S

  3. 33 CFR 80.712 - Morris Island, SC to Hilton Head Island, SC.

    Science.gov (United States)

    2010-07-01

    ... 33 Navigation and Navigable Waters 1 2010-07-01 2010-07-01 false Morris Island, SC to Hilton Head..., SC to Hilton Head Island, SC. (a) A line drawn from the easternmost tip of Folley Island to the... easternmost extremity of Hilton Head at latitude 32°13.0′ N. longitude 80°40.1′ W. [CGD 77-118a, 42 FR 35784...

  4. Toxicity, tissue distribution and excretion of 46ScCl3 and 46Sc-EDTA in mice

    International Nuclear Information System (INIS)

    Lachine, E.E.; Noujaim, A.A.; Ediss, C.; Wiebe, L.I.

    1976-01-01

    The acute toxicity, differential distribution in tissue, and elimination of ScCl 3 , 46 ScCl 3 , Sc-EDTA and 46 Sc-EDTA, in mice, has been investigated. The LD 50 sup(24hr) doses for ScCl 3 were 440 and 24 mg kg -1 respectively after intraperitioneal and intravenous injection, and 720 and 108 mg kg -1 respectively for Sc-EDTA. 46 ScCl 3 was extensively deposited in the liver and the spleen. 46 Sc-EDTA was rapidly taken up by the kidney with subsequent elimation via the urine. While-body desaturation kinetics for 46 Sc-EDTA were found to fit a three compartmental model. The fast elimination phase (T1/2 = 12.75 min; K = 0.05540 min -1 ) accounted for 74.6% of the dose; the intermediate phase (T1/2 = 40.2 min; K = 0.01722 min -1 ) for 21.8%, and the slow (T1/2 = 5351 min; K = 0.00013 min -1 ) for 3.6% of the dose. (author)

  5. Soluble semiclassical model for a one-dimensional Δl=1, Δm=0, decay

    International Nuclear Information System (INIS)

    Costa, R.C.T. da; Crestana, S.

    1978-01-01

    The radiation emitted by a plane of excited two-level atoms, Δl=1, Δm=0 transition, is exactly calculated using a semiclassical model in which the electromagnetic field is treated classically (Maxwell's equations) and the coupling between matter and field is described in the electric dipole approximation. The influence of the plane density in the radiation rate is investigated in both limits of weak and strong coupling (defined in the text). It is shown that, in the second case, we can observe infinitely many solutions of the problem, depending on the initial value of the phase difference appearing in the definition of the excited state. Cases of phase choices leading to enhanced or attenuated emission rates are also discussed [pt

  6. Quantum Bound to Chaos and the Semiclassical Limit

    Science.gov (United States)

    Kurchan, Jorge

    2018-06-01

    We discuss the quantum bound on chaos in the context of the free propagation of a particle in an arbitrarily curved surface at low temperatures. The semiclassical calculation of the Lyapunov exponent can be performed in much the same way as the corresponding one for the `Loschmidt echo'. The bound appears here as the impossibility to scatter a wave, by effect of the curvature, over characteristic lengths smaller than the deBroglie wavelength.

  7. MuSC is involved in regulating axonal fasciculation of mouse primary vestibular afferents.

    Science.gov (United States)

    Kawauchi, Daisuke; Kobayashi, Hiroaki; Sekine-Aizawa, Yoko; Fujita, Shinobu C; Murakami, Fujio

    2003-10-01

    Regulation of axonal fasciculation plays an important role in the precise patterning of neural circuits. Selective fasciculation contributes to the sorting of different types of axons and prevents the misrouting of axons. However, axons must defasciculate once they reach the target area. To study the regulation of fasciculation, we focused on the primary vestibulo-cerebellar afferents (PVAs), which show a dramatic change from fasciculated axon bundles to defasciculated individual axons at their target region, the cerebellar primordium. To understand how fasciculation and defasciculation are regulated in this system, we investigated the roles of murine SC1-related protein (MuSC), a molecule belonging to the immunoglobulin superfamily. We show: (i) by comparing 1,1'-dioctadecyl-3,3,3',3'-tetramethylindocarbocyanine perchlorate (Dil) labelling and anti-MuSC immunohistochemistry, that downregulation of MuSC in PVAs during development is concomitant with the defasciculation of PVA axons; (ii) in a binding assay with cells expressing MuSC, that MuSC has cell-adhesive activity via a homophilic binding mechanism, and this activity is increased by multimerization; and (iii) that MuSC also displays neurite outgrowth-promoting activity in vestibular ganglion cultures. These findings suggest that MuSC is involved in axonal fasciculation and its downregulation may help to initiate the defasciculation of PVAs.

  8. Magnetic moment of {sup 48}Sc

    Energy Technology Data Exchange (ETDEWEB)

    Ohtsubo, T., E-mail: tohtsubo@np.gs.niigata-u.ac.jp; Kawamura, Y.; Ohya, S. [Niigata University, Department of Physics (Japan); Izumikawa, T. [Niigata University, Radioisotope Center (Japan); Nishimura, K. [Toyama University, Faculty of Engineering (Japan); Muto, S. [Neutron Science Laboratory, KEK (Japan); Shinozuka, T. [Tohoku University, Cyclotron and Radioisotope Center (Japan)

    2007-11-15

    Nuclear magnetic resonances were measured for {sup 48}Sc and {sup 44m}Sc oriented at 8 mK in an Fe host metal. The magnetic hyperfine splitting frequencies at an external magnetic field of 0.2 T were determined to be 63.22(11) MHz and 64.81(1) MHz for {sup 48}Sc and {sup 44m}Sc, respectively. With the known magnetic moment of {mu}({sup 44m}Sc)=+3.88 (1) {mu}{sub N}, the magnetic moment of {sup 48}Sc is deduced as {mu}({sup 44}Sc)=+3.785(12) {mu}{sub N}. The measured magnetic moment of {sup 48}Sc is discussed in terms of the shell model using the effective interactions.

  9. Semiclassical expansions on and near caustics

    International Nuclear Information System (INIS)

    Meetz, K.

    1984-09-01

    We show that the standard WKB expansion can be generalized so that it reproduces the behavior of the wave function on and near a caustic in two-dimensional space time. The expansion is related to the unfolding polynomials of the elementary catastrophes occurring in two dimensions: the fold and the cusp catastrophe. The method determines control parameters and transport coefficients in a self-consistent way from differential equations and does not refer to the asymptotic expansion of Feynman path integrals. The lowest order equations are solved explicitly in terms of the multivalued classical action. The result is a generalized semiclassical approximation on and beyond a caustic. (orig.)

  10. Semiclassical approach to black hole evaporation

    International Nuclear Information System (INIS)

    Lowe, D.A.

    1993-01-01

    Black hole evaporation may lead to massive or massless remnants, or naked singularities. This paper investigates this process in the context of two quite different two-dimensional black hole models. The first is the original Callan-Giddings-Harvey-Strominger (CGHS) model, the second is another two-dimensional dilaton-gravity model, but with properties much closer to physics in the real, four-dimensional, world. Numerical simulations are performed of the formation and subsequent evaporation of black holes and the results are found to agree qualitatively with the exactly solved modified CGHS models, namely, that the semiclassical approximation breaks down just before a naked singularity appears

  11. Electron self-mass in the semiclassical limit

    International Nuclear Information System (INIS)

    Pradham, T.; Khare, A.

    1978-01-01

    The semiclassical limit of the electron self-mass, which is the first order term in an expansion of the exact Dyson self-mass in powers of h/2π, is calculated. The result is quadratically divergent in the limit of the cut-off radius tending to zero. It is noted that the present result is quantum mechanical in the same sense as any WKB result and is exact to all orders in e 2 , in contrast to the logarithmically divergent self-mass given by other resuls. (U.K.)

  12. Emergent semiclassical time in quantum gravity: II. Full geometrodynamics and minisuperspace examples

    International Nuclear Information System (INIS)

    Anderson, Edward

    2007-01-01

    I apply the preceding paper's emergent semiclassical time approach to geometrodynamics. The analogy between the two papers is useful at the level of the quadratic constraints, while I document the differences between the two due to the underlying differences in their linear constraints. I find that the emergent time-dependent wave equation for the universe in general not a time-dependent Schroedinger equation but rather a more general equation containing second time derivatives, and estimate in which regime this becomes significant. I provide a specific minisuperspace example for my emergent semiclassical time scheme and compare it with the hidden York time scheme. Overall, interesting connections are shown between Newtonian, Leibniz-Mach-Barbour, Wentzel-Kramers-Brillouin (WKB) and cosmic times, while the Euler and York hidden dilational times are argued to be somewhat different from these

  13. Topotactic oxidation pathway of ScTiO3 and high-temperature structure evolution of ScTiO3.5 and Sc4Ti3O12-type phases.

    Science.gov (United States)

    Shafi, Shahid P; Hernden, Bradley C; Cranswick, Lachlan M D; Hansen, Thomas C; Bieringer, Mario

    2012-02-06

    The novel oxide defect fluorite phase ScTiO(3.5) is formed during the topotactic oxidation of ScTiO(3) bixbyite. We report the oxidation pathway of ScTiO(3) and structure evolution of ScTiO(3.5), Sc(4)Ti(3)O(12), and related scandium-deficient phases as well as high-temperature phase transitions between room temperature and 1300 °Cusing in-situ X-ray diffraction. We provide the first detailed powder neutron diffraction study for ScTiO(3). ScTiO(3) crystallizes in the cubic bixbyite structure in space group Ia3 (206) with a = 9.7099(4) Å. The topotactic oxidation product ScTiO(3.5) crystallizes in an oxide defect fluorite structure in space group Fm3m (225) with a = 4.89199(5) Å. Thermogravimetric and differential thermal analysis experiments combined with in-situ X-ray powder diffraction studies illustrate a complex sequence of a topotactic oxidation pathway, phase segregation, and ion ordering at high temperatures. The optimized bulk synthesis for phase pure ScTiO(3.5) is presented. In contrast to the vanadium-based defect fluorite phases AVO(3.5+x) (A = Sc, In) the novel titanium analogue ScTiO(3.5) is stable over a wide temperature range. Above 950 °C ScTiO(3.5) undergoes decomposition with the final products being Sc(4)Ti(3)O(12) and TiO(2). Simultaneous Rietveld refinements against powder X-ray and neutron diffraction data showed that Sc(4)Ti(3)O(12) also exists in the defect fluorite structure in space group Fm3m (225) with a = 4.90077(4) Å. Sc(4)Ti(3)O(12) undergoes partial reduction in CO/Ar atmosphere to form Sc(4)Ti(3)O(11.69(2)).

  14. CERN: SC-33

    Energy Technology Data Exchange (ETDEWEB)

    Anon.

    1991-06-15

    On 22 April a forward-looking CERN also looked back for a day, when the 'SC-33' event reviewed the achievements of CERN's first machine, the 600 MeV SynchroCyclotron (SC), which closed down on 17 December after 33 years of valiant service.

  15. Semi-classical quantization non-manifestly using the method of harmonic balance

    International Nuclear Information System (INIS)

    Stepanov, S.S.; Tutik, R.S.; Yaroshenko, A.P.; Schlippe, W. von.

    1990-01-01

    Based on the ideas of the harmonic balance method and h-expansion a semi-classical procedure for deriving approximations to the energy levels of one-dimensional quantum systems is developed. The procedure is applied to treat the perturbed oscillator potentials. 12 refs.; 2 tabs

  16. Dynamical cluster approximation plus semiclassical approximation study for a Mott insulator and d-wave pairing

    Science.gov (United States)

    Kim, SungKun; Lee, Hunpyo

    2017-06-01

    Via a dynamical cluster approximation with N c = 4 in combination with a semiclassical approximation (DCA+SCA), we study the doped two-dimensional Hubbard model. We obtain a plaquette antiferromagnetic (AF) Mott insulator, a plaquette AF ordered metal, a pseudogap (or d-wave superconductor) and a paramagnetic metal by tuning the doping concentration. These features are similar to the behaviors observed in copper-oxide superconductors and are in qualitative agreement with the results calculated by the cluster dynamical mean field theory with the continuous-time quantum Monte Carlo (CDMFT+CTQMC) approach. The results of our DCA+SCA differ from those of the CDMFT+CTQMC approach in that the d-wave superconducting order parameters are shown even in the high doped region, unlike the results of the CDMFT+CTQMC approach. We think that the strong plaquette AF orderings in the dynamical cluster approximation (DCA) with N c = 4 suppress superconducting states with increasing doping up to strongly doped region, because frozen dynamical fluctuations in a semiclassical approximation (SCA) approach are unable to destroy those orderings. Our calculation with short-range spatial fluctuations is initial research, because the SCA can manage long-range spatial fluctuations in feasible computational times beyond the CDMFT+CTQMC tool. We believe that our future DCA+SCA calculations should supply information on the fully momentum-resolved physical properties, which could be compared with the results measured by angle-resolved photoemission spectroscopy experiments.

  17. A semiclassical distorted wave theory of inclusive nucleon inelastic scattering to continuum

    International Nuclear Information System (INIS)

    Kawai, M.; Luo, Y.L.

    1989-01-01

    A semiclassical model is presented for the one step process of the inclusive nucleon inelastic scattering to the continuum. In the model, we use distorted waves for describing the motion of the incident and the exit nucleon, and the Thomas-Fermi model for the initial and the final states of the target nucleus. The averaged two-body cross section inside the nucleus is given by Kikuchi-Kawai expression. The model gives a closed form formula for the double differential cross section. No free parameter is included. We apply the model to the inclusive nucleon inelastic scattering from Al, Sn and Bi at 62 MeV, and Ni at 164 MeV. The angular distribution experimental data are reproduced very well except for small and large angle regions. The calculated energy spectra agree with the experimental data very well in the middle angle region and at high exit energies. (author)

  18. Angular momentum projected semiclassics

    International Nuclear Information System (INIS)

    Hasse, R.W.

    1986-10-01

    By using angular momentum projected plane waves as wave functions, we derive semiclassical expressions for the single-particle propagator, the partition function, the nonlocal density matrix, the single-particle density and the one particle- one hole level density for fixed angular momentum and fixed z-component or summed over the z-components. Other quantities can be deduced from the propagator. In coordinate space (r, r') the relevant quantities depend on vertical stroker - r 3 vertical stroke instead of vertical stroker - r'vertical stroke and in Wigner space (R, P) they become proportional to the angular momentum constraints δ(vertical strokeRxPvertical stroke/ℎ - l) and δ((RxP) z /ℎ - m). As applications we calculate the single-particle and one particle- one hole level densities for harmonic oscillator and Hill-Wheeler box potentials and the imaginary part of the optical potential and its volume integral with an underlying harmonic oscillator potential and a zero range two-body interaction. (orig.)

  19. Semiclassical description of resonant tunnel effect: bifurcations and periodic orbits in the resonant current

    International Nuclear Information System (INIS)

    Rouben, D.C.

    1997-01-01

    A semiclassical method for resonant tunneling in a quantum well in the presence of a magnetic field tilted with regard to an electric field is developed. In particular a semiclassical formula is derived for the total current of electrons after the second barrier of the quantum well. The contribution of the stable and unstable orbits is studied. It appears that the parameters which describe the classical chaos in the quantum well have an important effect on the tunneling current. A numerical experiment is led, the contributions to the current of some particular orbits are evaluated and the results are compared with those given by the quantum theory. (A.C.)

  20. The recurrence coefficients of semi-classical Laguerre polynomials and the fourth Painlevé equation

    Science.gov (United States)

    Filipuk, Galina; Van Assche, Walter; Zhang, Lun

    2012-05-01

    We show that the coefficients of the three-term recurrence relation for orthogonal polynomials with respect to a semi-classical extension of the Laguerre weight satisfy the fourth Painlevé equation when viewed as functions of one of the parameters in the weight. We compare different approaches to derive this result, namely, the ladder operators approach, the isomonodromy deformations approach and combining the Toda system for the recurrence coefficients with a discrete equation. We also discuss a relation between the recurrence coefficients for the Freud weight and the semi-classical Laguerre weight and show how it arises from the Bäcklund transformation of the fourth Painlevé equation.

  1. The recurrence coefficients of semi-classical Laguerre polynomials and the fourth Painlevé equation

    International Nuclear Information System (INIS)

    Filipuk, Galina; Van Assche, Walter; Zhang Lun

    2012-01-01

    We show that the coefficients of the three-term recurrence relation for orthogonal polynomials with respect to a semi-classical extension of the Laguerre weight satisfy the fourth Painlevé equation when viewed as functions of one of the parameters in the weight. We compare different approaches to derive this result, namely, the ladder operators approach, the isomonodromy deformations approach and combining the Toda system for the recurrence coefficients with a discrete equation. We also discuss a relation between the recurrence coefficients for the Freud weight and the semi-classical Laguerre weight and show how it arises from the Bäcklund transformation of the fourth Painlevé equation. (paper)

  2. CERN: SC-33

    International Nuclear Information System (INIS)

    Anon.

    1991-01-01

    On 22 April a forward-looking CERN also looked back for a day, when the 'SC-33' event reviewed the achievements of CERN's first machine, the 600 MeV SynchroCyclotron (SC), which closed down on 17 December after 33 years of valiant service

  3. S-C Mylonites

    NARCIS (Netherlands)

    Lister, G.S.; Snoke, A.W.

    1984-01-01

    Two types of foliations are commonly developed in mylonites and mylonitic rocks: (a) S-surfaces related to the accumulation of finite strain and (b) C-surfaces related to displacement discontinuities or zones of relatively high shear strain. There are two types of S-C mylonites. Type I S-C

  4. Semiclassical perturbation theory for diffraction in heavy atom surface scattering.

    Science.gov (United States)

    Miret-Artés, Salvador; Daon, Shauli; Pollak, Eli

    2012-05-28

    The semiclassical perturbation theory formalism of Hubbard and Miller [J. Chem. Phys. 78, 1801 (1983)] for atom surface scattering is used to explore the possibility of observation of heavy atom diffractive scattering. In the limit of vanishing ℏ the semiclassical theory is shown to reduce to the classical perturbation theory. The quantum diffraction pattern is sensitive to the characteristics of the beam of incoming particles. Necessary conditions for observation of quantum diffraction are derived for the angular width of the incoming beam. An analytic expression for the angular distribution as a function of the angular and momentum variance of the incoming beam is obtained. We show both analytically and through some numerical results that increasing the angular width of the incident beam leads to decoherence of the quantum diffraction peaks and one approaches the classical limit. However, the incoherence of the beam in the parallel direction does not destroy the diffraction pattern. We consider the specific example of Ar atoms scattered from a rigid LiF(100) surface.

  5. Combinatorial theory of the semiclassical evaluation of transport moments. I. Equivalence with the random matrix approach

    Energy Technology Data Exchange (ETDEWEB)

    Berkolaiko, G., E-mail: berko@math.tamu.edu [Department of Mathematics, Texas A and M University, College Station, Texas 77843-3368 (United States); Kuipers, J., E-mail: Jack.Kuipers@physik.uni-regensburg.de [Institut für Theoretische Physik, Universität Regensburg, D-93040 Regensburg (Germany)

    2013-11-15

    To study electronic transport through chaotic quantum dots, there are two main theoretical approaches. One involves substituting the quantum system with a random scattering matrix and performing appropriate ensemble averaging. The other treats the transport in the semiclassical approximation and studies correlations among sets of classical trajectories. There are established evaluation procedures within the semiclassical evaluation that, for several linear and nonlinear transport moments to which they were applied, have always resulted in the agreement with random matrix predictions. We prove that this agreement is universal: any semiclassical evaluation within the accepted procedures is equivalent to the evaluation within random matrix theory. The equivalence is shown by developing a combinatorial interpretation of the trajectory sets as ribbon graphs (maps) with certain properties and exhibiting systematic cancellations among their contributions. Remaining trajectory sets can be identified with primitive (palindromic) factorisations whose number gives the coefficients in the corresponding expansion of the moments of random matrices. The equivalence is proved for systems with and without time reversal symmetry.

  6. Determination of 46Sc in water

    International Nuclear Information System (INIS)

    Huo Bijun; Ji Zhaogang; Wang Juying

    1985-01-01

    Analytical procedures for the determination of 46 Sc in water is presented. 46 Sc in water is concentrated with Fe(OH) 3 ; Then 46 Sc is extracted with TBP and purified by precipitating it with Amygdalic Acid. Finally the precipitate is ignited into Sc 2 O 3 under 800 deg C and β-activity is counted. In this method chemical reeovery for Sc was (90.8 +- 2.8)% and radiochemical recovery for 46 Sc was (89.8 +- 3.8)%. Purification factors for some of the relevant Radionuclides ranged from 10 3 to 10 5

  7. Classical and semi-classical solutions of the Yang--Mills theory

    International Nuclear Information System (INIS)

    Jackiw, R.; Nohl, C.; Rebbi, C.

    1977-12-01

    This review summarizes what is known at present about classical solutions to Yang-Mills theory both in Euclidean and Minkowski space. The quantal meaning of these solutions is also discussed. Solutions in Euclidean space expose multiple vacua and tunnelling of the quantum theory. Those in Minkowski space-time provide a semi-classical spectrum for a conformal generator

  8. The effect of Sc additions on the microstructure and age hardening behaviour of as cast Al–Sc alloys

    International Nuclear Information System (INIS)

    Costa, S.; Puga, H.; Barbosa, J.; Pinto, A.M.P.

    2012-01-01

    Highlights: ► The Sc effect on the microstructure and ageing behaviour of Al–Sc alloys is studied. ► Cast into copper mould allows the elimination of solution heat treatment. ► Directly aged as cast alloys exhibits higher hardness and precipitation kinetics. ► Sc addition and optimised ageing result in an increase in Al–Sc mechanical properties. -- Abstract: The grain refinement effect and the ageing behaviour of Al–0.5 wt.% Sc, Al–0.7 wt.% Sc, and Al–1 wt.% Sc alloys are studied on the basis of optic microscopy (OM), scanning electron microscopy (SEM), X-ray diffraction (XRD) observations and hardness measurements. In Al–Sc alloys the higher grain refinement is observed for Sc contents greater than 0.5 wt.% accompanied by a notorious morphology modification, from coarse columnar grains to a fine perfect equiaxed structure. The as cast structures are characterised by a rich supersaturated solid solution in Sc, that promotes a great age hardening response at 250 °C and 300 °C. The age hardening curves also demonstrate a low overageing kinetics for all the alloys. Although the higher Sc content in solid solution for the alloys with 0.7 and 1 wt.% Sc, the age hardening response of all the Al–Sc alloys remains similar. The direct age hardening response of the as cast Al–0.5 wt.% Sc is shown to be greater than the solutionised and age hardened alloy.

  9. A wave propagation matrix method in semiclassical theory

    International Nuclear Information System (INIS)

    Lee, S.Y.; Takigawa, N.

    1977-05-01

    A wave propagation matrix method is used to derive the semiclassical formulae of the multiturning point problem. A phase shift matrix and a barrier transformation matrix are introduced to describe the processes of a particle travelling through a potential well and crossing a potential barrier respectively. The wave propagation matrix is given by the products of phase shift matrices and barrier transformation matrices. The method to study scattering by surface transparent potentials and the Bloch wave in solids is then applied

  10. Semiclassical scar functions in phase space

    International Nuclear Information System (INIS)

    Rivas, Alejandro M F

    2007-01-01

    We develop a semiclassical approximation for the scar function in the Weyl-Wigner representation in the neighborhood of a classically unstable periodic orbit of chaotic two-dimensional systems. The prediction of hyperbolic fringes, asymptotic to the stable and unstable manifolds, is verified computationally for a (linear) cat map, after the theory is adapted to a discrete phase space appropriate to a quantized torus. Characteristic fringe patterns can be distinguished even for quasi-energies where the fixed point is not Bohr-quantized. Also the patterns are highly localized in the neighborhood of the periodic orbit and along its stable and unstable manifolds without any long distance patterns that appear for the case of the spectral Wigner function

  11. Investigating the local structure of B-site cations in (1-x)BaTiO3-xBiScO3 and (1-x)PbTiO3-xBiScO3 using X-ray absorption spectroscopy

    Science.gov (United States)

    Blanchard, Peter E. R.; Grosvenor, Andrew P.

    2018-05-01

    The structural properties of (1-x)BaTiO3-xBiScO3 and (1-x)PbTiO3-xBiScO3 were investigated using powder X-ray diffraction and X-ray absorption spectroscopy. Diffraction measurements confirmed that substituting small amounts of BiScO3 into BaTiO3 initially stabilizes a cubic phase at x = 0.2 before impurity phases begin to form at x = 0.5. BiScO3 substitution also resulted in noticeable changes in the local coordination environment of Ti4+. X-ray absorption near-edge spectroscopy (XANES) analysis showed that replacing Ti4+ with Sc3+ results in an increase in the off-centre displacement of Ti4+ cations. Surprisingly, BiScO3 substitution has no effect on the displacement of the Ti4+ cation in the (1-x)PbTiO3-xBiScO3 solid solution.

  12. Effect of lectin (ScLL on fibroblasts stimulated with LPS - an in vitro study

    Directory of Open Access Journals (Sweden)

    Manuella Verdinelli de Paula REIS

    Full Text Available Abstract: The lectin (ScLL extracted from the Synadenium carinatum plant has been evaluated as an immunomodulator in diseases such as asthma, neosporosis and leishmaniasis. However, it has not yet been evaluated in the oral cavity. This study evaluated the effect of ScLL on viability, proliferation and release of IL-10 in human gingival fibroblasts (HGF stimulated with lipopolysaccharide (LPS. HGF were stimulated with LPS 1 µg/ml and treated with ScLL in concentrations of 10, 5 and 2 µg/ml for 1 and 5 h, and evaluated by flow cytometry for viability, apoptosis (initial/advanced and necrosis. The supernatant was collected to detect release of IL-10 by ELISA. The proliferation was assessed with the BrdU assay. Positive control consisted of cells maintained in Dulbecco's Modified Eagles Medium (DMEM, and the negative control, of those kept in tap water. Data were analyzed by ANOVA and Dunnett's test (α = 0.05. No significant difference was found for ScLL concentrations regarding viability or initial and advanced apoptosis (p=0.455. All the groups, including the positive control, had a significantly lower necrosis parameter than negative control at 5 h (p < 0.001. No difference was found for proliferation among the experimental groups (p = 0.832. ScLL at 5 and 2 µg/ml resulted in a lower release of IL-10 than positive and negative controls at 5 h (p = 0.047. The results indicated that ScLL concentrations tested were not cytotoxic, and had no effect on proliferation and release of IL-10 parameters. A thorough understanding of ScLL, regarding its immunomodulatory potential, may open the door to new perspectives for dentistry.

  13. Semiclassical analysis spectral correlations in mesoscopic systems

    International Nuclear Information System (INIS)

    Argaman, N.; Imry, Y.; Smilansky, U.

    1991-07-01

    We consider the recently developed semiclassical analysis of the quantum mechanical spectral form factor, which may be expressed in terms of classically defiable properties. When applied to electrons whose classical behaviour is diffusive, the results of earlier quantum mechanical perturbative derivations, which were developed under a different set of assumptions, are reproduced. The comparison between the two derivations shows that the results depends not on their specific details, but to a large extent on the principle of quantum coherent superposition, and on the generality of the notion of diffusion. The connection with classical properties facilitates application to many physical situations. (author)

  14. Various semiclassical limits of torus conformal blocks

    Energy Technology Data Exchange (ETDEWEB)

    Alkalaev, Konstantin [I.E. Tamm Department of Theoretical Physics, P.N. Lebedev Physical Institute,Leninsky ave. 53, Moscow, 119991 (Russian Federation); Department of General and Applied Physics, Moscow Institute of Physics and Technology,Institutskiy per. 7, Dolgoprudnyi, Moscow region, 141700 (Russian Federation); Geiko, Roman [Mathematics Department, National Research University Higher School of Economics,Usacheva str. 6, Moscow, 119048 (Russian Federation); Rappoport, Vladimir [I.E. Tamm Department of Theoretical Physics, P.N. Lebedev Physical Institute,Leninsky ave. 53, Moscow, 119991 (Russian Federation); Department of Quantum Physics, Institute for Information Transmission Problems,Bolshoy Karetny per. 19, Moscow, 127994 (Russian Federation)

    2017-04-12

    We study four types of one-point torus blocks arising in the large central charge regime. There are the global block, the light block, the heavy-light block, and the linearized classical block, according to different regimes of conformal dimensions. It is shown that the blocks are not independent being connected to each other by various links. We find that the global, light, and heavy-light blocks correspond to three different contractions of the Virasoro algebra. Also, we formulate the c-recursive representation of the one-point torus blocks which is relevant in the semiclassical approximation.

  15. Solid-State NMR Spectroscopy Proves the Presence of Penta-coordinated Sc Sites in MIL-100(Sc).

    Science.gov (United States)

    Giovine, Raynald; Volkringer, Christophe; Ashbrook, Sharon E; Trébosc, Julien; McKay, David; Loiseau, Thierry; Amoureux, Jean-Paul; Lafon, Olivier; Pourpoint, Frédérique

    2017-07-18

    Advanced solid-state NMR methods and first-principles calculations demonstrate for the first time the formation of penta-coordinated scandium sites. These coordinatively unsaturated sites were shown during the thermal activation of scandium-based metal-organic frameworks (MOFs). A 45 Sc NMR experiment allows their specific observation in activated Sc 3 BTB 2 (H 3 BTB=1,3,5-tris(4-carboxyphenyl)benzene) and MIL-100(Sc) MOFs. The assignment of the ScO 5 groups is supported by the DFT calculations of NMR parameters. The presence of ScO 5 Lewis acid sites in MIL-100(Sc) explains furthermore its catalytic activity. The first NMR experiment to probe 13 C- 45 Sc distances is also introduced. This advanced solid-state NMR pulse sequence allows the demonstration of the shrinkage of the MIL-100(Sc) network when the activation temperature is raised. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

  16. Semiclassical Weyl Formula for a Class of Weakly Regular Elliptic Operators

    Energy Technology Data Exchange (ETDEWEB)

    Zielinski, Lech [Universite du Littoral, LMPA, Centre Mi-Voix (France)], E-mail: Lech.Zielinski@lmpa.univ-littoral.fr

    2006-02-15

    We investigate the semiclassical Weyl formula describing the asymptotic behaviour of the counting function for the number of eigenvalues in the case of self-adjoint elliptic differential operators satisfying weak regularity hypotheses. We consider symbols with possible critical points and with coefficients which have Hoelder continuous derivatives of first order.

  17. Semiclassical Weyl Formula for a Class of Weakly Regular Elliptic Operators

    International Nuclear Information System (INIS)

    Zielinski, Lech

    2006-01-01

    We investigate the semiclassical Weyl formula describing the asymptotic behaviour of the counting function for the number of eigenvalues in the case of self-adjoint elliptic differential operators satisfying weak regularity hypotheses. We consider symbols with possible critical points and with coefficients which have Hoelder continuous derivatives of first order

  18. Semiclassical and quantum motions on the non-commutative plane

    International Nuclear Information System (INIS)

    Baldiotti, M.C.; Gazeau, J.P.; Gitman, D.M.

    2009-01-01

    We study the canonical and the coherent state quantizations of a particle moving in a magnetic field on the non-commutative plane. Using a θ-modified action, we perform the canonical quantization and analyze the gauge dependence of the theory. We compare coherent states quantizations obtained through Malkin-Man'ko states and circular squeezed states. The relation between these states and the 'classical' trajectories is investigated, and we present numerical explorations of some semiclassical quantities.

  19. On semiclassical analysis of pure spinor superstring in an AdS{sub 5} x S{sup 5} background

    Energy Technology Data Exchange (ETDEWEB)

    Aisaka, Yuri [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany); Sao Paulo State Univ. (Brazil). Inst. de Fisica Teorica; Ibiapina Bevilaqua, L. [Univ. Federal do Rio Grande do Norte, Natal (Brazil). Esola de Ciencias e Tecnologia; Vallilo, Brenno C. [Santiago Univ. (Chile). Dept. de Ciencias Fisicas

    2012-06-15

    Relation between semiclassical analyses of Green-Schwarz and pure spinor formalisms in an AdS{sub 5} x S{sup 5} background is clarified. It is shown that the two formalisms have identical semiclassical partition functions for a simple family of classical solutions. It is also shown that, when the classical string is furthermore rigid, this in turn implies that the two formalisms predict the same one-loop corrections to spacetime energies.

  20. On the semiclassical description of shell effects in finite fermion systems; Zur semiklassischen Beschreibung von Schaleneffekten in endlichen Fermionensystemen

    Energy Technology Data Exchange (ETDEWEB)

    Meier, Peter Johann

    2009-09-19

    An extension of Gutzwiller's semiclassical ''Periodic Orbit Theory'' for systems with continous symmetries is used to predict the ground state deformations of simple metal clusters which are described in the framework of the shell model. Restrictions of the theory caused by the semiclassical approximations are discussed and possible generalizations are demonstrated. The results are compared with corresponding quantum mechanical calculations. (orig.)

  1. Influence of semiclassical plasma on the energy levels and radiative transitions in highly charged ions★

    Science.gov (United States)

    Hu, Hong-Wei; Chen, Zhan-Bin; Chen, Wen-Cong; Liu, Xiao-Bin; Fu, Nian; Wang, Kai

    2017-11-01

    Considering the quantum effects of diffraction and the collective screening effects, the potential of test charge in semiclassical plasmas is derived. It is generalized exponential screened Coulomb potential. Using the Ritz variational method incorporating this potential, the effects of semiclassical plasma on the energy levels and radiative transitions are investigated systematically, taking highly charged H-like ion as an example. The Debye plasma model is also employed for comparison purposes. Comparisons and analysis are made between these two sets of results and the differences are discussed. Contribution to the Topical Issue "Atomic and Molecular Data and their Applications", edited by Gordon W.F. Drake, Jung-Sik Yoon, Daiji Kato, Grzegorz Karwasz.

  2. Infectivity-associated PrP(Sc) and disease duration-associated PrP(Sc) of mouse BSE prions.

    Science.gov (United States)

    Miyazawa, Kohtaro; Okada, Hiroyuki; Masujin, Kentaro; Iwamaru, Yoshifumi; Yokoyama, Takashi

    2015-01-01

    Disease-related prion protein (PrP(Sc)), which is a structural isoform of the host-encoded cellular prion protein, is thought to be a causative agent of transmissible spongiform encephalopathies. However, the specific role of PrP(Sc) in prion pathogenesis and its relationship to infectivity remain controversial. A time-course study of prion-affected mice was conducted, which showed that the prion infectivity was not simply proportional to the amount of PrP(Sc) in the brain. Centrifugation (20,000 ×g) of the brain homogenate showed that most of the PrP(Sc) was precipitated into the pellet, and the supernatant contained only a slight amount of PrP(Sc). Interestingly, mice inoculated with the obtained supernatant showed incubation periods that were approximately 15 d longer than those of mice inoculated with the crude homogenate even though both inocula contained almost the same infectivity. Our results suggest that a small population of fine PrP(Sc) may be responsible for prion infectivity and that large, aggregated PrP(Sc) may contribute to determining prion disease duration.

  3. On the Application of Stark Broadening Data Determined with a Semiclassical Perturbation Approach

    Directory of Open Access Journals (Sweden)

    Milan S. Dimitrijević

    2014-08-01

    Full Text Available The significance of Stark broadening data for problems in astrophysics, physics, as well as for technological plasmas is discussed and applications of Stark broadening parameters calculated using a semiclassical perturbation method are analyzed.

  4. SC tuning fork

    CERN Document Server

    The tuning fork used to modulate the radiofrequency system of the synchro cyclotron (SC) from 1957 to 1973. This piece is an unused spare part. The SC was the 1st accelerator built at CERN. It operated from August 1957 until it was closed down at the end of 1990. In the SC the magnetic field did not change with time, and the particles were accelerated in successive pulses by a radiofrequency voltage of some 20kV which varied in frequency as they spiraled outwards towards the extraction radius. The frequency varied from 30MHz to about 17Mz in each pulse. The tuning fork vibrated at 55MHz in vacuum in an enclosure which formed a variable capacitor in the tuning circuit of the RF system, allowing the RF to vary over the appropriate range to accelerate protons from the centre of the macine up to 600Mev at extraction radius. In operation the tips of the tuning fork blade had an amplitude of movement of over 1 cm. The SC accelerator underwent extensive improvements from 1973 to 1975, including the installation of a...

  5. Measurement for commercial exposives with SC-DSC test. Sangyoyo bakuhayaku no SC-DSC sokutei

    Energy Technology Data Exchange (ETDEWEB)

    Yabashi, H.; Wada, Y.; Hwang, D.; Akutsu, Y.; Tamura, M.; Yoshida, T. (The University of Tokyo, Tokyo (Japan). Faculty of Engineering); Matsuzawa, T. (Nippon Kayaku Co. Ltd., Tokyo (Japan))

    1991-08-30

    The sealed cell differential scanning calorimetry (SC-DSC) was sintroduced of commercial blasting explosives. As a series of testing the commercial blasting explosives in performance, an SC-DSC test was made to compare the critical detonability line with that resulting therefrom. From the result of SC-DSC measurement, the critical dilution rate was estimated of commercial blasting explosives to become without detonating propagation. As a result, all the explosives with exception of ANFO one were assumed to have a possibility of detonating propagation so that the ANFO explosive was known to be material, unable to exactly evaluate the detonability by the SC-DSC test. The explosion heat, then calculated by the REITP2 in order to assume how the reaction proceeded in the DSC cell, was compared with the reaction heat measured by the SC-DSC test. As a result, the calculated value was known to be almost equal to or slightly larger than the measured one. 15 refs., 4 figs., 2 tabs.

  6. Semiclassical Loop Quantum Gravity and Black Hole Thermodynamics

    Directory of Open Access Journals (Sweden)

    Arundhati Dasgupta

    2013-02-01

    Full Text Available In this article we explore the origin of black hole thermodynamics using semiclassical states in loop quantum gravity. We re-examine the case of entropy using a density matrix for a coherent state and describe correlations across the horizon due to SU(2 intertwiners. We further show that Hawking radiation is a consequence of a non-Hermitian term in the evolution operator, which is necessary for entropy production or depletion at the horizon. This non-unitary evolution is also rooted in formulations of irreversible physics.

  7. Numerical approaches to complex quantum, semiclassical and classical systems

    Energy Technology Data Exchange (ETDEWEB)

    Schubert, Gerald

    2008-11-03

    In this work we analyse the capabilities of several numerical techniques for the description of different physical systems. Thereby, the considered systems range from quantum over semiclassical to classical and from few- to many-particle systems. In chapter 1 we investigate the behaviour of a single quantum particle in the presence of an external disordered background (static potentials). Starting from the quantum percolation problem, we address the fundamental question of a disorder induced (Anderson-) transition from extended to localised single-particle eigenstates. Distinguishing isolating from conducting states by applying a local distribution approach for the local density of states (LDOS), we detect the quantum percolation threshold in two- and three-dimensions. Extending the quantum percolation model to a quantum random resistor model, we comment on the possible relevance of our results to the influence of disorder on the conductivity in graphene sheets. For the calculation of the LDOS as well as for the Chebyshev expansion of the time evolution operator, the kernel polynomial method (KPM) is the key numerical technique. In chapter 2 we examine how a single quantum particle is influenced by retarded bosonic fields that are inherent to the system. Within the Holstein model, these bosonic degrees of freedom (phonons) give rise to an infinite dimensional Hilbert space, posing a true many-particle problem. Constituting a minimal model for polaron formation, the Holstein model allows us to study the optical absorption and activated transport in polaronic systems. Using a two-dimensional variant of the KPM, we calculate for the first time quasi-exactly the optical absorption and dc-conductivity as a function of temperature. In chapter 3 we come back to the time evolution of a quantum particle in an external, static potential and investigate the capability of semiclassical approximations to it. We address basic quantum effects as tunneling, interference and

  8. Numerical approaches to complex quantum, semiclassical and classical systems

    International Nuclear Information System (INIS)

    Schubert, Gerald

    2008-01-01

    In this work we analyse the capabilities of several numerical techniques for the description of different physical systems. Thereby, the considered systems range from quantum over semiclassical to classical and from few- to many-particle systems. In chapter 1 we investigate the behaviour of a single quantum particle in the presence of an external disordered background (static potentials). Starting from the quantum percolation problem, we address the fundamental question of a disorder induced (Anderson-) transition from extended to localised single-particle eigenstates. Distinguishing isolating from conducting states by applying a local distribution approach for the local density of states (LDOS), we detect the quantum percolation threshold in two- and three-dimensions. Extending the quantum percolation model to a quantum random resistor model, we comment on the possible relevance of our results to the influence of disorder on the conductivity in graphene sheets. For the calculation of the LDOS as well as for the Chebyshev expansion of the time evolution operator, the kernel polynomial method (KPM) is the key numerical technique. In chapter 2 we examine how a single quantum particle is influenced by retarded bosonic fields that are inherent to the system. Within the Holstein model, these bosonic degrees of freedom (phonons) give rise to an infinite dimensional Hilbert space, posing a true many-particle problem. Constituting a minimal model for polaron formation, the Holstein model allows us to study the optical absorption and activated transport in polaronic systems. Using a two-dimensional variant of the KPM, we calculate for the first time quasi-exactly the optical absorption and dc-conductivity as a function of temperature. In chapter 3 we come back to the time evolution of a quantum particle in an external, static potential and investigate the capability of semiclassical approximations to it. We address basic quantum effects as tunneling, interference and

  9. Entropy localization and extensivity in the semiclassical black hole evaporation

    International Nuclear Information System (INIS)

    Casini, H.

    2009-01-01

    I aim to quantify the distribution of information in the Hawking radiation and inside the black hole in the semiclassical evaporation process. The structure of relativistic quantum field theory does not allow one to define a localized entropy unambiguously, but rather forces one to consider the shared information (mutual information) between two different regions of space-time. Using this tool, I first show that the entropy of a thermal gas at the Unruh temperature underestimates the actual amount of (shared) information present in a region of the Rindler space. Then, I analyze the mutual information between the black hole and the late time radiation region. A well-known property of the entropy implies that this is monotonically increasing with time. This means that in the semiclassical picture it is not possible to recover the eventual purity of the initial state in the final Hawking radiation through subtle correlations established during the whole evaporation period, no matter the interactions present in the theory. I find extensivity of the entropy as a consequence of a reduction to a two dimensional conformal problem in a simple approximation. However, the extensivity of information in the radiation region in a full four dimensional calculation seems not to be guaranteed on general grounds. I also analyze the localization of shared information inside the black hole finding that a large amount of it is contained in a small, approximately flat region of space-time near the point where the horizon begins. This gives place to large violations of the entropy bounds. I show that this problem is not eased by backscattering effects and argue that a breaking of conformal invariance is necessary to delocalize the entropy. Finally, I indicate that the mutual information could lead to a way to understand the Bekenstein-Hawking black hole entropy which does not require a drastic reduction in degrees of freedom in order to regulate the entanglement entropy. On the contrary

  10. A study of the relationship between the semi-classical and the generator coordinate methods

    International Nuclear Information System (INIS)

    Passos, E.J.V. de; Souza Cruz, F.F. de.

    Using a very simple type of wave-packet which is obtained by letting unitary displacement operators having as generators canonical operators Q and P in the many-body Hilbert space act on a reference state, the relatinship between the semi-classical and the generator coordinate methods is investigated. The semi-classical method is based on the time-dependent variational principle whereas in the generator coordinate method the wave-packets are taken as generator states. To establish the equivalence of the two-methods, the concept of redundancy of the wave-packet and the importance of the zero-point energy effects are examined in detail, using tools developed in previous works. A numerical application to the case of the Goldhaber-Teller mode in 4 He is made. (Author) [pt

  11. SAM revisited: uniform semiclassical approximation with absorption

    International Nuclear Information System (INIS)

    Hussein, M.S.; Pato, M.P.

    1986-01-01

    The uniform semiclassical approximation is modified to take into account strong absorption. The resulting theory, very similar to the one developed by Frahn and Gross is used to discuss heavy-ion elastic scattering at intermediate energies. The theory permits a reasonably unambiguos separation of refractive and diffractive effects. The systems 12 C+ 12 C and 12 C+ 16 O, which seem to exhibit a remnant of a nuclear rainbow at E=20 Mev/N, are analysed with theory which is built directly on a model for the S-matrix. Simple relations between the fit S-matrix and the underlying complex potential are derived. (Author) [pt

  12. Semiclassical methods in field theories

    International Nuclear Information System (INIS)

    Ventura, I.

    1978-10-01

    A new scheme is proposed for semi-classical quantization in field theory - the expansion about the charge (EAC) - which is developed within the canonical formalism. This method is suitable for quantizing theories that are invariant under global gauge transformations. It is used in the treatment of the non relativistic logarithmic theory that was proposed by Bialynicki-Birula and Mycielski - a theory we can formulate in any number of spatial dimensions. The non linear Schroedinger equation is also quantized by means of the EAC. The classical logarithmic theories - both, the non relativistic and the relativistic one - are studied in detail. It is shown that the Bohr-Sommerfeld quantization rule(BSQR) in field theory is, in many cases, equivalent to charge quantization. This rule is then applied to the massive Thirring Model and the logarithmic theories. The BSQR can be see as a simplified and non local version of the EAC [pt

  13. Semiclassical investigation of the revival phenomena in a one-dimensional system

    International Nuclear Information System (INIS)

    Wang Zhexian; Heller, Eric J

    2009-01-01

    In a quantum revival, a localized wave packet re-forms or 'revives' into a compact reincarnation of itself long after it has spread in an unruly fashion over a region restricted only by the potential energy. This is a purely quantum phenomenon, which has no classical analog. Quantum revival and Anderson localization are members of a small class of subtle interference effects resulting in a quantum distribution radically different from the classical after long time evolution under classically nonlinear evolution. However, it is not clear that semiclassical methods, which start with the classical density and add interference effects, are in fact capable of capturing the revival phenomenon. Here we investigate two different one-dimensional systems, the infinite square well and Morse potential. In both the cases, after a long time the underlying classical manifolds are spread rather uniformly over phase space and are correspondingly spread in coordinate space, yet the semiclassical amplitudes are able to destructively interfere over most of coordinate space and constructively interfere in a small region, correctly reproducing a quantum revival. Further implications of this ability are discussed

  14. Semiclassical investigation of the revival phenomena in a one-dimensional system

    Energy Technology Data Exchange (ETDEWEB)

    Wang Zhexian [Hefei National Laboratory for Physical Sciences at Microscale and Department of Physics, University of Science and Technology of China, Hefei, Anhui 230026 (China); Heller, Eric J [Department of Physics and Department of Chemistry and Chemical Biology, Harvard University, Cambridge, MA 02138 (United States)

    2009-07-17

    In a quantum revival, a localized wave packet re-forms or 'revives' into a compact reincarnation of itself long after it has spread in an unruly fashion over a region restricted only by the potential energy. This is a purely quantum phenomenon, which has no classical analog. Quantum revival and Anderson localization are members of a small class of subtle interference effects resulting in a quantum distribution radically different from the classical after long time evolution under classically nonlinear evolution. However, it is not clear that semiclassical methods, which start with the classical density and add interference effects, are in fact capable of capturing the revival phenomenon. Here we investigate two different one-dimensional systems, the infinite square well and Morse potential. In both the cases, after a long time the underlying classical manifolds are spread rather uniformly over phase space and are correspondingly spread in coordinate space, yet the semiclassical amplitudes are able to destructively interfere over most of coordinate space and constructively interfere in a small region, correctly reproducing a quantum revival. Further implications of this ability are discussed.

  15. Semiclassical investigation of the revival phenomena in a one-dimensional system

    Science.gov (United States)

    Wang, Zhe-xian; Heller, Eric J.

    2009-07-01

    In a quantum revival, a localized wave packet re-forms or 'revives' into a compact reincarnation of itself long after it has spread in an unruly fashion over a region restricted only by the potential energy. This is a purely quantum phenomenon, which has no classical analog. Quantum revival and Anderson localization are members of a small class of subtle interference effects resulting in a quantum distribution radically different from the classical after long time evolution under classically nonlinear evolution. However, it is not clear that semiclassical methods, which start with the classical density and add interference effects, are in fact capable of capturing the revival phenomenon. Here we investigate two different one-dimensional systems, the infinite square well and Morse potential. In both the cases, after a long time the underlying classical manifolds are spread rather uniformly over phase space and are correspondingly spread in coordinate space, yet the semiclassical amplitudes are able to destructively interfere over most of coordinate space and constructively interfere in a small region, correctly reproducing a quantum revival. Further implications of this ability are discussed.

  16. α-ScVSe2O8, β-ScVSe2O8, and ScVTe2O8: new quaternary mixed metal oxides composed of only second-order Jahn-Teller distortive cations.

    Science.gov (United States)

    Kim, Yeong Hun; Lee, Dong Woo; Ok, Kang Min

    2013-10-07

    Three new quaternary scandium vanadium selenium/tellurium oxides, α-ScVSe2O8, β-ScVSe2O8, and ScVTe2O8 have been synthesized through hydrothermal and standard solid-state reactions. Although all three reported materials are stoichiometrically similar, they exhibit different crystal structures: α-ScVSe2O8 has a three-dimensional framework structure consisting of ScO6, VO6, and SeO3 groups. β-ScVSe2O8 reveals another three-dimensional framework composed of ScO7, VO5, and SeO3 polyhedra. ScVTe2O8 shows a layered structure with ScO6, VO4, and TeO4 polyhedra. Interestingly, the constituent cations, that is, Sc(3+), V(5+), Se(4+), and Te(4+) are all in a distorted coordination environment attributable to second-order Jahn-Teller (SOJT) effects. Complete characterizations including infrared spectroscopy, elemental analyses, thermal analyses, dipole moment calculation, and the magnitudes of out-of-center distortions for the compounds are reported. Transformation reactions suggest that α-ScVSe2O8 may change to β-ScVSe2O8, and then to Sc2(SeO3)3·H2O under hydrothermal conditions.

  17. Semiclassical and quantum motions on the non-commutative plane

    Energy Technology Data Exchange (ETDEWEB)

    Baldiotti, M.C., E-mail: baldiott@fma.if.usp.b [Instituto de Fisica, Universidade de Sao Paulo, Caixa Postal 66318-CEP, 05315-970 Sao Paulo, S.P. (Brazil); Gazeau, J.P., E-mail: gazeau@apc.univ-paris7.f [Instituto de Fisica, Universidade de Sao Paulo, Caixa Postal 66318-CEP, 05315-970 Sao Paulo, S.P. (Brazil); Gitman, D.M., E-mail: gitman@dfn.if.usp.b [Instituto de Fisica, Universidade de Sao Paulo, Caixa Postal 66318-CEP, 05315-970 Sao Paulo, S.P. (Brazil)

    2009-10-19

    We study the canonical and the coherent state quantizations of a particle moving in a magnetic field on the non-commutative plane. Using a theta-modified action, we perform the canonical quantization and analyze the gauge dependence of the theory. We compare coherent states quantizations obtained through Malkin-Man'ko states and circular squeezed states. The relation between these states and the 'classical' trajectories is investigated, and we present numerical explorations of some semiclassical quantities.

  18. Semiclassical magnetotransport in strongly spin-orbit coupled Rashba two-dimensional electron systems

    Science.gov (United States)

    Xiao, Cong; Li, Dingping

    2016-06-01

    Semiclassical magnetoelectric and magnetothermoelectric transport in strongly spin-orbit coupled Rashba two-dimensional electron systems is investigated. In the presence of a perpendicular classically weak magnetic field and short-range impurity scattering, we solve the linearized Boltzmann equation self-consistently. Using the solution, it is found that when Fermi energy E F locates below the band crossing point (BCP), the Hall coefficient is a nonmonotonic function of electron density n e and not inversely proportional to n e. While the magnetoresistance (MR) and Nernst coefficient vanish when E F locates above the BCP, non-zero MR and enhanced Nernst coefficient emerge when E F decreases below the BCP. Both of them are nonmonotonic functions of E F below the BCP. The different semiclassical magnetotransport behaviors between the two sides of the BCP can be helpful to experimental identifications of the band valley regime and topological change of Fermi surface in considered systems.

  19. Semiclassical magnetotransport in strongly spin–orbit coupled Rashba two-dimensional electron systems

    International Nuclear Information System (INIS)

    Xiao, Cong; Li, Dingping

    2016-01-01

    Semiclassical magnetoelectric and magnetothermoelectric transport in strongly spin–orbit coupled Rashba two-dimensional electron systems is investigated. In the presence of a perpendicular classically weak magnetic field and short-range impurity scattering, we solve the linearized Boltzmann equation self-consistently. Using the solution, it is found that when Fermi energy E F locates below the band crossing point (BCP), the Hall coefficient is a nonmonotonic function of electron density n e and not inversely proportional to n e . While the magnetoresistance (MR) and Nernst coefficient vanish when E F locates above the BCP, non-zero MR and enhanced Nernst coefficient emerge when E F decreases below the BCP. Both of them are nonmonotonic functions of E F below the BCP. The different semiclassical magnetotransport behaviors between the two sides of the BCP can be helpful to experimental identifications of the band valley regime and topological change of Fermi surface in considered systems. (paper)

  20. Semiclassical model for single-particle transitions in nucleus-nucleus interactions

    International Nuclear Information System (INIS)

    Milek, B.; Joint Inst. for Nuclear Research, Dubna; Technische Univ., Dresden; Reif, R.; Pham Khan Van; Revai, J.

    1990-04-01

    A previously elaborated semiclassical one-body model for the dynamics of a single particle, moving in two potentials, in heavy-ion reactions or in fissioning systems has been extended with respect to the inclusion of angular momenta and more realistic separable potentials. The collective relative motion is assumed to proceed along a trajectory which is calculated from classical equations of motion including conservative and phenomenological friction forces. The formalism has been derived involving three-dimensional trajectories for symmetric as well as for asymmetric nucleus-nucleus systems. The model allows for the calculation of correct quantum mechanical transition amplitudes to final bound and continuum states. It has been applied for the investigation of the excitation of a neutron during a fission process, covering also non-statistical differential emission probabilities. From the numerical calculations, using parameters adapted to 252 Cf(sf), one can conclude that in the underlying model without 'sudden' processes the energy spectrum consists of two parts. The low lying component is created in the neck region while a high lying part seems to be governed mainly by the dynamics of the underlying collective motion rather than by the specific initial conditions. (orig.)

  1. The comparative roles of connected and disconnected trajectories in the evaluation of the semiclassical coherent-state propagator

    International Nuclear Information System (INIS)

    Rubin, A.; Klauder, J.R.

    1995-01-01

    The semiclassical approximation of the coherent-state propagator developed by Klauder and subsequently modified by Adachi is applied to the quartic oscillator. This approximation involves classical trajectories which must satisfy complex boundary conditions. It is found that these complex classical trajectories fall into two broad categories basically characterized by the descriptive titles ''continuously connected'' and ''disconnected'' given to the two different types. The continuously connected type is found to always contribute in the evaluation of the semiclassical propagator while the disconnected type will only contribute under specific conditions. copyright 1995 Academic Press, Inc

  2. Conductivity ageing studies on 1M10ScSZ (M4+=Ce, Hf)

    DEFF Research Database (Denmark)

    Omar, Shobit; Bin Najib, Waqas; Bonanos, Nikolaos

    2011-01-01

    The long-term conductivity stability is tested on zirconia based electrolyte materials for solid oxide fuel cell applications. The ageing studies have been performed on the samples of ZrO2 co-doped with 10mol% of Sc2O3 and 1mol% MO2, where M = Ce or Hf (denoted respectively 1Ce10ScSZ and 1Hf10Sc......SZ) in oxidising and reducing atmospheres, at 600°C for 3000h. At 600°C, these compositions show initial conductivity of around 9–12mS∙cm−1 in air. After 3000h of ageing, no phase transitions are observed in any of the samples. For the first 1000h, the degradation rate is higher than in the subsequent 2000h......; thereafter, conductivity degrades linearly with time for all samples. In air, the loss in the conductivity is lower than in reducing conditions. The 1Ce10ScSZ shows the highest degradation rate of 3.8%/1000h in wet H2/N2 after the first 1000h of ageing. A colour change of the 1Ce10ScSZ sample from white...

  3. Semiclassical model of deuteron dissociation in the Coulomb-Nuclear field

    International Nuclear Information System (INIS)

    Aleshin, V.P.; Sidorenko, B.I.

    1995-01-01

    We consider the survival probability of a deuteron which moves in the field of a heavy nucleus. This quantity was calculated within a semiclassical approach to the intrinsic motion within a deuteron and in the framework of an approach which makes use of the imaginary part of the phenomenological deuteron optical potential. A close agreement is obtained between these approaches in a broad range of deuteron energies and orbital momenta

  4. A uniform semi-classical approach to the Coulomb fission problem

    International Nuclear Information System (INIS)

    Levit, S.; Smilansky, U.

    1978-01-01

    A semi-classical theory based on the path integral formalism is applied to the description of Coulomb fission. Complex classical trajectories are used to compute the classically forbidden transitions from the target's ground state to fission. In a simple model the energy spectrum and angular distributions of the fragments are calculated for the Coulomb fission in the Xe + U collision. Theoretical predictions are made which may be checked experimentally. (author)

  5. Some applications of semiclassical methods to quantum chaos; Quelques applications des methodes semiclassiques en chaos quantique

    Energy Technology Data Exchange (ETDEWEB)

    Mouchet, A

    1996-11-29

    This thesis is made of four chapters. The first chapter is devoted to the description of the band structure, using the semiclassical periodic orbit theory, for a one electron system in a two-dimensional crystal with a high magnetic field perpendicular to the crystal plane. Complex orbits turn out to be fundamental for a proper description of the band structure since they incorporate conduction processes through tunneling mechanisms. In the second part, the author focuses on the role played in semiclassical expansions by complex orbits. They give exponentially small contribution when h is small only in a precise situation. In all other cases, complex orbits give birth to corrections in powers in h but unlike the extreme case they are hidden in the shadow of usual Gutzwiller contributions of real orbits. In the third chapter, a semiclassical expansion of the Berry two-form in terms of finite number of periodic orbits for a discrete chaotic map defined on a compact phase space and governed by external parameters is given. Besides, when dealing with a toroidal geometry, the author gives a similar expansion for the Chern index of any Bloch band of the quasi-energy spectrum and is thus led to a semiclassical interpretation of the Hall effect. In the last chapter, the author sets out a mechanism to explain how symmetries can create Berry phase shifts higher than 2{pi} in a 3D-adiabatic transport. He shows how one can understand in a topological point of view why these shifts are necessarily integer multiple of 2{pi}. An explicit construction of such arbitrary large phase shifts is finally proposed. (N.T.).

  6. Nonadiabatic dynamics in the semiclassical Liouville representation: Locality, transformation theory, and the energy budget

    Energy Technology Data Exchange (ETDEWEB)

    Martens, Craig C., E-mail: cmartens@uci.edu

    2016-12-20

    In this paper, we revisit the semiclassical Liouville approach to describing molecular dynamics with electronic transitions using classical trajectories. Key features of the formalism are highlighted. The locality in phase space and presence of nonclassical terms in the generalized Liouville equations are emphasized and discussed in light of trajectory surface hopping methodology. The representation dependence of the coupled semiclassical Liouville equations in the diabatic and adiabatic bases are discussed and new results for the transformation theory of the Wigner functions representing the corresponding density matrix elements given. We show that the diagonal energies of the state populations are not conserved during electronic transitions, as energy is stored in the electronic coherence. We discuss the implications of this observation for the validity of imposing strict energy conservation in trajectory based methods for simulating nonadiabatic processes.

  7. Horizons of semiclassical black holes are cold

    Energy Technology Data Exchange (ETDEWEB)

    Brustein, Ram [Department of Physics, Ben-Gurion University,Beer-Sheva 84105 (Israel); CAS, Ludwig-Maximilians-Universität München,80333 München (Germany); Medved, A.J.M. [Department of Physics & Electronics, Rhodes University,Grahamstown 6140 (South Africa)

    2014-06-10

    We calculate, using our recently proposed semiclassical framework, the quantum state of the Hawking pairs that are produced during the evaporation of a black hole (BH). Our framework adheres to the standard rules of quantum mechanics and incorporates the quantum fluctuations of the collapsing shell spacetime in Hawking’s original calculation, while accounting for back-reaction effects. We argue that the negative-energy Hawking modes need to be regularly integrated out; and so these are effectively subsumed by the BH and, as a result, the number of coherent negative-energy modes N{sub coh} at any given time is parametrically smaller than the total number of the Hawking particles N{sub total} emitted during the lifetime of the BH. We find that N{sub coh} is determined by the width of the BH wavefunction and scales as the square root of the BH entropy. We also find that the coherent negative-energy modes are strongly entangled with their positive-energy partners. Previously, we have found that N{sub coh} is also the number of coherent outgoing particles and that information can be continually transferred to the outgoing radiation at a rate set by N{sub coh}. Our current results show that, while the BH is semiclassical, information can be released without jeopardizing the nearly maximal inside-out entanglement and imply that the state of matter near the horizon is approximately the vacuum. The BH firewall proposal, on the other hand, is that the state of matter near the horizon deviates substantially from the vacuum, starting at the Page time. We find that, under the usual assumptions for justifying the formation of a firewall, one does indeed form at the Page time. However, the possible loophole lies in the implicit assumption that the number of strongly entangled pairs can be of the same order of N{sub total}.

  8. Classical and semiclassical aspects of chemical dynamics

    International Nuclear Information System (INIS)

    Gray, S.K.

    1982-08-01

    Tunneling in the unimolecular reactions H 2 C 2 → HC 2 H, HNC → HCN, and H 2 CO → H 2 + CO is studied with a classical Hamiltonian that allows the reaction coordinate and transverse vibrational modes to be considered directly. A combination of classical perturbation theory and the semiclassical WKB method allows tunneling probabilities to be obtained, and a statistical theory (RRKM) is used to construct rate constants for these reactions in the tunneling regime. In this fashion, it is found that tunneling may be important, particularly for low excitation energies. Nonadiabatic charge transfer in the reaction Na + I → Na + + I - is treated with classical trajectories based on a classical Hamiltonian that is the analogue of a quantum matrix representation. The charge transfer cross section obtained is found to agree reasonably well with the exact quantum results. An approximate semiclassical formula, valid at high energies, is also obtained. The interaction of radiation and matter is treated from a classical viewpoint. The excitation of an HF molecule in a strong laser is described with classical trajectories. Quantum mechanical results are also obtained and compared to the classical results. Although the detailed structure of the pulse time averaged energy absorption cannot be reproduced classically, classical mechanics does predict the correct magnitude of energy absorption, as well as certain other qualitative features. The classical behavior of a nonrotating diatomic molecule in a strong laser field is considered further, by generating a period advance map that allows the solution over many periods of oscillation of the laser to be obtained with relative ease. Classical states are found to form beautiful spirals in phase space as time progresses. A simple pendulum model is found to describe the major qualitative features

  9. A semi-classical treatment of dissipative processes based on Feynman's influence functional method

    International Nuclear Information System (INIS)

    Moehring, K.; Smilansky, U.

    1980-01-01

    We develop a semi-classical treatment of dissipative processes based on Feynman's influence functional method. Applying it to deep inelastic collisions of heavy ions we study inclusive transition probabilities corresponding to a situation when only a set of collective variables is specified in the initial and final states. We show that the inclusive probabilities as well as the final energy distributions can be expressed in terms of properly defined classical paths and their corresponding stability fields. We present a uniform approximation for the study of quantal interference and focussing phenomena and discuss the conditions under which they are to be expected. For the dissipation mechanism we study three approximations - the harmonic model for the internal system, the weak coupling (diabatic) and the adiabatic coupling. We show that these three limits can be treated in the same manner. We finally compare the present formalism with other methodes as were introduced for the description of dissipation in deep inelastic collisions. (orig.)

  10. Semiclassical relations and IR effects in de Sitter and slow-roll space-times

    Energy Technology Data Exchange (ETDEWEB)

    Giddings, Steven B. [Department of Physics, University of California, Santa Barbara, CA 93106 (United States); Sloth, Martin S., E-mail: giddings@physics.ucsb.edu, E-mail: sloth@cern.ch [CERN, Physics Department, Theory Unit, CH-1211 Geneva 23 (Switzerland)

    2011-01-01

    We calculate IR divergent graviton one-loop corrections to scalar correlators in de Sitter space, and show that the leading IR contribution may be reproduced via simple semiclassical consistency relations. One can likewise use such semiclassical relations to calculate leading IR corrections to correlators in slow-roll inflation. The regulated corrections shift the tensor/scalar ratio and consistency relation of single field inflation, and non-gaussianity parameters averaged over very large distances. For inflation of sufficient duration, for example arising from a chaotic inflationary scenario, these corrections become of order unity. First-order corrections of this size indicate a breakdown of the perturbative expansion, and suggest the need for a non-perturbative description of the corresponding regime. This is analogous to a situation argued to arise in black hole evolution, and to interfere with a sharp perturbative calculation of ''missing information'' in Hawking radiation.

  11. Semiclassical relations and IR effects in de Sitter and slow-roll space-times

    International Nuclear Information System (INIS)

    Giddings, Steven B.; Sloth, Martin S.

    2011-01-01

    We calculate IR divergent graviton one-loop corrections to scalar correlators in de Sitter space, and show that the leading IR contribution may be reproduced via simple semiclassical consistency relations. One can likewise use such semiclassical relations to calculate leading IR corrections to correlators in slow-roll inflation. The regulated corrections shift the tensor/scalar ratio and consistency relation of single field inflation, and non-gaussianity parameters averaged over very large distances. For inflation of sufficient duration, for example arising from a chaotic inflationary scenario, these corrections become of order unity. First-order corrections of this size indicate a breakdown of the perturbative expansion, and suggest the need for a non-perturbative description of the corresponding regime. This is analogous to a situation argued to arise in black hole evolution, and to interfere with a sharp perturbative calculation of ''missing information'' in Hawking radiation

  12. Two anionically derivatized scandium oxoselenates(IV): ScF[SeO3] and Sc2O2[SeO3

    Science.gov (United States)

    Greiner, Stefan; Chou, Sheng-Chun; Schleid, Thomas

    2017-02-01

    Scandium fluoride oxoselenate(IV) ScF[SeO3] and scandium oxide oxoselenate(IV) Sc2O2[SeO3] could be synthesized through solid-state reactions. ScF[SeO3] was obtained phase-pure, by reacting mixtures of Sc2O3, ScF3 and SeO2 (molar ratio: 1:1:3) together with CsBr as fluxing agent in corundum crucibles embedded into evacuated glassy silica ampoules after firing at 700 °C for seven days. Sc2O2[SeO3] first emerged as by-product during the attempts to synthesize ScCl[SeO3] following aforementioned synthesis route and could later be reproduced from appropriate Sc2O3/SeO3 mixtures. ScF[SeO3] crystallizes monoclinically in space group P21/m with a=406.43(2), b =661.09(4), c=632.35(4) pm, β=93.298(3)° and Z=2. Sc2O2[SeO3] also crystallizes in the monoclinic system, but in space group P21/n with a=786.02(6), b=527.98(4), c=1086.11(8) pm, β=108.672(3)° for Z=4. The crystal structures of both compounds are strongly influenced by the stereochemically active lone pairs of the ψ1-tetrahedral [SeO3]2- anions. They also show partial structures, where the derivatizing F- or O2- anions play an important role. For ScF[SeO3] chains of the composition 2+∞ 1[FS c 2 / 2 ] form from connected [FSc2]5+ dumbbells, while [OSc3]7+ pyramids and [OSc4]10+ tetrahedra units are condensed to layers according to 2+ ∞ 2[O2Sc2 ] in Sc2O2[SeO3].

  13. A derivation of the Derbenev-Kondratenko formula using semi-classical electrodynamics

    International Nuclear Information System (INIS)

    Mane, S.R.

    1985-11-01

    We present a detailed exposition of the mechanism for the build-up of polarization in electron storage rings. A semi-classical approach is used to derive the rate of growth and asymptotic degree of polarization in an electron storage ring (the Derbenev-Kondratenko formula). Statistical mechanical concepts used to obtain as classical an understanding as possible of this phenomenon. (orig.)

  14. Classical properties and semiclassical calculations in a spherical nuclear average potential

    International Nuclear Information System (INIS)

    Carbonell, J.; Brut, F.; Arvieu, R.; Touchard, J.

    1984-03-01

    We study the relation between the classical properties or an average nuclear potential and its spectral properties. We have drawn the energy-action surface of this potential and related its properties to the spectral ones in the framework of the EBK semiclassical method. We also describe a method allowing us to get the evolution of the spectrum with the mass number

  15. Semiclassical electronic transport in MnAs thin films

    International Nuclear Information System (INIS)

    Helman, C.; Milano, J.; Steren, L.; Llois, A.M.

    2008-01-01

    Magneto-transport experiments have been recently performed on MnAs thin films. Hall effect and transverse magnetoresistance measurements have shown interesting and, until now, unknown results. For instance, the transverse magnetoresistance shows no saturation in the presence of very high magnetic fields. In order to understand the contribution of the electronic band structure to the non-saturating magnetoresistance, we perform ab initio calculations, using the Wien2K code and analyze the magneto-transport properties within the semiclassical approximation. We show that non-saturation may be due to the presence of open orbits on the majority Fermi surface

  16. Semiclassical electronic transport in MnAs thin films

    Energy Technology Data Exchange (ETDEWEB)

    Helman, C. [Dpto de Fisica, ' Juan Jose Giambiagi' , Facultad de Ciencias Exactas y Naturales, Universidad de Buenos Aires, Buenos Aires (Argentina); Unidad de Actividad Fisica, Centro Atomico Constituyentes, Comision Nacional de Energia Atomica, Buenos Aires (Argentina)], E-mail: helman@tandar.cnea.gov.ar; Milano, J.; Steren, L. [Departamento de Fisica, Centro Atomico Bariloche, Comision Nacional de Energia Atomica, S.C. Bariloche (Argentina); Llois, A.M. [Dpto de Fisica, ' Juan Jose Giambiagi' , Facultad de Ciencias Exactas y Naturales, Universidad de Buenos Aires, Buenos Aires (Argentina); Unidad de Actividad Fisica, Centro Atomico Constituyentes, Comision Nacional de Energia Atomica, Buenos Aires (Argentina)

    2008-07-15

    Magneto-transport experiments have been recently performed on MnAs thin films. Hall effect and transverse magnetoresistance measurements have shown interesting and, until now, unknown results. For instance, the transverse magnetoresistance shows no saturation in the presence of very high magnetic fields. In order to understand the contribution of the electronic band structure to the non-saturating magnetoresistance, we perform ab initio calculations, using the Wien2K code and analyze the magneto-transport properties within the semiclassical approximation. We show that non-saturation may be due to the presence of open orbits on the majority Fermi surface.

  17. Compensation of native donor doping in ScN: Carrier concentration control and p-type ScN

    Science.gov (United States)

    Saha, Bivas; Garbrecht, Magnus; Perez-Taborda, Jaime A.; Fawey, Mohammed H.; Koh, Yee Rui; Shakouri, Ali; Martin-Gonzalez, Marisol; Hultman, Lars; Sands, Timothy D.

    2017-06-01

    Scandium nitride (ScN) is an emerging indirect bandgap rocksalt semiconductor that has attracted significant attention in recent years for its potential applications in thermoelectric energy conversion devices, as a semiconducting component in epitaxial metal/semiconductor superlattices and as a substrate material for high quality GaN growth. Due to the presence of oxygen impurities and native defects such as nitrogen vacancies, sputter-deposited ScN thin-films are highly degenerate n-type semiconductors with carrier concentrations in the (1-6) × 1020 cm-3 range. In this letter, we show that magnesium nitride (MgxNy) acts as an efficient hole dopant in ScN and reduces the n-type carrier concentration, turning ScN into a p-type semiconductor at high doping levels. Employing a combination of high-resolution X-ray diffraction, transmission electron microscopy, and room temperature optical and temperature dependent electrical measurements, we demonstrate that p-type Sc1-xMgxN thin-film alloys (a) are substitutional solid solutions without MgxNy precipitation, phase segregation, or secondary phase formation within the studied compositional region, (b) exhibit a maximum hole-concentration of 2.2 × 1020 cm-3 and a hole mobility of 21 cm2/Vs, (c) do not show any defect states inside the direct gap of ScN, thus retaining their basic electronic structure, and (d) exhibit alloy scattering dominating hole conduction at high temperatures. These results demonstrate MgxNy doped p-type ScN and compare well with our previous reports on p-type ScN with manganese nitride (MnxNy) doping.

  18. Investigation of Sc(3) state in nonaqueous solutions by the 45Sc NMR method of high permission

    International Nuclear Information System (INIS)

    Buslaev, Yu.A.; Kirakosyan, G.A.; Tarasov, V.P.

    1980-01-01

    The ScCl 3 + CH 3 CN and ScCl 3 + KNCS + CH 3 CN solutions have been studied by a high-resolution NMR 45 Sc method. It has been estimated that in acetonitrile solutions, with competing ligands of Cl - and NCS - being available, hexacoordination Sc(3) complexes of various compositions are formed, and solvent molecules also take part in formation of the coordination sphere of scandium. Chemical shifts in NMR 45 Sc signals depend linearly on the number of chlor- or NCS - ions bound to scandium(3). This made it possible to determine the value of chemical shifts in signals of all 28 potential complexes formed in a system with three competing ligands

  19. Semiclassical model of atomic collisions: stopping and capture of the heavy charged particles and exotic atom formation

    International Nuclear Information System (INIS)

    Beck, W.A.

    2000-01-01

    The semiclassical model of atomic collisions, especially in different areas of the maximum stopping, when proton collides at the velocity of the boron order velocity, providing as the result for interactions of many bodies with an electron target, enabling application of the model with high degree of confidence to a clearly expressed experimental problem, such the antiproton capture on helium, is presented. The semiclassical collision model and stopping energy are considered. The stopping and capture of negatively-charged particles are investigated. The capture and angular moments of antiprotons, captures at the end of the collision cascade, are presented [ru

  20. Semiclassical eigenenergies in the wake of fast ions in solids

    International Nuclear Information System (INIS)

    Mueller, J.; Burgdoerfer, J.; Noid, D.W.

    1990-01-01

    We compare the semiclassical and quantum mechanical eigenenergies of an electron in the wake of a fast, highly charged ion traversing a solid. The classical dynamics of this system shows a transition from regular to chaotic motion as a function of the binding energy. The transition can also be seen in the quantal spectra. We find evidence for a connection between bifurcation of tori and disorder in the energy level sequences. 21 refs., 4 figs

  1. Development of standardized radioactive 46Sc solution

    International Nuclear Information System (INIS)

    Du Hongshan; Jia Zhang; Yu Yiguang; Sun Naiyao

    1988-01-01

    A method of preparation of standardized radioactive 46 Sc solution is developed. The separation of 46 Sc, the composition of 46 Sc solution and its stability, and radioactivity measurement of 46 Sc are systematically studied. The results obtained in the study and in the applications in many laboratories have shown that our method is effective and reliable

  2. Numerical solutions of the semiclassical Boltzmann ellipsoidal-statistical kinetic model equation

    Science.gov (United States)

    Yang, Jaw-Yen; Yan, Chin-Yuan; Huang, Juan-Chen; Li, Zhihui

    2014-01-01

    Computations of rarefied gas dynamical flows governed by the semiclassical Boltzmann ellipsoidal-statistical (ES) kinetic model equation using an accurate numerical method are presented. The semiclassical ES model was derived through the maximum entropy principle and conserves not only the mass, momentum and energy, but also contains additional higher order moments that differ from the standard quantum distributions. A different decoding procedure to obtain the necessary parameters for determining the ES distribution is also devised. The numerical method in phase space combines the discrete-ordinate method in momentum space and the high-resolution shock capturing method in physical space. Numerical solutions of two-dimensional Riemann problems for two configurations covering various degrees of rarefaction are presented and various contours of the quantities unique to this new model are illustrated. When the relaxation time becomes very small, the main flow features a display similar to that of ideal quantum gas dynamics, and the present solutions are found to be consistent with existing calculations for classical gas. The effect of a parameter that permits an adjustable Prandtl number in the flow is also studied. PMID:25104904

  3. Knowledge insufficient: the management of haemoglobin SC disease.

    Science.gov (United States)

    Pecker, Lydia H; Schaefer, Beverly A; Luchtman-Jones, Lori

    2017-02-01

    Although haemoglobin SC (HbSC) accounts for 30% of sickle cell disease (SCD) in the United States and United Kingdom, evidence-based guidelines for genotype specific management are lacking. The unique pathology of HbSC disease is complex, characterized by erythrocyte dehydration, intracellular sickling and increased blood viscosity. The evaluation and treatment of patients with HbSC is largely inferred from studies of SCD consisting mostly of haemoglobin SS (HbSS) patients. These studies are underpowered to allow definitive conclusions about HbSC. We review the pathophysiology of HbSC disease, including known and potential differences between HbSS and HbSC, and highlight knowledge gaps in HbSC disease management. Clinical and translational research is needed to develop targeted treatments and to validate management recommendations for efficacy, safety and impact on quality of life for people with HbSC. © 2016 John Wiley & Sons Ltd.

  4. Fermilab's SC Accelerator Magnet Program for Future U.S. HEP Facilities

    International Nuclear Information System (INIS)

    Lamm, Michael; Zlobin, Alexander

    2010-01-01

    The invention of SC accelerator magnets in the 1970s opened wide the possibilities for advancing the energy frontier of particle accelerators, while limiting the machine circumference and reducing their energy consumption. The successful development of SC accelerator magnets based on NbTi superconductor have made possible a proton-antiproton collider (Tevatron) at Fermilab, an electron-proton collider (HERA) at DESY, a relativistic heavy ion collider (RHIC) at BNL and recently a proton-proton collider (LHC) at CERN. Further technological innovations and inventions are required as the US HEP looks forward towards the post-LHC energy or/and intensity frontiers. A strong, goal oriented national SC accelerator magnet program must take on this challenge to provide a strong base for the future of HEP in the U.S. The results and experience obtained by Fermilab during the past 30 years will allow us to play a leadership role in the SC accelerator magnet development in the U.S., in particular, focusing on magnets for a Muon Collider/Neutrino Factory (1)-(2). In this paper, we summarize the required Muon Collider magnet needs and challenges, summarize the technology advances in the Fermilab accelerator magnet development over the past few years, and present and discuss our vision and long-term plans for these Fermilab-supported accelerator initiatives.

  5. Instanton calculus without equations of motion: semiclassics from monodromies of a Riemann surface

    Science.gov (United States)

    Gulden, Tobias; Janas, Michael; Kamenev, Alex

    2015-02-01

    Instanton calculations in semiclassical quantum mechanics rely on integration along trajectories which solve classical equations of motion. However in systems with higher dimensionality or complexified phase space these are rarely attainable. A prime example are spin-coherent states which are used e.g. to describe single molecule magnets (SMM). We use this example to develop instanton calculus which does not rely on explicit solutions of the classical equations of motion. Energy conservation restricts the complex phase space to a Riemann surface of complex dimension one, allowing to deform integration paths according to Cauchy’s integral theorem. As a result, the semiclassical actions can be evaluated without knowing actual classical paths. Furthermore we show that in many cases such actions may be solely derived from monodromy properties of the corresponding Riemann surface and residue values at its singular points. As an example, we consider quenching of tunneling processes in SMM by an applied magnetic field.

  6. Applications of the semiclassical spectral method to nuclear, atomic, molecular, and polymeric dynamics

    International Nuclear Information System (INIS)

    Koszykowski, M.L.; Pfeffer, G.A.; Noid, D.W.

    1987-01-01

    Nonlinear dynamics plays a dominant role in a variety of important problems in chemical physics. Examples are unimolecular reactions, infrared multiphoton decomposition of molecules, the pumping process of the gamma ray laser, dissociation of vibrationally excited state-selected van der Waals's complexes, and many other chemical and atomic processes. The present article discusses recent theoretical studies on the quasi-periodic and chaotic dynamic aspects of vibrational-rotational states of atomic, nuclear, and molecular systems using the semiclassical spectral method (SSM). The authors note that the coordinates, momenta, and so on, are found using classical mechanics in the studies included in this review. They outline the semiclassical spectral method and a wide variety of applications. Although this technique was first developed ten years ago, it has proved to be tremendously successful as a tool used in dynamics problems. Applications include problems in nonlinear dynamics, molecular and atomic spectra, surface science, astronomy and stellar dynamics, nuclear physics, and polymer physics

  7. Hyperspherical time-dependent method with semiclassical outgoing waves for double photoionization of helium

    International Nuclear Information System (INIS)

    Kazansky, A.K.; Selles, P.; Malegat, L.

    2003-01-01

    The hyperspherical time-dependent method with semiclassical outgoing waves for study of double photoionization of helium is presented. It is closely related to the hyperspherical R-matrix method with semiclassical outgoing waves [Phys. Rev. A 65, 032711 (2002)]: both split configuration space into two regions to solve the stationary inhomogeneous Schroedinger equation associated with the one-photon ionization problem, and both apply the same treatment to the outer region. However, the two methods differ radically in their treatments of the problem in the inner region: the most recent one applies a time-dependent approach for calculating the stationary wave function, while the previous one uses a R-matrix treatment. The excellent agreement observed between the triple differential cross sections obtained from these two basically different methods provides very strong support for both of them. Importantly, the very different numerical structures of both methods might make the most recent one a better candidate for investigating the near-threshold region

  8. SC-FDMA for mobile communications

    CERN Document Server

    Abd El-Samie, Fathi E

    2013-01-01

    SC-FDMA for Mobile Communications examines Single-Carrier Frequency Division Multiple Access (SC-FDMA). Explaining this rapidly evolving system for mobile communications, it describes its advantages and limitations and outlines possible solutions for addressing its current limitations. The book explores the emerging trend of cooperative communication with SC-FDMA and how it can improve the physical layer security. It considers the design of distributed coding schemes and protocols for wireless relay networks where users cooperate to send their data to the destination. Supplying you with the re

  9. Combinatorial theory of the semiclassical evaluation of transport moments II: Algorithmic approach for moment generating functions

    Energy Technology Data Exchange (ETDEWEB)

    Berkolaiko, G. [Department of Mathematics, Texas A and M University, College Station, Texas 77843-3368 (United States); Kuipers, J. [Institut für Theoretische Physik, Universität Regensburg, D-93040 Regensburg (Germany)

    2013-12-15

    Electronic transport through chaotic quantum dots exhibits universal behaviour which can be understood through the semiclassical approximation. Within the approximation, calculation of transport moments reduces to codifying classical correlations between scattering trajectories. These can be represented as ribbon graphs and we develop an algorithmic combinatorial method to generate all such graphs with a given genus. This provides an expansion of the linear transport moments for systems both with and without time reversal symmetry. The computational implementation is then able to progress several orders further than previous semiclassical formulae as well as those derived from an asymptotic expansion of random matrix results. The patterns observed also suggest a general form for the higher orders.

  10. Frozen Gaussian approximation based domain decomposition methods for the linear Schrödinger equation beyond the semi-classical regime

    Science.gov (United States)

    Lorin, E.; Yang, X.; Antoine, X.

    2016-06-01

    The paper is devoted to develop efficient domain decomposition methods for the linear Schrödinger equation beyond the semiclassical regime, which does not carry a small enough rescaled Planck constant for asymptotic methods (e.g. geometric optics) to produce a good accuracy, but which is too computationally expensive if direct methods (e.g. finite difference) are applied. This belongs to the category of computing middle-frequency wave propagation, where neither asymptotic nor direct methods can be directly used with both efficiency and accuracy. Motivated by recent works of the authors on absorbing boundary conditions (Antoine et al. (2014) [13] and Yang and Zhang (2014) [43]), we introduce Semiclassical Schwarz Waveform Relaxation methods (SSWR), which are seamless integrations of semiclassical approximation to Schwarz Waveform Relaxation methods. Two versions are proposed respectively based on Herman-Kluk propagation and geometric optics, and we prove the convergence and provide numerical evidence of efficiency and accuracy of these methods.

  11. Semiclassical expansions of the nuclear relativistic Hartree-Fock theory

    International Nuclear Information System (INIS)

    Weigel, M.K.; Haddad, S.

    1991-01-01

    Semiclassical expansions for Green functions, self-energy, phase-space density and density are given and discussed. The many-body problem was treated in the relativistic Hartree-Fock approximation with a Lagrangian with a standard OBE potential structure including the possibility of space-dependent couplings. The expansions are obtained by formulating the many-body problem in the mixed position-momentum (Wigner) representation and application of the (h/2π)-Wigner-Kirkwood expansion scheme. The resulting self-consistency problems for the zeroth and second order are formulated in three versions. (author)

  12. Precipitation in cold-rolled Al-Sc-Zr and Al-Mn-Sc-Zr alloys prepared by powder metallurgy

    KAUST Repository

    Vlach, Martin

    2013-12-01

    The effects of cold-rolling on thermal, mechanical and electrical properties, microstructure and recrystallization behaviour of the AlScZr and AlMnScZr alloys prepared by powder metallurgy were studied. The powder was produced by atomising in argon with 1% oxygen and then consolidated by hot extrusion at 350 C. The electrical resistometry and microhardness together with differential scanning calorimetry measurements were compared with microstructure development observed by transmission and scanning electron microscopy, X-ray diffraction and electron backscatter diffraction. Fine (sub)grain structure developed and fine coherent Al3Sc and/or Al3(Sc,Zr) particles precipitated during extrusion at 350 C in the alloys studied. Additional precipitation of the Al3Sc and/or Al3(Sc,Zr) particles and/or their coarsening was slightly facilitated by the previous cold rolling. The presence of Sc,Zr-containing particles has a significant antirecrystallization effect that prevents recrystallization at temperatures minimally up to 420 C. The precipitation of the Al6Mn- and/or Al 6(Mn,Fe) particles of a size ~ 1.0 μm at subgrain boundaries has also an essential antirecrystallization effect and totally suppresses recrystallization during 32 h long annealing at 550 C. The texture development of the alloys seems to be affected by high solid solution strengthening by Mn. The precipitation of the Mn-containing alloy is highly enhanced by a cold rolling. The apparent activation energy of the Al3Sc particles formation and/or coarsening and that of the Al6Mn and/or Al 6(Mn,Fe) particle precipitation in the powder and in the compacted alloys were determined. The cold deformation has no effect on the apparent activation energy values of the Al3Sc-phase and the Al 6Mn-phase precipitation. © 2013 Elsevier Inc.

  13. Precipitation in cold-rolled Al-Sc-Zr and Al-Mn-Sc-Zr alloys prepared by powder metallurgy

    KAUST Repository

    Vlach, Martin; Stulí ková , Ivana; Smola, Bohumil; Kekule, Tomá š; Kudrnová , Hana; Daniš, Stanislav; Gemma, Ryota; Očená šek, Vladivoj; Má lek, Jaroslav; Tanprayoon, Dhritti; Neubert, Volkmar

    2013-01-01

    The effects of cold-rolling on thermal, mechanical and electrical properties, microstructure and recrystallization behaviour of the AlScZr and AlMnScZr alloys prepared by powder metallurgy were studied. The powder was produced by atomising in argon with 1% oxygen and then consolidated by hot extrusion at 350 C. The electrical resistometry and microhardness together with differential scanning calorimetry measurements were compared with microstructure development observed by transmission and scanning electron microscopy, X-ray diffraction and electron backscatter diffraction. Fine (sub)grain structure developed and fine coherent Al3Sc and/or Al3(Sc,Zr) particles precipitated during extrusion at 350 C in the alloys studied. Additional precipitation of the Al3Sc and/or Al3(Sc,Zr) particles and/or their coarsening was slightly facilitated by the previous cold rolling. The presence of Sc,Zr-containing particles has a significant antirecrystallization effect that prevents recrystallization at temperatures minimally up to 420 C. The precipitation of the Al6Mn- and/or Al 6(Mn,Fe) particles of a size ~ 1.0 μm at subgrain boundaries has also an essential antirecrystallization effect and totally suppresses recrystallization during 32 h long annealing at 550 C. The texture development of the alloys seems to be affected by high solid solution strengthening by Mn. The precipitation of the Mn-containing alloy is highly enhanced by a cold rolling. The apparent activation energy of the Al3Sc particles formation and/or coarsening and that of the Al6Mn and/or Al 6(Mn,Fe) particle precipitation in the powder and in the compacted alloys were determined. The cold deformation has no effect on the apparent activation energy values of the Al3Sc-phase and the Al 6Mn-phase precipitation. © 2013 Elsevier Inc.

  14. Band structure of the quaternary Heusler alloys ScMnFeSn and ScFeCoAl

    Science.gov (United States)

    Shanthi, N.; Teja, Y. N.; Shaji, Shephine M.; Hosamani, Shashikala; Divya, H. S.

    2018-04-01

    In our quest for materials with specific applications, a theoretical study plays an important role in predicting the properties of compounds. Heusler alloys or compounds are the most studied in this context. More recently, a lot of quaternary Heusler compounds are investigated for potential applications in fields like Spintronics. We report here our preliminary study of the alloys ScMnFeSn and ScFeCoAl, using the ab-initio linear muffin-tin orbital method within the atomic sphere approximation (LMTO-ASA). The alloy ScMnFeSn shows perfect half-metallicity, namely, one of the spins shows a metallic behaviour and the other spin shows semi-conducting behaviour. Such materials find application in devices such as the spin-transfer torque random access memory (STT-MRAM). In addition, the alloy ScMnFeSn is found to have an integral magnetic moment of 4 µB, as predicted by the Slater-Pauling rule. The alloy ScFeCoAl does not show half-metallicity.

  15. Study between the semi-classical and the generator-coordinate methods

    International Nuclear Information System (INIS)

    Souza Cruz, F.F. de.

    1979-01-01

    In this work it is performed a comparison between two microscopic theories of the colective movement: semi-classical theory and the quantum theory from the generator -coordinate method. In boths cases, it is used wave packets |p,q> which depend on two canonical conjugate parameters. These wave packets are constructed by the action of displacement unitory operators, which are generated by canonical operators Q-circumflex and P-circumflex on a referencial state. (A.C.A.S.) [pt

  16. Bipolar harmonics method in the semiclassical theory of sub-doppler cooling

    International Nuclear Information System (INIS)

    Bezverbnyi, A.V.

    2000-01-01

    The bipolar harmonics method is extended to the case of complex elliptic polarization vectors. The method is used to study, on the basis of the semiclassical theory, the multipole moments of the ground state of atoms under conditions of sub-Doppler cooling with a monochromatic light field possessing spatial gradients of the polarization. It is shown that for stationary atoms with an initial isotropic distribution over sublevels the multipole moments of rank κ decompose, in accordance with the parity κ of the rank, according to one of two minimal sets of bipolar harmonics with different symmetry under inversion. An expansion of the corrections, which are linear in the velocity, to the multipole moments with respect to the indicated minimal sets of bipolar harmonics is studied for a stationary state, and the expansion coefficients are analyzed. The orientation vector J of the atomic ensemble is studied on the basis of the proposed method for the dipole transition 1/2 → 1/2, and the light-induced forces for a specific 2D configuration of the light field, including radiation friction forces and Lorentz-type forces, are analyzed

  17. The semiclassical limit of W.sub.N./sub. CFTs and Vasiliev theory

    Czech Academy of Sciences Publication Activity Database

    Perlmutter, E.; Procházka, Tomáš; Raeymaekers, Joris

    2013-01-01

    Roč. 2013, č. 5 (2013), s. 1-51 ISSN 1029-8479 R&D Projects: GA ČR(CZ) GAP203/11/1388 Grant - others:EUROHORC and ESF(XE) EYI/07/E010 Institutional support: RVO:68378271 Keywords : field theory * coupling * scalar * matter * spin * semiclassical * gravitation * defect Subject RIV: BE - Theoretical Physics Impact factor: 6.220, year: 2013

  18. A semiclassical model for quark jet fragmentation

    International Nuclear Information System (INIS)

    Andersson, B.; Gustafson, G.; Peterson, C.

    1979-01-01

    A semiclassical model is presented for the way the energy of a fast quark is transformed into observable hadrons. It reproduces the features of 1+1 dimensional QED (the Schwinger model) concerning a flat rapidity distribution in the central region. It also reproduces results from phenomenological considerations, which, based upon scaling, predict that meson formation in the fragmentation region can be described by an iterative scheme, implying a set of coupled integral equations. In particular the model predicts that the probability to find a meson containing the leading quark is independent of the Feynman scaling variable z. The iterative structure corresponds to a Brownian motion with relevance both to the cofinement problems and to the distribution of mass in the quark jet. (orig.) [de

  19. Improvements on Semi-Classical Distorted-Wave model

    Energy Technology Data Exchange (ETDEWEB)

    Sun Weili; Watanabe, Y.; Kuwata, R. [Kyushu Univ., Fukuoka (Japan); Kohno, M.; Ogata, K.; Kawai, M.

    1998-03-01

    A method of improving the Semi-Classical Distorted Wave (SCDW) model in terms of the Wigner transform of the one-body density matrix is presented. Finite size effect of atomic nuclei can be taken into account by using the single particle wave functions for harmonic oscillator or Wood-Saxon potential, instead of those based on the local Fermi-gas model which were incorporated into previous SCDW model. We carried out a preliminary SCDW calculation of 160 MeV (p,p`x) reaction on {sup 90}Zr with the Wigner transform of harmonic oscillator wave functions. It is shown that the present calculation of angular distributions increase remarkably at backward angles than the previous ones and the agreement with the experimental data is improved. (author)

  20. Semiclassical statistical mechanics of fluids

    International Nuclear Information System (INIS)

    Singh, Y.; Sinha, S.K.

    1981-01-01

    The problem of calculating the equilibrium properties of fluids in the semiclassical limit when the quantum effects are small is studied. Particle distribution functions and thermodynamic quantities are defined in terms of the Slater sum and methods for evaluating the Slater sum are discussed. It is shown that the expansion method employing the usual Wigner-Kirkwood or Hemmer-Jancovici series is not suitable to treat the properties of the condensed state. Using the grand canonical ensemble and functional differentiation technique we develop cluster expansion series of the Helmholtz free energy and pair correlation functions. Using topological reduction we transform these series to more compact form involving a renormalized potential or a renormalized Mayer function. Then the convergence of the two series is improved by an optimal choice of the renormalized potential or the Mayer function. Integral equation theories are derived and used to devise perturbation methods. An application of these methods to the calculation of the virial coefficients, thermodynamic properties and the pair correlation function for model fluids is discussed. (orig.)

  1. The colours of Hubble Sc galaxy nuclei

    International Nuclear Information System (INIS)

    Iskudaryan, S.G.

    1975-01-01

    The colorimetric data on the nuclei of the Sc galaxies are given. Comparison of the following parameters: color of a nucleus, integral color of a galaxy, Byurakan class, and spectral type of normal spirals gives the possibility to conclude: (1) The colors of the nuclei of the Sc galaxies have a high dispersion in its values. In all Byurakan classes the galaxies with intensely red and blue nuclei occur; (2) Some Sc galaxies exhibit a discrepancy between the spectral and morphological types. The results of colorimetry of nuclei indicate that almost all such Sc galaxies have intensely red nuclei which, naturally, provide for these late spectral types. It can be assumed that the intensely red color of the nuclei of such Sc galaxies is a result of a new type of activity of these nuclei; and (3) some Sc galaxies show the characteristics of the Markarian objects

  2. Semiclassical derivation of a local optical potential for heavy-ion plastic scattering

    International Nuclear Information System (INIS)

    Donangelo, R.; Qanto, L.F.; Hussein, M.S.

    A semiclassical method to determine the contribution to the optical potential in the elastic channel due to the coupling to other processes taking place in heavy-ion collisions is developed. An application is made to the case of coulomb excitation. The lowest order term of our potential is shown to be identical to the quantum mechanical expression of Baltz et al

  3. Horizons of semiclassical black holes are cold

    International Nuclear Information System (INIS)

    Brustein, Ram; Medved, A.J.M.

    2014-01-01

    We calculate, using our recently proposed semiclassical framework, the quantum state of the Hawking pairs that are produced during the evaporation of a black hole (BH). Our framework adheres to the standard rules of quantum mechanics and incorporates the quantum fluctuations of the collapsing shell spacetime in Hawking’s original calculation, while accounting for back-reaction effects. We argue that the negative-energy Hawking modes need to be regularly integrated out; and so these are effectively subsumed by the BH and, as a result, the number of coherent negative-energy modes N_c_o_h at any given time is parametrically smaller than the total number of the Hawking particles N_t_o_t_a_l emitted during the lifetime of the BH. We find that N_c_o_h is determined by the width of the BH wavefunction and scales as the square root of the BH entropy. We also find that the coherent negative-energy modes are strongly entangled with their positive-energy partners. Previously, we have found that N_c_o_h is also the number of coherent outgoing particles and that information can be continually transferred to the outgoing radiation at a rate set by N_c_o_h. Our current results show that, while the BH is semiclassical, information can be released without jeopardizing the nearly maximal inside-out entanglement and imply that the state of matter near the horizon is approximately the vacuum. The BH firewall proposal, on the other hand, is that the state of matter near the horizon deviates substantially from the vacuum, starting at the Page time. We find that, under the usual assumptions for justifying the formation of a firewall, one does indeed form at the Page time. However, the possible loophole lies in the implicit assumption that the number of strongly entangled pairs can be of the same order of N_t_o_t_a_l

  4. Semiclassical theory of magnetoresistance in positionally disordered organic semiconductors

    Science.gov (United States)

    Harmon, N. J.; Flatté, M. E.

    2012-02-01

    A recently introduced percolative theory of unipolar organic magnetoresistance is generalized by treating the hyperfine interaction semiclassically for an arbitrary hopping rate. Compact analytic results for the magnetoresistance are achievable when carrier hopping occurs much more frequently than the hyperfine field precession period. In other regimes the magnetoresistance can be straightforwardly evaluated numerically. Slow and fast hopping magnetoresistance are found to be uniquely characterized by their line shapes. We find that the threshold hopping distance is analogous a phenomenological two-site model's branching parameter, and that the distinction between slow and fast hopping is contingent on the threshold hopping distance.

  5. Quadratic Forms and Semiclassical Eigenfunction Hypothesis for Flat Tori

    Science.gov (United States)

    T. Sardari, Naser

    2018-03-01

    Let Q( X) be any integral primitive positive definite quadratic form in k variables, where {k≥4}, and discriminant D. For any integer n, we give an upper bound on the number of integral solutions of Q( X) = n in terms of n, k, and D. As a corollary, we prove a conjecture of Lester and Rudnick on the small scale equidistribution of almost all functions belonging to any orthonormal basis of a given eigenspace of the Laplacian on the flat torus {T^d} for {d≥ 5}. This conjecture is motivated by the work of Berry [2,3] on the semiclassical eigenfunction hypothesis.

  6. Scale-invariant curvature fluctuations from an extended semiclassical gravity

    Energy Technology Data Exchange (ETDEWEB)

    Pinamonti, Nicola, E-mail: pinamont@dima.unige.it, E-mail: siemssen@dima.unige.it [Dipartimento di Matematica, Università di Genova, Via Dodecaneso 35, 16146 Genova (Italy); INFN Sezione di Genova, Via Dodecaneso 33, 16146 Genova (Italy); Siemssen, Daniel, E-mail: pinamont@dima.unige.it, E-mail: siemssen@dima.unige.it [Dipartimento di Matematica, Università di Genova, Via Dodecaneso 35, 16146 Genova (Italy)

    2015-02-15

    We present an extension of the semiclassical Einstein equations which couple n-point correlation functions of a stochastic Einstein tensor to the n-point functions of the quantum stress-energy tensor. We apply this extension to calculate the quantum fluctuations during an inflationary period, where we take as a model a massive conformally coupled scalar field on a perturbed de Sitter space and describe how a renormalization independent, almost-scale-invariant power spectrum of the scalar metric perturbation is produced. Furthermore, we discuss how this model yields a natural basis for the calculation of non-Gaussianities of the considered metric fluctuations.

  7. Surgical Critical Care Initiative

    Data.gov (United States)

    Federal Laboratory Consortium — The Surgical Critical Care Initiative (SC2i) is a USU research program established in October 2013 to develop, translate, and validate biology-driven critical care....

  8. Semiclassical and phase space approaches to dynamic and collisional problems of nuclei

    International Nuclear Information System (INIS)

    Hasse, R.W.; Gregoire, C.; Remaud, B.; Jaenicke, J.; Schuck, P.

    1988-09-01

    This article summarises recent work on the semiclassical (Thomas-Fermi like) treatment of nuclear correlations and dynamical problems. After a short outline of hte general technique the nucleon-nucleus optical potential in the doorway approximation (2p-1h and 2h-1p intermediate states) is treated. The imaginary part serves to calculate the energy dependent correction to the real part. The level density parameter, occupation numbers, and the mean free path are discussed. The semiclassical treatment of the nuclear response function is given in detail. Applications to inelastic electron scattering in the quasi-elastic peak region are presented. Analogously, inelastic proton scattering is calculated. Because of the surface absorption this reaction excites the surface response. The imaginary part of the single-particle (hole) potential in the evaluation of the response function introduces a 2p-2h spreading. The missing charge in the longitudinal response is reduced but not all experimental puzzles can be explained. The experience gained in the description of phenomena close to equilibrium serves to construct solutions of the Landau-Vlasov (alias Vlasov-Uehling-Uhlenbeck) equation for the description of non-equilibrium processes encountered in heavy ion reactions

  9. Reconciling semiclassical and Bohmian mechanics. V. Wavepacket dynamics

    International Nuclear Information System (INIS)

    Poirier, Bill

    2008-01-01

    In previous articles [B. Poirier J. Chem. Phys. 121, 4501 (2004); C. Trahan and B. Poirier, ibid. 124, 034115 (2006); 124, 034116 (2006); B. Poirier and G. Parlant, J. Phys. Chem. A 111, 10400 (2007)] a bipolar counterpropagating wave decomposition, ψ=ψ + +ψ - , was presented for stationary states ψ of the one-dimensional Schroedinger equation, such that the components ψ ± approach their semiclassical Wentzel-Kramers-Brillouin analogs in the large action limit. The corresponding bipolar quantum trajectories are classical-like and well behaved, even when ψ has many nodes, or is wildly oscillatory. In this paper, the method is generalized for time-dependent wavepacket dynamics applications and applied to several benchmark problems, including multisurface systems with nonadiabatic coupling

  10. On a semiclassical analysis of high energy electron diffraction by imperfect crystals: the stacking fault

    International Nuclear Information System (INIS)

    Smith, A.E.; Chadderton, L.T.; Johnson, E.

    1978-01-01

    Electron diffraction amplitudes at the lower surface of a displaced sandwich crystal are obtained for the high energy limit in the real space formulation. Using semiclassical methods analytical approximations to a resulting overlap integral - central to the problem - are derived. (Auth.)

  11. Classical, Semi-classical and Quantum Noise

    CERN Document Server

    Poor, H; Scully, Marlan

    2012-01-01

    David Middleton was a towering figure of 20th Century engineering and science and one of the founders of statistical communication theory. During the second World War, the young David Middleton, working with Van Fleck, devised the notion of the matched filter, which is the most basic method used for detecting signals in noise. Over the intervening six decades, the contributions of Middleton have become classics. This collection of essays by leading scientists, engineers and colleagues of David are in his honor and reflect the wide  influence that he has had on many fields. Also included is the introduction by Middleton to his forthcoming book, which gives a wonderful view of the field of communication, its history and his own views on the field that he developed over the past 60 years. Focusing on classical noise modeling and applications, Classical, Semi-Classical and Quantum Noise includes coverage of statistical communication theory, non-stationary noise, molecular footprints, noise suppression, Quantum e...

  12. Semiclassical statistical mechanics

    International Nuclear Information System (INIS)

    Stratt, R.M.

    1979-04-01

    On the basis of an approach devised by Miller, a formalism is developed which allows the nonperturbative incorporation of quantum effects into equilibrium classical statistical mechanics. The resulting expressions bear a close similarity to classical phase space integrals and, therefore, are easily molded into forms suitable for examining a wide variety of problems. As a demonstration of this, three such problems are briefly considered: the simple harmonic oscillator, the vibrational state distribution of HCl, and the density-independent radial distribution function of He 4 . A more detailed study is then made of two more general applications involving the statistical mechanics of nonanalytic potentials and of fluids. The former, which is a particularly difficult problem for perturbative schemes, is treated with only limited success by restricting phase space and by adding an effective potential. The problem of fluids, however, is readily found to yield to a semiclassical pairwise interaction approximation, which in turn permits any classical many-body model to be expressed in a convenient form. The remainder of the discussion concentrates on some ramifications of having a phase space version of quantum mechanics. To test the breadth of the formulation, the task of constructing quantal ensemble averages of phase space functions is undertaken, and in the process several limitations of the formalism are revealed. A rather different approach is also pursued. The concept of quantum mechanical ergodicity is examined through the use of numerically evaluated eigenstates of the Barbanis potential, and the existence of this quantal ergodicity - normally associated with classical phase space - is verified. 21 figures, 4 tables

  13. Saccharomyces cerevisiae Differential Functionalization of Presumed ScALT1 and ScALT2 Alanine Transaminases Has Been Driven by Diversification of Pyridoxal Phosphate Interactions

    Directory of Open Access Journals (Sweden)

    Erendira Rojas-Ortega

    2018-05-01

    Full Text Available Saccharomyces cerevisiae arose from an interspecies hybridization (allopolyploidiza-tion, followed by Whole Genome Duplication. Diversification analysis of ScAlt1/ScAlt2 indicated that while ScAlt1 is an alanine transaminase, ScAlt2 lost this activity, constituting an example in which one of the members of the gene pair lacks the apparent ancestral physiological role. This paper analyzes structural organization and pyridoxal phosphate (PLP binding properties of ScAlt1 and ScAlt2 indicating functional diversification could have determined loss of ScAlt2 alanine transaminase activity and thus its role in alanine metabolism. It was found that ScAlt1 and ScAlt2 are dimeric enzymes harboring 67% identity and intact conservation of the catalytic residues, with very similar structures. However, tertiary structure analysis indicated that ScAlt2 has a more open conformation than that of ScAlt1 so that under physiological conditions, while PLP interaction with ScAlt1 allows the formation of two tautomeric PLP isomers (enolimine and ketoenamine ScAlt2 preferentially forms the ketoenamine PLP tautomer, indicating a modified polarity of the active sites which affect the interaction of PLP with these proteins, that could result in lack of alanine transaminase activity in ScAlt2. The fact that ScAlt2 forms a catalytically active Schiff base with PLP and its position in an independent clade in “sensu strictu” yeasts suggests this protein has a yet undiscovered physiological function.

  14. Saccharomyces cerevisiae Differential Functionalization of Presumed ScALT1 and ScALT2 Alanine Transaminases Has Been Driven by Diversification of Pyridoxal Phosphate Interactions

    Science.gov (United States)

    Rojas-Ortega, Erendira; Aguirre-López, Beatriz; Reyes-Vivas, Horacio; González-Andrade, Martín; Campero-Basaldúa, Jose C.; Pardo, Juan P.; González, Alicia

    2018-01-01

    Saccharomyces cerevisiae arose from an interspecies hybridization (allopolyploidiza-tion), followed by Whole Genome Duplication. Diversification analysis of ScAlt1/ScAlt2 indicated that while ScAlt1 is an alanine transaminase, ScAlt2 lost this activity, constituting an example in which one of the members of the gene pair lacks the apparent ancestral physiological role. This paper analyzes structural organization and pyridoxal phosphate (PLP) binding properties of ScAlt1 and ScAlt2 indicating functional diversification could have determined loss of ScAlt2 alanine transaminase activity and thus its role in alanine metabolism. It was found that ScAlt1 and ScAlt2 are dimeric enzymes harboring 67% identity and intact conservation of the catalytic residues, with very similar structures. However, tertiary structure analysis indicated that ScAlt2 has a more open conformation than that of ScAlt1 so that under physiological conditions, while PLP interaction with ScAlt1 allows the formation of two tautomeric PLP isomers (enolimine and ketoenamine) ScAlt2 preferentially forms the ketoenamine PLP tautomer, indicating a modified polarity of the active sites which affect the interaction of PLP with these proteins, that could result in lack of alanine transaminase activity in ScAlt2. The fact that ScAlt2 forms a catalytically active Schiff base with PLP and its position in an independent clade in “sensu strictu” yeasts suggests this protein has a yet undiscovered physiological function. PMID:29867852

  15. Quantum screening effects on the electron-ion occurrence scattering time advance in strongly coupled semiclassical plasmas

    International Nuclear Information System (INIS)

    Song, Mi-Young; Jung, Young-Dae

    2003-01-01

    Quantum screening effects on the occurrence scattering time advance for elastic electron-ion collisions in strongly coupled semiclassical plasmas are investigated using the second-order eikonal analysis. The electron-ion interaction in strongly coupled semiclassical plasmas is obtained by the pseudopotential model taking into account the plasma screening and quantum effects. It is found that the quantum-mechanical effects significantly reduce the occurrence scattering time advance. It is also found that the occurrence scattering time advance increases with increasing Debye length. It is quite interesting to note that the domain of the maximum occurrence time advance is localized for the forward scattering case. The region of the scaled thermal de Broglie wave length (λ-bar) for the maximum occurrence time advance is found to be 0.4≤λ-bar≤1.4

  16. Diffraction and angular momentum effects in semiclassical atomic scattering theory

    International Nuclear Information System (INIS)

    Russek, A.

    1979-01-01

    The semiclassical scattering theory of Mott and Massey and Ford and Wheeler is here extended to multichannel scattering as occurs at a crossing or pseudocrossing of the transient molecule formed by the colliding atoms. The generalized theory incorporates both interference and diffraction phenomena, but the emphasis in this work is on diffraction. For small-angle scattering, diffraction effects become broader, not narrower, as the collision energy increases: ΔbΔtau > or = h[E/sub inc//(2m)]/sup 1/2/ relates the uncertainties in impact parameter b and reduced scattering angle tau = E/sub inc/theta, and determines the range in b required to resolve a structure in the deflection function of height Δtau. In the kilovolt range of collision energies, the effects of local maxima and minima in the deflection function are washed out, and the Airy-function approximation of Ford and Wheeler is inappropriate to describe the differential cross section. More generally, it is shown that at keV collision energies the stationary-phase approximation, heretofore essential in the reduction to the semiclassical limit, breaks down in the vicinity of a level crossing. An approximate theorem is proposed which remains valid in this region and elsewhere reduces to the standard stationary-phase approximation. Several illustrative examples are considered. A separate development treats the effect on the differential scattering cross section of a change in electronic angular momentum when electronic excitation occurs

  17. Timescale differences between SC-PDSI and SPEI for drought monitoring in China

    Science.gov (United States)

    Zhao, Haiyan; Gao, Ge; An, Wei; Zou, Xukai; Li, Haitao; Hou, Meiting

    2017-12-01

    The Palmer Drought Severity Index (PDSI) has been widely used to monitor drought. Its characteristics are more suitable for measuring droughts of longer timescales, and this fact has not received much attention. The Standardized Precipitation Evapotranspiration Index (SPEI) can better reflect the climatic water balance, owing to its combination of precipitation and potential evapotranspiration. In this study, we selected monthly average air temperature and precipitation data from 589 meteorological stations of China's National Meteorological Information Center, to compare the effects of applying a self-calibrating PDSI (SC-PDSI) and SPEI to monitor drought events in the station regions, with a special focus on differences of event timescale. The results show the following. 1) Comparative analysis using SC-PDSI and SPEI for drought years and characters of three dry periods from 1961 to 2011 in the Beijing region showed that durations of SC-PDSI-based dry spells were longer than those of 3-month and 6-month SPEIs, but equal to those of 12-month or longer timescale SPEIs. 2) For monitoring evolution of the fall 2009 to spring 2010 Southwest China drought and spring 2000 Huang-Huai drought, 3-month SPEI could better monitor the initiation, aggravation, alleviation and relief of drought in the two regions, whereas the SC-PDSI was insensitive to drought recovery because of its long-term memory of previous climate conditions. 3) Analysis of the relationship between SC-PDSI for different regions and SPEI for different timescales showed that correlation of the two indexes changed with region, and SC-PDSI was maximally correlated with SPEI of 9-19 months in China. Therefore, SC-PDSI is only suitable for monitoring mid- and long-term droughts, owing to the strong lagged autocorrelation such as 0.4786 for 12-month lagged ones in Beijing, whereas SPEI is suitable for both short- and long-term drought-monitoring and should have greater application prospects in China.

  18. The ternary systems Sc-Sm(Dy)-Si at 870 K

    International Nuclear Information System (INIS)

    Kotur, B.Ya.; Mokra, I.Ya.; Toporinskij, A.Ya.

    1991-01-01

    Isothermal cross sections of the ternary systems Sc-Sm-Si and Sc-Dy-Si at 870 K have been plotted. Investigation of scandium and disprosium in ternary systems have been examined by X-ray diffraction and microstructure analysis. Besides literary data on binary systems Sc-Si, Sm-Si, Dy-Si have been used. Formation of limited (Sc-Sm-Si, Sc-Dy-Si) and continuous (Sc-Dy-Si) solid solutions based on bisilicides of Sc and Sm(Dy) is discovered. Two and five ternary compounds in Sc-Sm-Si and Sc-Dy-Si systems have been determined and their crystal structure has been established. When investigating of Sc-(rare earth element)-Si ternary systems and should take into account the specific interaction of scandium and samarium with REE

  19. Nuclear giant resonances in coordinate space. A semiclassical density functional approach

    International Nuclear Information System (INIS)

    Gleissl, P.; Brack, M.; Meyer, J.; Quentin, P.

    1987-01-01

    We discuss the semiclassical description of nuclear giant resonances (GR) using a realistic Skyrme force (SkM*) and complete ETF density functionals. We present monopole (0 + ) eigenmodes of isoscalar (I=0) and isovector (I=1) type, which are in good agreement with experiment, and the corresponding m 1 and m 3 sum rules. We also present the temperature dependence of some typical GR energies (0 + , I=0,1; 1 - , I=1; 2 + , I=0) in 208 Pb

  20. Hamiltonian structure of isospectral deformation equation and semi-classical approximation to factorized S-matrices

    International Nuclear Information System (INIS)

    Chudnovsky, D.V.; Chudnovsky, G.V.

    1980-01-01

    We consider semi-classical approximation to factorized S-matrices. We show that this new class of matrices, called s-matrices, defines Hamiltonian structures for isospectral deformation equations. Concrete examples of factorized s-matrices are constructed and they are used to define Hamiltonian structure for general two-dimensional isospectral deformation systems. (orig.)

  1. Semiclassical approach to the quantization of the periodic solutions of the sine-Gordon equation

    International Nuclear Information System (INIS)

    Ghika, G.; Visinescu, M.

    1978-01-01

    The periodic solutions of the sine-Gordon equation are proved to be singular. For the semiclassical quantization of the periodic solutions we calculate the fluctuations around them and we use the path integrals in the Gaussian approximation in order to obtain the bound states of the sine-Gordon field equation. (author)

  2. Hydride vapor phase epitaxy growth of GaN, InGaN, ScN, and ScAIN

    NARCIS (Netherlands)

    Bohnen, T.

    2010-01-01

    Chemical vapor deposition (CVD); hydride vapor phase epitaxy (HVPE); gallium nitride (GaN); indium gallium nitride (InGaN); scandium nitride (ScN); scandium aluminum nitride (ScAlN); semiconductors; thin films; nanowires; III nitrides; crystal growth - We studied the HVPE growth of different III

  3. Recombinant norovirus-specific scFv inhibit virus-like particle binding to cellular ligands

    Directory of Open Access Journals (Sweden)

    Hardy Michele E

    2008-01-01

    Full Text Available Abstract Background Noroviruses cause epidemic outbreaks of gastrointestinal illness in all age-groups. The rapid onset and ease of person-to-person transmission suggest that inhibitors of the initial steps of virus binding to susceptible cells have value in limiting spread and outbreak persistence. We previously generated a monoclonal antibody (mAb 54.6 that blocks binding of recombinant norovirus-like particles (VLP to Caco-2 intestinal cells and inhibits VLP-mediated hemagglutination. In this study, we engineered the antigen binding domains of mAb 54.6 into a single chain variable fragment (scFv and tested whether these scFv could function as cell binding inhibitors, similar to the parent mAb. Results The scFv54.6 construct was engineered to encode the light (VL and heavy (VH variable domains of mAb 54.6 separated by a flexible peptide linker, and this recombinant protein was expressed in Pichia pastoris. Purified scFv54.6 recognized native VLPs by immunoblot, inhibited VLP-mediated hemagglutination, and blocked VLP binding to H carbohydrate antigen expressed on the surface of a CHO cell line stably transfected to express α 1,2-fucosyltransferase. Conclusion scFv54.6 retained the functional properties of the parent mAb with respect to inhibiting norovirus particle interactions with cells. With further engineering into a form deliverable to the gut mucosa, norovirus neutralizing antibodies represent a prophylactic strategy that would be valuable in outbreak settings.

  4. Mathematical properties of a semi-classical signal analysis method: Noisy signal case

    KAUST Repository

    Liu, Dayan

    2012-08-01

    Recently, a new signal analysis method based on a semi-classical approach has been proposed [1]. The main idea in this method is to interpret a signal as a potential of a Schrodinger operator and then to use the discrete spectrum of this operator to analyze the signal. In this paper, we are interested in a mathematical analysis of this method in discrete case considering noisy signals. © 2012 IEEE.

  5. Mathematical properties of a semi-classical signal analysis method: Noisy signal case

    KAUST Repository

    Liu, Dayan; Laleg-Kirati, Taous-Meriem

    2012-01-01

    Recently, a new signal analysis method based on a semi-classical approach has been proposed [1]. The main idea in this method is to interpret a signal as a potential of a Schrodinger operator and then to use the discrete spectrum of this operator to analyze the signal. In this paper, we are interested in a mathematical analysis of this method in discrete case considering noisy signals. © 2012 IEEE.

  6. Semiclassical treatment of inelastic collisions between electrons and highly ionized atoms

    International Nuclear Information System (INIS)

    Frasier, S.M.

    1984-01-01

    The thesis is concerned with the calculation of excitation cross sections of ions by electron impact at intermediate energies in the limit of Z >> N/sub b/, where Z is the atomic number and N/sub b/ is the number of bound electrons. A semiclassical procedure is developed for calculating total cross sections using analytic bound states and averaged free electron wave functions derived in the second eikonal approximation. The analytic bound states are derived assuming a screened Coulomb potential and using orbital energies obtained from Hartree-Fock calculations. The functional form of the bound states reduces naturally to the hydrogen atom functions in the limit Z → infinity. The free electron functions used are semiclassical solutions to the free electron Schroedinger equation with a screened Coulomb potential. An exact solution is obtained in the second eikonal approximation, including all classical path contributions. This solution is averaged to extract the focusing and acceleration effects resulting from the long range Coulomb potential of the ion. The results are presented in the form of Born-like cross section formulae and demonstrate the appropriate correction of the Born cross section which arises from the acceleration and focusing of the free electrons by the long range Coulomb potential. Comparison is made with the Coulomb-Born results; the results agree to within 10% in most cases

  7. Ultimate internal pressure capacity assessment of SC structure

    International Nuclear Information System (INIS)

    Park, Hyungkui; Choi, Inkil

    2013-01-01

    An SC structure applied to a containment building can be quite effective. However, an SC structure cannot be applied to a containment building, because its internal pressure resistance performance has not been verified. The containment building, which undergoes ultimate internal pressure, resists the internal pressure through a pre-stress tendon. It is hard to apply a tendon to an SC structure because of its structural characteristics. Therefore, the internal pressure resistance performance of the SC structure itself should be ensured to apply it to a structure with internal pressure resistance. In this study, the suitability of an SC structure as a substitution for the tendon of a pressure resistant structure was evaluated. A containment structure model was used in this study, because it was representative structures that resistance of ultimate internal pressure be required. In this study, a nonlinear analysis was performed to evaluate and compare the behaviors of tendon model and SC structure model. By comparing the internal pressure-displacement according to the structure type, the stability of SC structure model was assessed

  8. On semi-classical questions related to signal analysis

    KAUST Repository

    Helffer, Bernard

    2011-12-01

    This study explores the reconstruction of a signal using spectral quantities associated with some self-adjoint realization of an h-dependent Schrödinger operator -h2(d2/dx2)-y(x), h>0, when the parameter h tends to 0. Theoretical results in semi-classical analysis are proved. Some numerical results are also presented. We first consider as a toy model the sech2 function. Then we study a real signal given by arterial blood pressure measurements. This approach seems to be very promising in signal analysis. Indeed it provides new spectral quantities that can give relevant information on some signals as it is the case for arterial blood pressure signal. © 2011 - IOS Press and the authors. All rights reserved.

  9. Semi-classical analysis of scattering of deformed heavy-ions below the Coulomb barrier

    International Nuclear Information System (INIS)

    Johnson, R.C.; Roberts, E.J.; Sukumar, C.V.; Brink, D.M.

    1995-01-01

    Polarization observables for the sub-Coulomb elastic scattering of a quadrupole deformed projectile of spin 3/2 from a spinless spherical target are evaluated using a new semi-classical method based on a path-integral formalism. Analytic expressions are obtained which agree well with coupled channels calculations and which predict definite deviations from the ''shape-effect'' relations for tensor analyzing powers

  10. Calculation of the spin-isospin response functions in an extended semi-classical theory

    International Nuclear Information System (INIS)

    Chanfray, G.

    1987-01-01

    We present a semi-classical calculation of the spin isospin response-functions beyond Thomas-Fermi theory. We show that surface-peaked ℎ 2 corrections reduce the collective effects predicted by Thomas-Fermi calculations. These effects, small for a volume response, become important for surface responses probed by hadrons. This yields a considerable improvement of the agreement with the (p, p') Los Alamos data

  11. Damping in nuclear collective modes in a semiclassical fluid-dynamical approximation

    International Nuclear Information System (INIS)

    Vignolo, C.E.; Hernandez, Susana

    1989-01-01

    A semiclassical fluiddynamical model based on an usual scaling approximation (SCA) was extended to investigate the role of one and two-body dissipation in the widths of nuclear collective modes. The competition between one and two-body viscosity in: i) the collisionless (elastic) limit; ii) the hydrodynamical case and iii) the general viscoelastic regime is examined over the whole range of nuclear collision time scales. Numerical solutions are investigated for the first magnetic 2 - twist mode in 208 Pb. (Author) [es

  12. Semiclassical neutral atom as a reference system in density functional theory.

    Science.gov (United States)

    Constantin, Lucian A; Fabiano, E; Laricchia, S; Della Sala, F

    2011-05-06

    We use the asymptotic expansions of the semiclassical neutral atom as a reference system in density functional theory to construct accurate generalized gradient approximations (GGAs) for the exchange-correlation and kinetic energies without any empiricism. These asymptotic functionals are among the most accurate GGAs for molecular systems, perform well for solid state, and overcome current GGA state of the art in frozen density embedding calculations. Our results also provide evidence for the conjointness conjecture between exchange and kinetic energies of atomic systems.

  13. Fourier transform methods for calculating action variables and semiclassical eigenvalues for coupled oscillator systems

    International Nuclear Information System (INIS)

    Eaker, C.W.; Schatz, G.C.; De Leon, N.; Heller, E.J.

    1984-01-01

    Two methods for calculating the good action variables and semiclassical eigenvalues for coupled oscillator systems are presented, both of which relate the actions to the coefficients appearing in the Fourier representation of the normal coordinates and momenta. The two methods differ in that one is based on the exact expression for the actions together with the EBK semiclassical quantization condition while the other is derived from the Sorbie--Handy (SH) approximation to the actions. However, they are also very similar in that the actions in both methods are related to the same set of Fourier coefficients and both require determining the perturbed frequencies in calculating actions. These frequencies are also determined from the Fourier representations, which means that the actions in both methods are determined from information entirely contained in the Fourier expansion of the coordinates and momenta. We show how these expansions can very conveniently be obtained from fast Fourier transform (FFT) methods and that numerical filtering methods can be used to remove spurious Fourier components associated with the finite trajectory integration duration. In the case of the SH based method, we find that the use of filtering enables us to relax the usual periodicity requirement on the calculated trajectory. Application to two standard Henon--Heiles models is considered and both are shown to give semiclassical eigenvalues in good agreement with previous calculations for nondegenerate and 1:1 resonant systems. In comparing the two methods, we find that although the exact method is quite general in its ability to be used for systems exhibiting complex resonant behavior, it converges more slowly with increasing trajectory integration duration and is more sensitive to the algorithm for choosing perturbed frequencies than the SH based method

  14. Semiclassical spectral quantization: Application to two and four coupled molecular degrees of freedom

    International Nuclear Information System (INIS)

    De Leon, N.; Heller, E.J.

    1984-01-01

    Semiclassical quantization of the quasiperiodic vibrational motion of molecules is usually based on Einstein--Brillouin--Keller (EBK) conditions for the quantization of the classical actions. Explicit use of the EBK conditions for molecular systems of K degrees of freedom requires K quantization conditions. Therefore, explicit use of the EBK conditions becomes increasingly difficult if not impossible for polyatomic systems of three or more degrees of freedom. In this paper we propose a semiclassical quantization method which makes explicit use of phase coherence of the de Broglie wave associated with the trajectory rather than the EBK conditions. We show that taking advantage of phase coherence reduces the K quantization conditions to a single quantum condition: regardless of the number of degrees of freedom. For reasons that will become obvious we call this method ''spectral quantization.'' Polyatomic vibrational wave functions and energy eigenvalues are generated from quasiperiodic classical trajectories. The spectral method is applied to an ABA linear triatomic molecule with two degrees of freedom and to an anharmonic model of the molecule cyanoacetylene. The usefulness of the technique is demonstrated in this latter calculation since the cyanoacetylene model will have four coupled vibrational degrees of freedom

  15. Semi-classical approaches to the phase space evolutions in intermediate energy heavy ion collisions

    Energy Technology Data Exchange (ETDEWEB)

    Remaud, B; Sebille, F; Raffray, Y; Gregoire, C; Vinet, L

    1986-01-06

    The properties of semi-classical phase space evolution equations - as the Vlasov/Boltzmann equations - are discussed in the context of the heavy ion reaction theory at intermediate energies (from 10 to 100 MeV per nucleon). The generalized coherent state set is shown to form a (over) complete basis for the phase space; then every solution of the Vlasov/Boltzmann equations can be defined as a convolution product of the generalized coherent state basis by an appropriate weight function w. The uniform approximation for w is shown to provide an accurate semi-classical description of fermion systems in their ground state: the examples of fermions in a harmonic well and of cold nuclei are discussed. The solution of the Vlasov equation amounts to follow the time evolution of the coherent states which play the role of a moving basis. For the Boltzmann equation, the collision term is taken into account by explicit or implicit variations of the function w. Typical applications are discussed: nuclear response to the giant monopole resonance excitation, fast nucleon emission in heavy-ion reactions. (orig.).

  16. SAM revisited: absorptive uniform semiclassical approximation and application to heavy-ion elastic scattering

    International Nuclear Information System (INIS)

    Pato, M.P.; Hussein, M.S.

    1989-06-01

    The Uniform Semiclassical Approximation is modified to take into account absorption. Symbol calculus and pseudodifferential operators techniques are employed for the purpose. The resulting theory, very similar to the one developed by Frahn and Gross permits the decomposition of the near-side and far-side amplitudes into diffractive and refractive components. Application to several heavy-ion systems at intermediate energies is made. (author) [pt

  17. Focal points and the phase of the semi-classical propagator

    International Nuclear Information System (INIS)

    Levit, S.; Moehring, K.; Smilansky, U.; Dreyfus, T.

    1977-01-01

    The relation between the phase of the semi-classical propagator and the number of times the classical trajectory is reflected from a caustic is discussed. It is shown that the accepted prescription based on Morse's focal point theorem is valid only for a restricted class of problems (coordinate representation and a positive definite mass tensor). A more general method to evaluate the phase is derived. It applies to all problems of physical interest involving the most general representations (mixed coordinate and momentum) and complicated Hamiltonian functions. The result is of particular relevance for the classical S-matrix. (author)

  18. Energy Levels and Radiative Rates for Transitions in F-like Sc XIII and Ne-like Sc XII and Y XXX

    Science.gov (United States)

    Aggarwal, Kanti

    2018-05-01

    Energy levels, radiative rates and lifetimes are reported for F-like Sc~XIII and Ne-like Sc~XII and Y~XXX for which the general-purpose relativistic atomic structure package ({\\sc grasp}) has been adopted. For all three ions limited data exist in the literature but comparisons have been made wherever possible to assess the accuracy of the calculations. In the present work the lowest 102, 125 and 139 levels have been considered for the respective ions. Additionally, calculations have also been performed with the flexible atomic code ({\\sc fac}) to (particularly) confirm the accuracy of energy levels.

  19. Cyclotron production of {sup 44}Sc for clinical application

    Energy Technology Data Exchange (ETDEWEB)

    Krajewski, S.; Bilewicz, A. [Institute of Nuclear Chemistry and Technology, Warsaw (Poland); Cydzik, I. [Institute of Nuclear Chemistry and Technology, Warsaw (Poland); European Commission Joint Research Center, Ispra (Italy). Inst. for Health and Consumer Protection; Warsaw Univ. (Poland). Heavy Ion Lab.; Abbas, K. [European Commission Joint Research Center, Ispra (Italy). Institute for Transuranium Elements; Bulgheroni, A.; Simonelli, F.; Holzwarth, U. [European Commission Joint Research Center, Ispra (Italy). Inst. for Health and Consumer Protection

    2013-08-01

    {sup 44} is a promising {beta}{sup +}-emitter for molecular imaging with intermediate half-life of 4 h. Due to the chemical similarity of Sc{sup 3+} to the Lu{sup 3+} and Y{sup 3+} cations, {sup 44}Sc-DOTA bioconjugates are expected to demonstrate similar properties in vivo as the {sup 177}Lu- and {sup 90}Y-bioconjugates, what is important in planning the radionuclide therapy. {sup 44}Sc can be obtained from the {sup 44}Ti/{sup 44}Sc generator. An alternative method for {sup 44}Sc production can be the irradiation of {sup 44}Ca target at small cyclotrons. The aim of our work was to optimize the parameters of {sup 44}CaCO{sub 3} irradiation and to develop a simple procedure for {sup 44}Sc separation from the calcium target. For optimization study, {sup 44}CaCO{sub 3} targets were irradiated by protons in the energy range of 5.6-17.5 MeV with 9 MeV being found to be the best energy for {sup 44}Ca irradiations. A simple and fast separation procedure of {sup 44}Sc from calcium target was developed using chelating resin Chelex 100. DOTATATE conjugate was successfully radiolabelled with high yield at elevated temperature using the produced {sup 44}Sc. While {sup 44}CaCO{sub 3} is relatively expensive, the cost of {sup 44}Sc-DOTATATE production can be reduced by target recovery. Due to low proton energy required to produce GBq activity level of {sup 44}Sc, the availability of {sup 44}Sc radioisotope could be enhanced to open new opportunities for applications in medical imaging. (orig.)

  20. Radiation Protection Section (SC/SL/RP)

    CERN Document Server

    2006-01-01

    We should like to inform you that the Radiation Protection Section (SC/SL/RP) located on the Prévessin site has moved from Building 865 (ground floor) to new premises in Wing A of Building 892 (second floor). Telephone numbers remain the same. SC/SL/RP section

  1. Cyclotron production of {sup 43}Sc for PET imaging

    Energy Technology Data Exchange (ETDEWEB)

    Walczak, Rafał [Institute of Nuclear Chemistry and Technology, Dorodna 16, 03-195 Warsaw (Poland); Krajewski, Seweryn [Synektik S.A., Research and Development Center, Warsaw (Poland); Szkliniarz, Katarzyna [Department of Nuclear Physics, University of Silesia, Katowice (Poland); Sitarz, Mateusz [Heavy Ion Laboratory, University of Warsaw, Warsaw (Poland); Abbas, Kamel [Nuclear Security Unit, Joint Research Centre, Institute for Transuranium Elements, European Commission, Ispra (Italy); Choiński, Jarosław; Jakubowski, Andrzej; Jastrzębski, Jerzy [Heavy Ion Laboratory, University of Warsaw, Warsaw (Poland); Majkowska, Agnieszka [Institute of Nuclear Chemistry and Technology, Dorodna 16, 03-195 Warsaw (Poland); Simonelli, Federica [Nuclear Decommissioning Unit, Joint Research Centre, Ispra Site Management Directorate, European Commission, Ispra (Italy); Stolarz, Anna; Trzcińska, Agnieszka [Heavy Ion Laboratory, University of Warsaw, Warsaw (Poland); Zipper, Wiktor [Department of Nuclear Physics, University of Silesia, Katowice (Poland); Bilewicz, Aleksander [Institute of Nuclear Chemistry and Technology, Dorodna 16, 03-195 Warsaw (Poland)

    2015-12-04

    Recently, significant interest in {sup 44}Sc as a tracer for positron emission tomography (PET) imaging has been observed. Unfortunately, the co-emission by {sup 44}Sc of high-energy γ rays (E{sub γ} = 1157, 1499 keV) causes a dangerous increase of the radiation dose to the patients and clinical staff. However, it is possible to produce another radionuclide of scandium—{sup 43}Sc—having properties similar to {sup 44}Sc but is characterized by much lower energy of the concurrent gamma emissions. This work presents the production route of {sup 43}Sc by α irradiation of natural calcium, its separation and purification processes, and the labeling of [DOTA,Tyr3] octreotate (DOTATATE) bioconjugate. Natural CaCO{sub 3} and enriched [{sup 40}Ca]CaCO{sub 3} were irradiated with alpha particles for 1 h in an energy range of 14.8–30 MeV at a beam current of 0.5 or 0.25 μA. In order to find the optimum method for the separation of {sup 43}Sc from irradiated calcium targets, three processes previously developed for {sup 44}Sc were tested. Radiolabeling experiments were performed with DOTATATE radiobioconjugate, and the stability of the obtained {sup 43}Sc-DOTATATE was tested in human serum. Studies of {sup nat}CaCO{sub 3} target irradiation by alpha particles show that the optimum alpha particle energies are in the range of 24–27 MeV, giving 102 MBq/μA/h of {sup 43}Sc radioactivity which creates the opportunity to produce several GBq of {sup 43}Sc. The separation experiments performed indicate that, as with {sup 44}Sc, due to the simplicity of the operations and because of the chemical purity of the {sup 43}Sc obtained, the best separation process is when UTEVA resin is used. The DOTATATE conjugate was labeled by the obtained {sup 43}Sc with a yield >98 % at elevated temperature. Tens of GBq activities of {sup 43}Sc of high radionuclidic purity can be obtainable for clinical applications by irradiation of natural calcium with an alpha beam.

  2. A semiclassical method in the theory of light scattering by semiconductor quantum dots

    International Nuclear Information System (INIS)

    Lang, I. G.; Korovin, L. I.; Pavlov, S. T.

    2008-01-01

    A semiclassical method is proposed for the theoretical description of elastic light scattering by arbitrary semiconductor quantum dots under conditions of size quantization. This method involves retarded potentials and allows one to dispense with boundary conditions for electric and magnetic fields. Exact results for the Umov-Poynting vector at large distances from quantum dots in the case of monochromatic and pulsed irradiation and formulas for differential scattering cross sections are obtained

  3. Simulation of a Local Collision of SC Wall Using High Energy Absorbing Steel

    Energy Technology Data Exchange (ETDEWEB)

    Yoo, H. K.; Chung, C. H.; Park, J.; Lee, J. W. [Dankook University, Yongin (Korea, Republic of); Kim, S. Y. [Korea Institute of Nuclear Safety, Daejeon (Korea, Republic of)

    2011-05-15

    Local damage evaluations for nuclear power plant(NPP) design are performed against turbine impact, tornado impact, airplane engine impact, etc., where turbine is a internal source of impact, whereas tornado and airplane engine are external sources of impact. The thickness of NPP wall structure is determined at initial design stage not to be penetrated by local impacts. This study investigated the local damage of NPP substructure against internal turbine impact. Simulation of local collisions of SC wall in NPP structure, which consists of two models: one using general steel and the other using high energy absorbing steel, were performed. The performance of SC wall using ductile high energy absorbing steel can be greatly improved on local collisions when compared with that of general steel

  4. Simulation of a Local Collision of SC Wall Using High Energy Absorbing Steel

    International Nuclear Information System (INIS)

    Yoo, H. K.; Chung, C. H.; Park, J.; Lee, J. W.; Kim, S. Y.

    2011-01-01

    Local damage evaluations for nuclear power plant(NPP) design are performed against turbine impact, tornado impact, airplane engine impact, etc., where turbine is a internal source of impact, whereas tornado and airplane engine are external sources of impact. The thickness of NPP wall structure is determined at initial design stage not to be penetrated by local impacts. This study investigated the local damage of NPP substructure against internal turbine impact. Simulation of local collisions of SC wall in NPP structure, which consists of two models: one using general steel and the other using high energy absorbing steel, were performed. The performance of SC wall using ductile high energy absorbing steel can be greatly improved on local collisions when compared with that of general steel

  5. Spinning cylinder experiments SC-I and SC-II: A review of results and analyses provided to the FALSIRE project

    International Nuclear Information System (INIS)

    Morland, E.; Sherry, A.H.

    1993-01-01

    A series of six large-scale experiments have been carried out at AEA Technology using the Spinning Cylinder test facility. Results from two of those experiments (SC-I and SC-II) have been provided to Project FALSIRE and are reviewed in this paper. The Spinning Cylinder tests were carried out using hollow cylinders of 1.4m outer diameter, 0.2m wall thickness and 1.3m length, containing full-length axial defects and fabricated from a modified A508 Class 3 steel. The first Spinning Cylinder test (SC-I) was an investigation of stable ductile growth induced via mechanical (primary) loading and under conditions of contained yielding. Mechanical loading was provided in the hoop direction by rotating the cylinder about its major axis within an enclosed oven. The second test (SC-II) investigated stable ductile growth under severe thermal shock (secondary) loading again under conditions of contained yielding. In this case thermal shock was produced by spraying cold water on the inside surface of the heated cylinder whilst it was rotating. For each experiment, results are presented in terms of a number of variables, eg. crack growth, temperature, stress, strain and applied K and J. In addition, an overview of the analyses of the FALSIRE Phase-1 report is also presented with respect to test SC-I and SC-II. 4 refs., 14 figs., 13 tabs

  6. Lamb shift in quantum electrodynamics (semiclassical theory)

    International Nuclear Information System (INIS)

    Blaive, B.; Boudet, R.

    1989-01-01

    This paper aims to bring some arguments to the proof of the Barut and Van Huele formula, which gives the Lamb shift in the semi-classical theory model: by shortening the calculation owing to the use of a decomposition of the self-potential of the electron; by eliminating the appeal to a divergent series; by bringing justifications and clarifications on some important points of the proof. The effective calculation of the coefficients of the formula is achieved for some of them, and the general analytical form of these coefficients is explicited. It is also proved that the B. and V.H. formula must give results at least as close to the experiment as those of the Bethe formula, which is obtained in Quantum Theory of Fields. Finally one shows that the B. and V.H. formula provides a justification de facto for the cut-off which is used for associating finite numbers to the divergent integrals of the Bethe formula [fr

  7. Effect of the Size of Al3(Sc,Zr) Precipitates on the Structure of Multi-Directionally Isothermally Forged Al-Mg-Sc-Zr Alloy

    Science.gov (United States)

    Sitdikov, O. Sh.; Avtokratova, E. V.; Mukhametdinova, O. E.; Garipova, R. N.; Markushev, M. V.

    2017-12-01

    The effect of Al3(Sc,Zr) dispersoids on the evolution of the cast Al-Mg-Sc-Zr alloy structure under multi-directional isothermal forging (MIF) has been investigated. The alloy, which has an equiaxed grain structure with a grain size of 25 μm and contains dispersoids 5-10 and 20-50 nm in size after onestage (at 360°C for 6 h) and two-stage (360°C for 6 h + 520°C for 1 h) annealing, respectively, was deformed at 325°C ( 0.65 T m) up to cumulative strains of e = 8.4. In the initial stages of MIF, new fine (sub)grains surrounded by low-angle and high-angle boundaries (HABs) were formed near the initial grain boundaries. With increasing strain, the volume fraction and misorientation of these crystallites increased, which led to the replacement of a coarse-grained structure with a fine-grained one with a grain size of 1.5-2.0 μm. Dynamic recrystallization occurred in accordance to a continuous mechanism and was controlled by the interaction of lattice dislocations and/or (sub)grain boundaries with dispersoids that effectively inhibited the migration of boundaries, as well as the rearrangement of lattice dislocations and their annihilation. The particle size and the density of their distribution significantly affected the parameters of the evolved structure; in an alloy with smaller particles, a structure with a smaller grain size and a larger HAB fraction developed.

  8. Classical trajectory perspective of atomic ionization in strong laser fields. Semiclassical modeling

    International Nuclear Information System (INIS)

    Liu, Jie

    2014-01-01

    Dealing with timely and interesting issues in strong laser physics. Illustrates complex strong field atomic ionization with the simple semiclassical model of classical trajectory perspective for the first time. Provides a theoretical model that can be used to account for recent experiments. The ionization of atoms and molecules in strong laser fields is an active field in modern physics and has versatile applications in such as attosecond physics, X-ray generation, inertial confined fusion (ICF), medical science and so on. Classical Trajectory Perspective of Atomic Ionization in Strong Laser Fields covers the basic concepts in this field and discusses many interesting topics using the semiclassical model of classical trajectory ensemble simulation, which is one of the most successful ionization models and has the advantages of a clear picture, feasible computing and accounting for many exquisite experiments quantitatively. The book also presents many applications of the model in such topics as the single ionization, double ionization, neutral atom acceleration and other timely issues in strong field physics, and delivers useful messages to readers with presenting the classical trajectory perspective on the strong field atomic ionization. The book is intended for graduate students and researchers in the field of laser physics, atom molecule physics and theoretical physics. Dr. Jie Liu is a professor of Institute of Applied Physics and Computational Mathematics, China and Peking University.

  9. Effective single chain antibody (scFv) concentrations in vivo via adenoviral vector mediated expression of secretory scFv

    NARCIS (Netherlands)

    Arafat, WO; Gomez-Navarro, J; Buchsbaum, DJ; Xiang, J; Casado, E; Barker, SD; Mahasreshti, PJ; Haisma, HJ; Barnes, MN; Siegal, GP; Alvarez, RD; Hemminki, A; Nettelbeck, DM; Curiel, DT

    Single chain antibodies (scFv) represent powerful interventional agents for the achievement of targeted therapeutics. The practical utility of these agents have been limited, however, by difficulties related to production of recombinant scFv and the achievement of effective and sustained levels of

  10. Hemoglobin C, S-C, and E Diseases

    Science.gov (United States)

    ... quickly than others, resulting in chronic anemia. Hemoglobin C disease Hemoglobin C disease occurs mostly in blacks. ... a common complication of hemoglobin C disease. Hemoglobin S-C disease Hemoglobin S-C disease occurs in people who ...

  11. Semiclassical Hybrid Approach to Condensed Phase Molecular Dynamics: Application to the I2Kr17 Cluster

    Czech Academy of Sciences Publication Activity Database

    Buchholz, M.; Goletz, Ch. M.; Grossman, F.; Schmidt, B.; Heyda, J.; Jungwirth, Pavel

    2012-01-01

    Roč. 116, č. 46 (2012), s. 11199-11210 ISSN 1089-5639 R&D Projects: GA ČR GBP208/12/G016 Institutional support: RVO:61388963 Keywords : semiclassical molecular dynamics * cluster * wavepacket * coherence * spectra Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 2.771, year: 2012

  12. Reflection at a complex potential barrier in the semiclassical theory of scattering

    International Nuclear Information System (INIS)

    Avishai, Y.; Knoll, J.

    1976-01-01

    The reflection of spherical waves at a complex potential barrier is discussed in the semiclassical approximation. We study the complex WKB method and the Uniform Approximation in the special case of weakly absorptive barriers, typical of surface transparent optical potentials used in heavy-ion reactions. It is found that the complex WKB results lead to a very accurate cross-section despite their inaccuracy in the most important phase shifts. Thereby, the amazing stamina of the WKB has been confirmed once more. (orig.) [de

  13. Gauge-invariant area distributions for semiclassical magnetotransport through ballistic nanostructures

    International Nuclear Information System (INIS)

    Wirtz, L.; Yang, Xiazhou; Burgdoerfer, J.E.

    1996-01-01

    Within the semiclassical theory of magnetotransport, conductance fluctuations in ballistic cavities are determined by distribution functions of directed areas enclose by classical paths. The authors calculate gauge invariant areas which can be visualized as closure of areas by adding a virtual path to the real path connecting the leads. Gauge invariance of the resulting area distribution is found to be important for geometry-sensitive non-universal properties of transport. The authors show that in the presence of direct paths both the area distribution and the two-point pair distribution function for areas of trajectories contribute. Comparison with recent data by Marcus et al. for a stadium-shaped nanostructure is made

  14. Dynamic plasma screening effects on semiclassical inelastic electron endash ion collisions in dense plasmas

    International Nuclear Information System (INIS)

    Jung, Y.

    1997-01-01

    In dense plasmas, dynamic plasma screening effects are investigated on 1s→2p dipole transition probabilities for electron-impact excitation of hydrogenic ions. The electron endash ion interaction potential is considered by introduction of the plasma dielectric function. A semiclassical straight-line trajectory method is applied to the path of the projectile electron in order to visualize the semiclassical transition probability as a function of the impact parameter, projectile energy, and plasma parameters. The transition probability including the dynamic plasma screening effect is always greater than that including the static plasma screening effect. When the projectile velocity is smaller than the electron thermal velocity, the dynamic polarization screening effect becomes the static plasma screening effect. When the projectile velocity is greater than the electron thermal velocity, then the interaction potential is almost unshielded. The difference between the dynamic and static plasma screening effects is more significant for low-energy projectiles. It is also found that the static plasma screening formula obtained by the Debye endash Hueckel model overestimates the plasma screening effects on the atomic excitation processes in dense plasmas. copyright 1997 American Institute of Physics

  15. Semi-classical approximation to path integrals - phases and catastrophes

    International Nuclear Information System (INIS)

    Levit, S.

    1977-01-01

    Problems of phases and catastrophes were encountered when trying to apply the classical S-matrix theory to the scattering phenomena in nuclear physics. The path integral formulation provided a suitable basis for the treatment of these and related problems. Within conventional mathematical language it was possible to give practical prescriptions and discuss their limitations. Since the semi-classical (stationary phase) approximation is commonly used in any application of the path integral method, the results are not restricted to the scattering problems and may be of general interest. The derivation of the uniform approximations in the energy representation should use the exact path integral expression as the starting point, rather than performing Fourier transforms on the expressions derived in the present lecture. (B.G.)

  16. Laguerre-Freud Equations for the Recurrence Coefficients of Some Discrete Semi-Classical Orthogonal Polynomials of Class Two

    Science.gov (United States)

    Hounga, C.; Hounkonnou, M. N.; Ronveaux, A.

    2006-10-01

    In this paper, we give Laguerre-Freud equations for the recurrence coefficients of discrete semi-classical orthogonal polynomials of class two, when the polynomials in the Pearson equation are of the same degree. The case of generalized Charlier polynomials is also presented.

  17. INCREASING OF THE EXPRESSION OF RECOMBINANT scFv-ANTIBODIES EFFICIENCY

    Directory of Open Access Journals (Sweden)

    O.V. Galkin

    2017-10-01

    Full Text Available Obtaining single-chain variable fragments (scFv of recombinant antibodies in E. coli cells is often associated with numerous problems causing low yields or inactive conformation of the product. The aim of this work was to study the influence of staphylococcal protein A fragment fused with scFv antibodies (SpA-tag on the efficiency of expression of final product. Examination of scFv antibodies of different origin and specificity has shown that in similar expression systems fused scFv is synthesized in much higher quantities than free scFv. Furthermore, the scFv antibodies in fused form retained their antigen-binding properties and the SpA fragment the ability to bind other immunoglobulins. Thus, the proposed strategy can be considered effective in improving the efficiency of scFv-antibodies production in E. coli cells.

  18. The semiclassical approximation for L- and M-shell coulomb ionization by heavy charged particles

    International Nuclear Information System (INIS)

    Kocbach, L.

    1975-08-01

    The semiclassical approximation with straight line trajectories is applied to the Coulomb ionization of K-, L- and M-shells by heavy charged particles. The calculational aspects are discussed in detail. Scaling relations for the experimentally relevant quantities are derived. The theoretical predictions are compared with experimental data. The relation of the present work to earlier SCA results and the PWBA results is discussed in detail. (auth)

  19. Fabrication and characterization of novel antimicrobial films derived from thymol-loaded zein-sodium caseinate (SC) nanoparticles.

    Science.gov (United States)

    Li, Kang-Kang; Yin, Shou-Wei; Yang, Xiao-Quan; Tang, Chuan-He; Wei, Zi-Hao

    2012-11-21

    The objective of this research was to fabricate novel antimicrobial films based on zein colloidal nanoparticles coated with sodium caseinate (SC), an emulsifier/stabilizer. Thymol-loaded zein-SC nanoparticles were prepared using an antisolvent technique, with the average particle size and zeta potential about 200 ± 20 nm and -40 mV, respectively. Zein-SC nanoparticle-based films exhibited higher mechanical resistance and water barrier capacity than the SC films and concomitant good extensibility as compared with zein films. Thymol loadings endowed zein-SC nanoparticle-based films with antimicrobial activity against Escherichia coli and Salmonella as well as DPPH radical scavenging activity. Water vapor permeability, microstructure, mechanical, and controlled release properties of the films were evaluated. The possible relationship between some selected physical properties and microstructure were also discussed. Atomic force microscopy (AFM) analysis indicated that thymol loadings resulted in the emergence phenomena of the nanoparticles to form large particles or packed structure, consisting of clusters of nanoparticles, within the film matrix, in a thymol loading dependent manner. The appearance of large particles or an agglomerate of particles may weaken the compactness of protein network of films and thus impair the water barrier capacity, mechanical resistance, and extensibility of the films. The release kinetics of thymol from nanoparticle-based films can be described as a two-step biphasic process, that is, an initial burst effect followed by subsequent slower release, and zein-SC nanoparticles within the films matrices gave them the ability to sustain the release of thymol. In addition, a schematic illustration of the formation pathway of zein-SC nanoparticle-based films with or without thymol was proposed to illuminate the possible relationship between some selected physical properties and the microstructure of the films.

  20. Fracture Initiation of an Inhomogeneous Shale Rock under a Pressurized Supercritical CO2 Jet

    Directory of Open Access Journals (Sweden)

    Yi Hu

    2017-10-01

    Full Text Available Due to the advantages of good fracture performance and the application of carbon capture and storage (CCS, supercritical carbon dioxide (SC-CO2 is considered a promising alternative for hydraulic fracturing. However, the fracture initiation mechanism and its propagation under pressurized SC-CO2 jet are still unknown. To address these problems, a fluid–structure interaction (FSI-based numerical simulation model along with a user-defined code was used to investigate the fracture initiation in an inhomogeneous shale rock. The mechanism of fracturing under the effect of SC-CO2 jet was explored, and the effects of various influencing factors were analyzed and discussed. The results indicated that higher velocity jets of SC-CO2 not only caused hydraulic-fracturing ring, but also resulted in the increase of stress in the shale rock. It was found that, with the increase of perforation pressure, more cracks initiated at the tip. In contrast, the length of cracks at the root decreased. The length-to-diameter ratio and the aperture ratio distinctly affected the pressurization of SC-CO2 jet, and contributed to the non-linear distribution and various maximum values of the stress in shale rock. The results proved that Weibull probability distribution was appropriate for analysis of the fracture initiation. The studied parameters explain the distribution of weak elements, and they affect the stress field in shale rock.

  1. PET imaging of 64Cu-DOTA-scFv-anti-PSMA lipid nanoparticles (LNPs): Enhanced tumor targeting over anti-PSMA scFv or untargeted LNPs

    International Nuclear Information System (INIS)

    Wong, Patty; Li, Lin; Chea, Junie; Delgado, Melissa K.; Crow, Desiree; Poku, Erasmus; Szpikowska, Barbara; Bowles, Nicole; Channappa, Divya; Colcher, David; Wong, Jeffrey Y.C.; Shively, John E.; Yazaki, Paul J.

    2017-01-01

    Introduction: Single chain (scFv) antibodies are ideal targeting ligands due to their modular structure, high antigen specificity and affinity. These monovalent ligands display rapid tumor targeting but have limitations due to their fast urinary clearance. Methods: An anti-prostate membrane antigen (PSMA) scFv with a site-specific cysteine was expressed and evaluated in a prostate cancer xenograft model by Cu-64 PET imaging. To enhance tumor accumulation, the scFv-cys was conjugated to the co-polymer DSPE-PEG-maleimide that spontaneously assembled into a homogeneous multivalent lipid nanoparticle (LNP). Results: The targeted LNP exhibited a 2-fold increase in tumor uptake compared to the scFv alone using two different thiol ester chemistries. The anti-PSMA scFv-LNP exhibited a 1.6 fold increase in tumor targeting over the untargeted LNP. Conclusions: The targeted anti-PSMA scFv-LNP showed enhanced tumor accumulation over the scFv alone or the untargeted DOTA-micelle providing evidence for the development of this system for drug delivery. Advances in knowledge and implications for patient care: Anti-tumor scFv antibody fragments have not achieved their therapeutic potential due to their fast blood clearance. Conjugation to an LNP enables multivalency to the tumor antigen as well as increased molecular size for chemotherapy drug delivery.

  2. A Further Study of the Products of Sc and Dioxygen Reactions

    Science.gov (United States)

    Bauschlicher, Charles W., Jr.; Zhou, Mingfei; Andrews, Lester; Johnson, J. R. Tobias; Panas, Itai; Snis, Anders; Roos, Bjoern O.; Arnold, James O. (Technical Monitor)

    1999-01-01

    The products of the reaction of Sc and dioxygen have been reinvestigated. By adding the electron-trapping molecule CC14, additional information about the IR spectra has been obtained, as well as the observation of new bands. New ab initio calculations are also performed on possible products of the Sc plus O2 reaction. The previously observed band at 722.5 per cm is assigned as the b2 mode of ScO2(-). Bands arising from ScO(+), Sc(O2)(+), and(O2)ScO are also assigned. We are still unable to assign any bands to OScO. The problems associated with the computational study of ScO2 are discussed.

  3. An evaluation of safety culture initiatives at BNSF Railway

    Science.gov (United States)

    2015-04-01

    Major safety culture (SC) initiatives initiated in the FRA Office of Research, Technology and Development (RT&D), such as Clear Signal for Action (CSA), the Investigation of Safety Related Occurrences Protocol (ISROP), the Participative Safety Rules ...

  4. Synthesis and Isolation of the Titanium-Scandium Endohedral Fullerenes-Sc2 TiC@Ih -C80 , Sc2 TiC@D5h -C80 and Sc2 TiC2 @Ih -C80 : Metal Size Tuning of the Ti(IV) /Ti(III) Redox Potentials.

    Science.gov (United States)

    Junghans, Katrin; Ghiassi, Kamran B; Samoylova, Nataliya A; Deng, Qingming; Rosenkranz, Marco; Olmstead, Marilyn M; Balch, Alan L; Popov, Alexey A

    2016-09-05

    The formation of endohedral metallofullerenes (EMFs) in an electric arc is reported for the mixed-metal Sc-Ti system utilizing methane as a reactive gas. Comparison of these results with those from the Sc/CH4 and Ti/CH4 systems as well as syntheses without methane revealed a strong mutual influence of all key components on the product distribution. Whereas a methane atmosphere alone suppresses the formation of empty cage fullerenes, the Ti/CH4 system forms mainly empty cage fullerenes. In contrast, the main fullerene products in the Sc/CH4 system are Sc4 C2 @C80 (the most abundant EMF from this synthesis), Sc3 C2 @C80 , isomers of Sc2 C2 @C82 , and the family Sc2 C2 n (2 n=74, 76, 82, 86, 90, etc.), as well as Sc3 CH@C80 . The Sc-Ti/CH4 system produces the mixed-metal Sc2 TiC@C2 n (2 n=68, 78, 80) and Sc2 TiC2 @C2 n (2 n=80) clusterfullerene families. The molecular structures of the new, transition-metal-containing endohedral fullerenes, Sc2 TiC@Ih -C80 , Sc2 TiC@D5h -C80 , and Sc2 TiC2 @Ih -C80 , were characterized by NMR spectroscopy. The structure of Sc2 TiC@Ih -C80 was also determined by single-crystal X-ray diffraction, which demonstrated the presence of a short Ti=C double bond. Both Sc2 TiC- and Sc2 TiC2 -containing clusterfullerenes have Ti-localized LUMOs. Encapsulation of the redox-active Ti ion inside the fullerene cage enables analysis of the cluster-cage strain in the endohedral fullerenes through electrochemical measurements. © 2016 The Authors. Published by Wiley-VCH Verlag GmbH & Co. KGaA.

  5. Energy Levels, wavelengths and hyperfine structure measurements of Sc II

    Science.gov (United States)

    Hala, Fnu; Nave, Gillian

    2018-01-01

    Lines of singly ionized Scandium (Sc II) along with other Iron group elements have been observed [1] in the region surrounding the massive star Eta Carinae [2,3] called the strontium filament (SrF). The last extensive analysis of Sc II was the four-decade old work of Johansson & Litzen [4], using low-resolution grating spectroscopy. To update and extend the Sc II spectra, we have made observation of Sc/Ar, Sc/Ne and Sc/Ge/Ar hollow cathode emission spectrum on the NIST high resolution FT700 UV/Vis and 2 m UV/Vis/IR Fourier transform spectrometers (FTS). More than 850 Sc II lines have been measured in the wavelength range of 187 nm to 3.2 μm. connecting a total of 152 energy levels. The present work also focuses to resolve hyperfine structure (HFS) in Sc II lines. We aim to obtain accurate transition wavelengths, improved energy levels and HFS constants of Sc II. The latest results from work in progress will be presented.Reference[1] Hartman H, Gull T, Johansson S and Smith N 2004 Astron. Astrophys. 419 215[2] Smith N, Morse J A and Gull T R 2004 Astrophys. J. 605 405[3] Davidson K and Humphreys R M 1997 Annu. Rev. Astron. Astrophys. 35[4] Johansson S and Litzén U 1980 Phys. Scr. 22 49

  6. Sc-Decorated WS_2 Nanoribbons as Hydrogen Storage Media

    International Nuclear Information System (INIS)

    Xu Bin; Wang Yu-Sheng; Zhang Jing; Song Na-Hong; Li Meng; Yi Lin

    2016-01-01

    The hydrogen storage behavior of Sc-decorated WS_2 monolayer and WS_2 nanoribbons is systematically studied by using first principles calculations based on the density functional theory. The present results indicate that an Sc-decorated WS_2 monolayer is not suitable for storing hydrogen due to the weak interaction between the monolayer WS_2 sheet and the Sc atoms. It is found that both the hybridization mechanism and the Coulomb attraction make the Sc atoms stably adsorb on the edges of WS_2 nanoribbons without clustering. The 2Sc/WS_2 NRs system can adsorb at most eight H_2 molecules with average adsorption energy of 0.20 eV/H_2. The results show that the desorption of H_2 is possible by lowering the pressure or by increasing the temperature. (paper)

  7. CORRELATION BETWEEN SEED TESTS AND FIELD EMERGENCE OF TWO MAIZE HYBRIDS (SC704 AND SC500)

    OpenAIRE

    A.A. ALILOO; B. SHOKATI

    2011-01-01

    Early emergence and stand establishment of maize (Zea mays L.) are considered to be the most important yield-contributing factors. The influence of seed vigor on these factors is vital. Therefore, five laboratory tests and field experiment were conducted on basis of a randomized complete block design (RCBD) with five replications in 2011, to evaluate the correlation among the seed vigor tests and field emergence of two maize hybrids (SC704 and SC500). In laboratory tests, differences between ...

  8. Semiclassical approach to finite-temperature quantum annealing with trapped ions

    Science.gov (United States)

    Raventós, David; Graß, Tobias; Juliá-Díaz, Bruno; Lewenstein, Maciej

    2018-05-01

    Recently it has been demonstrated that an ensemble of trapped ions may serve as a quantum annealer for the number-partitioning problem [Nat. Commun. 7, 11524 (2016), 10.1038/ncomms11524]. This hard computational problem may be addressed by employing a tunable spin-glass architecture. Following the proposal of the trapped-ion annealer, we study here its robustness against thermal effects; that is, we investigate the role played by thermal phonons. For the efficient description of the system, we use a semiclassical approach, and benchmark it against the exact quantum evolution. The aim is to understand better and characterize how the quantum device approaches a solution of an otherwise difficult to solve NP-hard problem.

  9. Depletion of Arabidopsis SC35 and SC35-like serine/arginine-rich proteins affects the transcription and splicing of a subset of genes.

    Science.gov (United States)

    Yan, Qingqing; Xia, Xi; Sun, Zhenfei; Fang, Yuda

    2017-03-01

    Serine/arginine-rich (SR) proteins are important splicing factors which play significant roles in spliceosome assembly and splicing regulation. However, little is known regarding their biological functions in plants. Here, we analyzed the phenotypes of mutants upon depleting different subfamilies of Arabidopsis SR proteins. We found that loss of the functions of SC35 and SC35-like (SCL) proteins cause pleiotropic changes in plant morphology and development, including serrated leaves, late flowering, shorter roots and abnormal silique phyllotaxy. Using RNA-seq, we found that SC35 and SCL proteins play roles in the pre-mRNA splicing. Motif analysis revealed that SC35 and SCL proteins preferentially bind to a specific RNA sequence containing the AGAAGA motif. In addition, the transcriptions of a subset of genes are affected by the deletion of SC35 and SCL proteins which interact with NRPB4, a specific subunit of RNA polymerase II. The splicing of FLOWERING LOCUS C (FLC) intron1 and transcription of FLC were significantly regulated by SC35 and SCL proteins to control Arabidopsis flowering. Therefore, our findings provide mechanistic insight into the functions of plant SC35 and SCL proteins in the regulation of splicing and transcription in a direct or indirect manner to maintain the proper expression of genes and development.

  10. Semiclassical approximations for a momentum dependent one-body potential

    International Nuclear Information System (INIS)

    Dworzecka, M.; Moszkowski, S.A.

    1976-08-01

    Recently a semiclassical approximation was applied by Jennings, et al., for a system of noninteracting fermions in a local one-body potential. This is a way to calculate shell corrections alternative to Strutinsky's method. This method was generalized to a spherical but a momentum dependent potential of the form, V(r) + 1 / 2 (p 2 W(r) + W(r)p 2 ). Explicit expressions are developed for the number of particles and the smooth sum of single particle energies in terms of the Fermi energy and the one-body potential and its first two derivatives. They are calculated for selected values of the parameters and compared with the sum of single particle energies obtained by numerical solution of the Schroedinger equation. The difference between the two is evidently the shell correction

  11. The semiclassical coherent state propagator in the Weyl representation

    International Nuclear Information System (INIS)

    Braun, Carol; Li, Feifei; Garg, Anupam; Stone, Michael

    2015-01-01

    It is shown that the semiclassical coherent state propagator takes its simplest form when the quantum mechanical Hamiltonian is replaced by its Weyl symbol in defining the classical action, in that there is then no need for a Solari-Kochetov correction. It is also shown that such a correction exists if a symbol other than the Weyl symbol is chosen and that its form is different depending on the symbol chosen. The various forms of the propagator based on different symbols are shown to be equivalent provided the correspondingly correct Solari-Kochetov correction is included. All these results are shown for both particle and spin coherent state propagators. The global anomaly in the fluctuation determinant is further elucidated by a study of the connection between the discrete fluctuation determinant and the discrete Jacobi equation

  12. DiSC-OPAL

    DEFF Research Database (Denmark)

    Kemal, Mohammed Seifu; Pedersen, Rasmus; Iov, Florin

    2017-01-01

    of such systems. The simulation tool should be able to model Electrical Grid and flexible assets with different time scales and resolution levels fulfilling specific functionalities. In this paper DiSC-OPAL, an OPAL-RT compatible toolbox library for modelling of assets is presented. The library is suitable...

  13. New indides Sc{sub 6}Co{sub 2.18}In{sub 0.82}, Sc{sub 10}Ni{sub 9}In{sub 19.44} and ScCu{sub 4}In-synthesis, structure, and crystal chemistry

    Energy Technology Data Exchange (ETDEWEB)

    Zaremba, R.I.; Rodewald, U. Ch.; Poettgen, R. [Inst. fuer Anorganische und Analytische Chemie, Westfaelische Wilhelms-Univ. Muenster (Germany); Kalychak, Y.M.; Zaremba, V.I. [Inorganic Chemistry Dept., Ivan Franko National Univ. of Lviv, Lviv (Ukraine)

    2006-08-15

    New indides Sc{sub 6}Co{sub 2.18}In{sub 0.82}, Sc{sub 10}Ni{sub 9}In{sub 19.44} and ScCu{sub 4}In have been synthesized from the elements by arc-melting. Single crystals were grown by special annealing modes. The thee indides were investigated via X-ray powder and single crystal diffraction: Ho{sub 6}Co{sub 2}Ga type, Immm, a = 886.7(3), b = 878.0(2), c = 932.1(3) pm, wR2 = 0.0517, 711 F{sup 2} values, 35 variables for Sc{sub 6}Co{sub 2.18}In{sub 0.82}, Ho{sub 10}Ni{sub 9}In{sub 20} type, P4/nmm, a = 1287.5(2), c = 884.7(1) pm, wR2 = 0.0642, 1221 F{sup 2} values, 63 variables for Sc{sub 10}Ni{sub 9}In{sub 19.44}, and MgCu{sub 4}Sn type, anti F 43m, a = 704.03(7) pm, wR2 = 0.0267, 101 F{sup 2} values, and 7 variables for ScCu{sub 4}In. The scandium rich indide Sc{sub 6}Co{sub 2.18}In{sub 0.82} contains two Co{sub 2} dumb-bells at Co-Co distances of 221 and 230 pm. Each cobalt atom within these dumb-bells has a tricapped trigonal prismatic coordination. The In1 site has a distorted cube-like coordination by scandium and shows a mixed occupancy (36%) with cobalt. The In2 atoms have distorted icosahedral scandium coordination. As a consequence of the small size of the scandium atoms, the In4 site in Sc{sub 10}Ni{sub 9}In{sub 19.44} shows defects and was furthermore refined with a split model leading to a new distorted variant within the family of Ho{sub 10}Ni{sub 9}In{sub 20} compounds. ScCu{sub 4}In is an ordered version of the cubic Laves phase with scandium and indium atoms in the CN16 voids of the copper substructure. The Cu-Cu distances within the three-dimensional network of corner-sharing tetrahedra are 248.6 and 249.2 pm. The crystal chemical peculiarities of these three indide structures are briefly discussed. (orig.)

  14. PET Imaging of 64Cu-DOTA-scFv-Anti-PSMA Lipid Nanoparticles (LNPs): Enhanced Tumor Targeting over Anti-PSMA scFv or Untargeted LNPs

    Science.gov (United States)

    Wong, Patty; Li, Lin; Chea, Junie; Delgado, Melissa K.; Crow, Desiree; Poku, Erasmus; Szpikowska, Barbara; Bowles, Nicole; Channappa, Divya; Colcher, David; Wong, Jeffrey Y.C.; Shively, John E.; Yazaki, Paul J.

    2017-01-01

    Introduction Single chain (scFv) antibodies are ideal targeting ligands due to their modular structure, high antigen specificity and affinity. These monovalent ligands display rapid tumor targeting but have limitations due to their fast urinary clearance. Methods An anti-prostate membrane antigen (PSMA) scFv with a site-specific cysteine was expressed and evaluated in a prostate cancer xenograft model by Cu-64 PET imaging. To enhance tumor accumulation, the scFv-cys was conjugated to the co-polymer DSPE-PEG-maleimide that spontaneously assembled into a homogeneous multivalent lipid nanoparticle (LNP). Results The targeted LNP exhibited a 2-fold increase in tumor uptake compared to the scFv alone using two different thiol ester chemistries. The anti-PSMA scFv-LNP exhibited a 1.6 fold increase in tumor targeting over the untargeted LNP. Conclusions The targeted anti-PSMA scFv-LNP showed enhanced tumor accumulation over the scFv alone or the untargeted DOTA-micelle providing evidence for the development of this system for drug delivery. Advances in Knowledge and implications for patient care Anti-tumor scFv antibody fragments have not achieved their therapeutic potential due to their fast blood clearance. Conjugation to a LNP enables multivalency to the tumor antigen as well as increased molecular size for chemotherapy drug delivery. PMID:28126683

  15. Molecular and functional characterization of peptidoglycan-recognition protein SC2 (PGRP-SC2) from Nile tilapia (Oreochromis niloticus) involved in the immune response to Streptococcus agalactiae.

    Science.gov (United States)

    Gan, Zhen; Chen, Shannan; Hou, Jing; Huo, Huijun; Zhang, Xiaolin; Ruan, Baiye; Laghari, Zubair Ahmed; Li, Li; Lu, Yishan; Nie, Pin

    2016-07-01

    PGRP-SC2, the member of PGRP family, plays an important role in regulation of innate immune response. In this paper, a PGRP-SC2 gene of Nile tilapia, Oreochromis niloticus (designated as On-PGRP-SC2) was cloned and its expression pattern under the infection of Streptococcus agalactiae was investigated. Sequence analysis showed main structural features required for amidase activity were detected in the deduced amino acid sequence of On-PGRP-SC2. In healthy tilapia, the On-PGRP-SC2 transcripts could be detected in all the examined tissues, with the most abundant expression in the muscle. When infected with S. agalactiae, there was a clear time-dependent expression pattern of On-PGRP-SC2 in the spleen, head kidney and brain. The assays for the amidase activity suggested that recombinant On-PGRP-SC2 protein had a Zn(2+)-dependent PGN-degrading activity. Moreover, our works showed that recombinant On-PGRP-SC2 protein could significantly reduce bacterial load in target organs attacked by S. agalactiae. These findings indicated that On-PGRP-SC2 may play important roles in the immune response to S. agalactiae in Nile tilapia. Copyright © 2016 Elsevier Ltd. All rights reserved.

  16. Development of SC structure modularization in Nuclear Power Plant

    International Nuclear Information System (INIS)

    Mun, Taeyoup

    2008-01-01

    New Focus on NPP are Rising Concerns on Global Warming, Potential energy crisis (geo-political), Improved reliability and safety of nuclear power plant, Advent of Generation 3+ NPP technology and Economical Energy Resource. New NPPs are 6 units in Korea and 23 in Asia being built, 32 units being planned in China by 2020 (150 by 2050), 10 units being planned in US by 2020 and IAEA expects $200 billions on NPP construction next 25 years (up to 30% of total world energy). □ SC(Steel Plate Concrete) structure · Steel Plate is used as a Structural Element instead of Reinforcing Bars in RC · SC structure consists of Steel Plate with Headed Studs. Connected by Tie-bars - The Primary Purpose of Tie-bars is to Stiffen and Hold Together the Plates during Construction Process - Headed Studs are Welded to the Inside of Steel Plate for composite action □ Benefits of SC Structure · Shorten Construction Duration for Re bar, Forming and Scaffolding Works · Minimize Site Labors · Improve the Construction Quality · Enable Construction Sites to be kept Clean □ SC Modularization · Fit for Modular Construction for Structural Features · Fit for Modular Construction for Structural Features · Inattentively Effective for Integrated Modules · Pre-fabrication, Pre-assembly and Modularization □ Project Overview · Project Name: Development of SC structure for Modularization in NPP · Project Type: Electric Power Industry R and D (Ministry of Knowledge Economy) · Duration: Sep. 2005 ∼ Aug. 2008 (36 Months) · Research Team and Scopes - Project Management: Korea Hydro and Nuclear Power Company (KHNP) - Development of Code and Standards for SC Structure: Korea Society of Steel Construction (KSSC) Korea Electric Power Research Institute (KEPRI) - Development of SC Structural Analysis and Design: Korea Power Engineering Company (KOPEC) - Development of Construction Techniques for SC Modularization: KHNP, Korea Institute of Nuclear Safety(KINS), KOPEC □ Performance

  17. Pascal-SC a computer language for scientific computation

    CERN Document Server

    Bohlender, Gerd; von Gudenberg, Jürgen Wolff; Rheinboldt, Werner; Siewiorek, Daniel

    1987-01-01

    Perspectives in Computing, Vol. 17: Pascal-SC: A Computer Language for Scientific Computation focuses on the application of Pascal-SC, a programming language developed as an extension of standard Pascal, in scientific computation. The publication first elaborates on the introduction to Pascal-SC, a review of standard Pascal, and real floating-point arithmetic. Discussions focus on optimal scalar product, standard functions, real expressions, program structure, simple extensions, real floating-point arithmetic, vector and matrix arithmetic, and dynamic arrays. The text then examines functions a

  18. Screening of synthetic phage display scFv libraries yields competitive ligands of human leptin receptor.

    Science.gov (United States)

    Molek, Peter; Vodnik, Miha; Strukelj, Borut; Bratkovič, Tomaž

    2014-09-26

    Initially considered the main endogenous anorexigenic factor, fat-derived leptin turned out to be a markedly pleiotropic hormone, influencing diverse physiological processes. Moreover, hyperleptinemia in obese individuals has been linked to the onset or progression of serious disorders, such as cancer, autoimmune diseases, and atherosclerosis, and antagonizing peripheral leptin's signalization has been shown to improve these conditions. To develop an antibody-based leptin antagonist we have devised a tailored panning procedure and screened two phage display libraries of single chain variable antibody fragments (scFvs) against recombinant leptin receptor. One of the scFvs was expressed in Escherichia coli and its interaction with leptin receptor was characterized in more detail. It was found to recognize a discontinuous epitope and to compete with leptin for receptor binding with IC50 and Kd values in the nanomolar range. The reported scFv represents a lead for development of leptin antagonists that may ultimately find use in therapy of various hyperleptinemia-related disorders. Copyright © 2014 Elsevier Inc. All rights reserved.

  19. Thermodynamic modeling of the Sc-Zn system coupled with first-principles calculation

    Directory of Open Access Journals (Sweden)

    Tang C.

    2012-01-01

    Full Text Available The Sc-Zn system has been critically reviewed and assessed by means of CALPHAD (CALculation of PHAse Diagram approach. By means of first-principles calculation, the enthalpies of formation at 0 K for the ScZn, ScZn2, Sc17Zn58, Sc3Zn17 and ScZn12 have been computed with the desire to assist thermodynamic modeling. A set of self-consistent thermodynamic parameters for the Sc-Zn system is then obtained. The calculated phase diagram and thermodynamic properties agree well with the experimental data and first-principles calculations, respectively.

  20. Application of semiclassical and geometrical optics theories to resonant modes of a coated sphere.

    Science.gov (United States)

    Bambino, Túlio M; Breitschaft, Ana Maria S; Barbosa, Valmar C; Guimarães, Luiz G

    2003-03-01

    This work deals with some aspects of the resonant scattering of electromagnetic waves by a metallic sphere covered by a dielectric layer, in the weak-absorption approximation. We carry out a geometrical optics treatment of the scattering and develop semiclassical formulas to determine the positions and widths of the system resonances. In addition, we show that the mean lifetime of broad resonances is strongly dependent on the polarization of the incident light.

  1. Semiclassical theory of electronically nonadiabatic chemical dynamics: Incorporation of the Zhu-Nakamura theory into the frozen Gaussian propagation method

    International Nuclear Information System (INIS)

    Kondorskiy, A.; Nakamura, H.

    2004-01-01

    The title theory is developed by combining the Herman-Kluk semiclassical theory for adiabatic propagation on single potential-energy surface and the semiclassical Zhu-Nakamura theory for nonadiabatic transition. The formulation with use of natural mathematical principles leads to a quite simple expression for the propagator based on classical trajectories and simple formulas are derived for overall adiabatic and nonadiabatic processes. The theory is applied to electronically nonadiabatic photodissociation processes: a one-dimensional problem of H 2 + in a cw (continuous wave) laser field and a two-dimensional model problem of H 2 O in a cw laser field. The theory is found to work well for the propagation duration of several molecular vibrational periods and wide energy range. Although the formulation is made for the case of laser induced nonadiabatic processes, it is straightforwardly applicable to ordinary electronically nonadiabatic chemical dynamics

  2. Lifetime and g-factor measurements in 44Sc

    International Nuclear Information System (INIS)

    Chevallier, A.; Chavallier, J.; Gross, J.L.; Haas, B.; Schulz, N.; Styczen, J.; Toulemonde, M.

    1975-01-01

    The lifetimes of the 235 keV, 2 - state and 350 keV, 4 + state in 44 Sc have been measured via the 44 Ca(p, n) 44 Sc reaction with a pulsed proton beam. The time integral perturbed angular distribution technique with an external field was used to measure the precession angles of the 2 - and 4 + states populated by the 30 Si( 16 O, pnγ) 44 Sc reaction. The following values for the mean-lives and g-factors were obtained: π(2 - ) = 8.83(33) ns, g(2 - ) = 0.30(13) and π(4 + ) = 4.52(27)ns, g(4 + ) = 0.90(12). The results for the 2 - state support a rotational description of the negative parity states in 44 Sc. The magnetic moment of the 4 + state is compared to shell model predictions. (orig.) [de

  3. Electronic structure and local distortions in epitaxial ScGaN films

    International Nuclear Information System (INIS)

    Knoll, S M; Zhang, S; Rovezzi, M; Joyce, T B; Moram, M A

    2014-01-01

    High energy resolution fluorescence-detected x-ray absorption spectroscopy and density functional theory calculations were used to investigate the local bonding and electronic structure of Sc in epitaxial wurtzite-structure Sc x Ga 1−x N films with x ≤ 0.059. Sc atoms are found to substitute for Ga atoms, accompanied by a local distortion involving an increase in the internal lattice parameter u around the Sc atoms. The local bonding and electronic structure at Sc are not affected strongly by the strain state or the defect microstructure of the films. These data are consistent with theoretical predictions regarding the electronic structure of dilute Sc x Ga 1−x N alloys. (paper)

  4. Semiclassical asymptotic behavior and the rearrangement mechanisms for Coulomb particles

    International Nuclear Information System (INIS)

    Bogdanov, A.V.; Gevorkyan, A.S.; Dubrovskii, G.V.

    1986-01-01

    The semiclassical asymptotic behavior of the eikonal amplitude of the resonance rearrangement in a system of three Coulomb particles is studied. It is shown that the general formula for the amplitude correctly describes two classical mechanisms (pickup and knockout) and one nonclassical mechanism (stripping). The classical mechanisms predominate at high energies, while the stripping mechanism predominates at lower energies. In the region of medium energies the dominant mechanism is the pickup (or Thomas) mechanism, which is realized by nonclassical means. For such transitions the classical cross section diverges, and the amplitude must be computed on a complex trajectory. The physical reasons for introducing the approximate complex trajectories are discussed. The contributions of all the mechanisms to the rearrangement cross section are found in their analytic forms

  5. Frozen and broken color: a matrix Schroedinger equation in the semiclassical limit

    International Nuclear Information System (INIS)

    Orbach, H.S.

    1981-01-01

    We consider the case of frozen color, i.e, where global color symmetry remains exact, but where colored states have a mass large compared to color-singlet mesons. Using semiclassical WKB formalism, we construct the spectrum of bound states. In order to determine the charge of the constituents, we then consider deep-inelastic scattering of an external probe (e.g., lepton) from our one-dimensional meson. We calculate explicitly the structure function, W, in the WKB limit and show how Lipkin's mechanism is manifested, as well as how scaling behavior comes. We derive the WKB formalism as a special case of a method of obtaining WKB type solutions for generalized Schroedinger equations for which the Hamiltonian is an arbitrary matrix function of any number of pairs of canonical operators. We generalize these considerations to the case of broken color symmetry - but where the breaking is not so strong as to allow low-lying states to have a large amount of mixing with the colored states. In this case, the degeneracy of excited colored states can be broken. We find that local excitation of color guarantees global excitation of color; i.e., if at a given energy colored semiclassical states can be constructed with size comparable to that of the ground state wave function, colored states of that energy will also exist in the spectrum of the full theory and will be observed. However, global existence of color does not guarantee the excitation of colored states via deep-inelastic processes

  6. Pure state condition for the semi-classical Wigner function

    International Nuclear Information System (INIS)

    Ozorio de Almeida, A.M.

    1982-01-01

    The Wigner function W(p,q) is a symmetrized Fourier transform of the density matrix e(q 1 ,q 2 ), representing quantum-mechanical states or their statistical mixture in phase space. Identification of these two alternatives in the case of density matrices depends on the projection identity e 2 = e; its Wigner correspondence is the pure state condition. This criterion is applied to the Wigner functions botained from standard semiclassical wave functions, determining as pure states those whose classical invariant tori satisfy the generalized Bohr-Sommerfeld conditions. Superpositions of eigenstates are then examined and it is found that the Wigner function corresponding to Gaussian random wave functions are smoothed out in the manner of mixedstate Wigner functions. Attention is also given to the pure-state condition in the case where an angular coordinate is used. (orig.)

  7. Hydroxyurea decreases hospitalizations in pediatric patients with Hb SC and Hb SB+ thalassemia

    Directory of Open Access Journals (Sweden)

    Lebensburger JD

    2015-12-01

    Full Text Available Jeffrey D Lebensburger, Rakeshkumar J Patel, Prasannalaxmi Palabindela, Christina J Bemrich-Stolz, Thomas H Howard, Lee M HilliardDivision of Pediatric Hematology Oncology, University of Alabama at Birmingham, Birmingham, AL, USAPurpose: Patients with hemoglobin SC (Hb SC and hemoglobin SB+ (Hb SB+ thalassemia suffer from frequent hospitalizations yet strong evidence of a clinical benefit of hydroxyurea (HU in this population is lacking. Patients with recurrent hospitalizations for pain crisis are offered HU at our institution based on small cohort data and anecdotal benefit. This study identifies outcomes from a large cohort of patients with Hb SC and SB+ thalassemia who were treated with HU for 2 years.Materials and methods: A retrospective review was conducted of 32 patients with Hb SC and SB+ thalassemia who were treated with HU. We reviewed the number, and reasons for hospitalization in the 2 years prior to, and 2 years post-HU treatment as well as laboratory changes from baseline, over 1 year.Results: Patients with Hb SC and SB+ thalassemia started on HU for frequent pain, had a significant reduction in hospitalizations over 2 years as compared to the 2 years prior to HU initiation (mean total hospitalizations/year: pre-HU: 1.6 vs post-HU 0.4 hospitalizations, P<0.001; mean pain hospitalizations/year: pre-HU 1.5 vs post-HU 0.3 hospitalizations, P<0.001. Patients demonstrated hematologic changes including an increase in percent fetal hemoglobin (%HbF pre–post HU (4.5% to 7.7%, P=0.002, mean corpuscular volume (74 to 86 fL, P<0,0001, and decrease in absolute neutrophil count (5.0 to 3.2×109/L, P=0.007. Patients with higher doses of HU demonstrated the greatest reduction in hospitalizations but this was unrelated to absolute neutrophil count.Conclusion: This cohort of patients with Hb SC and SB+ thalassemia provides additional support for using HU in patients with recurrent hospitalizations for pain. A large randomized multicenter trial of

  8. Effects of hydroxyurea treatment for patients with hemoglobin SC disease.

    Science.gov (United States)

    Luchtman-Jones, Lori; Pressel, Sara; Hilliard, Lee; Brown, R Clark; Smith, Mary G; Thompson, Alexis A; Lee, Margaret T; Rothman, Jennifer; Rogers, Zora R; Owen, William; Imran, Hamayun; Thornburg, Courtney; Kwiatkowski, Janet L; Aygun, Banu; Nelson, Stephen; Roberts, Carla; Gauger, Cynthia; Piccone, Connie; Kalfa, Theodosia; Alvarez, Ofelia; Hassell, Kathryn; Davis, Barry R; Ware, Russell E

    2016-02-01

    Although hemoglobin SC (HbSC) disease is usually considered less severe than sickle cell anemia (SCA), which includes HbSS and HbS/β(0) -thalassemia genotypes, many patients with HbSC experience severe disease complications, including vaso-occlusive pain, acute chest syndrome, avascular necrosis, retinopathy, and poor quality of life. Fully 20 years after the clinical and laboratory efficacy of hydroxyurea was proven in adult SCA patients, the safety and utility of hydroxyurea treatment for HbSC patients remain unclear. Recent NHLBI evidence-based guidelines highlight this as a critical knowledge gap, noting HbSC accounts for ∼30% of sickle cell patients within the United States. To date, only 5 publications have reported short-term, incomplete, or conflicting laboratory and clinical outcomes of hydroxyurea treatment in a total of 71 adults and children with HbSC. We now report on a cohort of 133 adult and pediatric HbSC patients who received hydroxyurea, typically for recurrent vaso-occlusive pain. Hydroxyurea treatment was associated with a stable hemoglobin concentration; increased fetal hemoglobin (HbF) and mean corpuscular volume (MCV); and reduced white blood cell count (WBC), absolute neutrophil count (ANC), and absolute reticulocyte count (ARC). Reversible cytopenias occurred in 22% of patients, primarily neutropenia and thrombocytopenia. Painful events were reduced with hydroxyurea, more in patients >15 years old. These multicenter data support the safety and potentially salutary effects of hydroxyurea treatment for HbSC disease; however, a multicenter, placebo-controlled, Phase 3 clinical trial is needed to determine if hydroxyurea therapy has efficacy for patients with HbSC disease. © 2015 Wiley Periodicals, Inc.

  9. Low-temperature VRH conduction through complex materials in the presence of a temperature-dependent voltage threshold: A semi-classical percolative approach

    International Nuclear Information System (INIS)

    Sen, A.K.; Bhattacharya, S.

    2006-12-01

    In this paper, we study the variation of low temperature (T) dc conductance, G(T), of a semi-classical percolative Random Resistor cum Tunneling-bond Network (RRTN), in the presence of a linearly temperature-dependent microscopic voltage threshold, υ g (T). This model (proposed by our group in the early 90's) considers a phenomenological semi-classical tunneling (or, hopping through a barrier) process. Just as in our previous constant-υ g case, we find in the present study also that the variable range hopping (VRH) exponent γ varies continuously with the ohmic concentration p in a non-monotonic fashion. In addition, we observe a new shoulder-like behaviour of G(T) in the intermediate temperature range, below the conductance maximum. (author)

  10. Design of SC walls and slabs for impulsive loading

    Energy Technology Data Exchange (ETDEWEB)

    Varma, Amit H. [Purdue Univ., West Lafayette, IN (United States)

    2015-11-11

    Reinforced concrete (RC) structures have historically been the preferred choice for blast resistant structures because of their mass and the ductility provided by steel reinforcement. Steel-plate composite (SC) walls are a viable alternative to RC for protecting the infrastructure against explosive threats. SC structures consist of two steel faceplates with a plain concrete core between them. The steel faceplates are anchored to the concrete using stud anchors and connected to each other using tie bars. SC structures provide mass from the concrete infill and ductility from the continuous external steel faceplates. This dissertation presents findings and recommendations from experimental and analytical investigations of the performance of SC walls subjected to far-field blast loads.

  11. LOCAL COLLISION SIMULATION OF AN SC WALL USING ENERGY ABSORBING STEEL

    Directory of Open Access Journals (Sweden)

    CHUL-HUN CHUNG

    2013-08-01

    Full Text Available This study evaluates the local damage of a turbine in an auxiliary building of a nuclear power plant due to an external impact by using the LS-DYNA finite element program. The wall of the auxiliary building is SC structure and the material of the SC wall plate is high manganese steel, which has superior ductility and energy absorbance compared to the ordinary steel used for other SC wall plates. The effects of the material of the wall, collision speed, and angle on the magnitude of the local damage were evaluated by local collision analysis. The analysis revealed that the SC wall made of manganese steel had significantly less damage than the SC wall made of ordinary steel. In conclusion, an SC wall made of manganese steel can have higher effective resistance than an SC wall made of ordinary steel against the local collision of an airplane engine or against a turbine impact.

  12. Local Collision Simulation of an SC Wall Using Energy Absorbing Steel

    Energy Technology Data Exchange (ETDEWEB)

    Chung, Chulhun; Choi, Hyun; Park, Jaegyun [Dankook Univ., Yongin (Korea, Republic of)

    2013-08-15

    This study evaluates the local damage of a turbine in an auxiliary building of a nuclear power plant due to an external impact by using the LS-DYNA finite element program. The wall of the auxiliary building is SC structure and the material of the SC wall plate is high manganese steel, which has superior ductility and energy absorbance compared to the ordinary steel used for other SC wall plates. The effects of the material of the wall, collision speed, and angle on the magnitude of the local damage were evaluated by local collision analysis. The analysis revealed that the SC wall made of manganese steel had significantly less damage than the SC wall made of ordinary steel. In conclusion, an SC wall made of manganese steel can have higher effective resistance than an SC wall made of ordinary steel against the local collision of an airplane engine or against a turbine impact.

  13. The quantum N-body problem in the mean-field and semiclassical regime.

    Science.gov (United States)

    Golse, François

    2018-04-28

    The present work discusses the mean-field limit for the quantum N -body problem in the semiclassical regime. More precisely, we establish a convergence rate for the mean-field limit which is uniform as the ratio of Planck constant to the action of the typical single particle tends to zero. This convergence rate is formulated in terms of a quantum analogue of the quadratic Monge-Kantorovich or Wasserstein distance. This paper is an account of some recent collaboration with C. Mouhot, T. Paul and M. Pulvirenti.This article is part of the themed issue 'Hilbert's sixth problem'. © 2018 The Author(s).

  14. Dirac particle in a plane wave field and the semi-classical approximation

    Energy Technology Data Exchange (ETDEWEB)

    Bourouaine, S. [Department of Physics, Faculty of Sciences, Mentouri University, Constantine (Algeria)

    2005-04-01

    In this paper we investigate the influence of photon represented by plane wave field on Dirac particle in the context of path integral approach given by Fradkin and Gitman formalism. In our case, although the action relative to Dirac particle in plane wave field seems to be non quadratic, the result obtained by semi-classical approach is the same as that found by an exact calculation. Hence; when we add the plane wave field to any quadratic actions related to Fradkin and Gitman approach, the total action behaves like quadratic. (Abstract Copyright [2005], Wiley Periodicals, Inc.)

  15. Semiclassical series solution of the generalized phase shift atom--diatom scattering equations

    International Nuclear Information System (INIS)

    Squire, K.R.; Curtiss, C.F.

    1980-01-01

    A semiclassical series solution of the previously developed operator form of the generalized phase shift equations describing atom--diatom scattering is presented. This development is based on earlier work which led to a double series in powers of Planck's constant and a scaling parameter of the anisotropic portion of the intermolecular potential. The present solution is similar in that it is a double power series in Planck's constant and in the difference between the spherical radial momentum and a first order approximation. The present series solution avoids difficulties of the previous series associated with the classical turning point

  16. Dirac particle in a plane wave field and the semi-classical approximation

    International Nuclear Information System (INIS)

    Bourouaine, S.

    2005-01-01

    In this paper we investigate the influence of photon represented by plane wave field on Dirac particle in the context of path integral approach given by Fradkin and Gitman formalism. In our case, although the action relative to Dirac particle in plane wave field seems to be non quadratic, the result obtained by semi-classical approach is the same as that found by an exact calculation. Hence; when we add the plane wave field to any quadratic actions related to Fradkin and Gitman approach, the total action behaves like quadratic. (Abstract Copyright [2005], Wiley Periodicals, Inc.)

  17. Quadratic Zeeman spectra for the hydrogen atom by means of semiclassical quantization

    International Nuclear Information System (INIS)

    Hasegawa, Hiroshi; Adachi, Satoshi

    1988-01-01

    The elliptic cylindrical coordinates of type I adapted to the Fock hypersphere in momentum space of the Kepler motion and their canonical momenta are used to construct an analytic form of the classical action integrals which yield an adequate parametrization of the KAM (Kolmogorov-Arnold-Moser) tori of the Kepler trajectories weakly perturbed by a uniform magnetic field. The semiclassical quantization formula so provided presents a prototype of the exact EBK (Einstein-Brillouin-Keller) quantization scheme, and the resulting quantized energies vs the magnetic field strength correspond to the quadratic Zeeman spectra of each Rydberg multiplet lifted by the perturbation. (author)

  18. Semiclassical derivation of a local optical potential for heavy-ion elastic scattering. [Coupling to other processes

    Energy Technology Data Exchange (ETDEWEB)

    Donangelo, R; Canto, L F [Rio de Janeiro Univ. (Brazil). Inst. de Fisica; Hussein, M S [Sao Paulo Univ. (Brazil). Inst. de Fisica

    1979-05-21

    A semiclassical method to determine the contribution to the optical potential in the elastic channel due to the coupling to other processes taking place in heavy-ion collisions is developed. An application is made to the case of Coulomb excitation. The lowest-order term of the potential used is shown to be identical to the potential derived by Baltz et al.

  19. The semiclassical approximation in the local theory of resonance inelastic interaction of slow electrons with molecules

    International Nuclear Information System (INIS)

    Kazansky, A.K.

    1984-01-01

    The semiclassical approach is developed to calculate the cross sections of vibrational excitation and dissociative attachment for diatomic molecules within the framework of the 'boomerang model'. The formulae obtained reveal the energy dependence of the cross sections on the parameters of the system. Numerical calculations for N 2 , CO, H 2 , HD and D 2 confirm the high accuracy of the method. (author)

  20. Atomic bonding and mechanical properties of Al-Mg-Zr-Sc alloy

    Institute of Scientific and Technical Information of China (English)

    高英俊; 班冬梅; 韩永剑; 钟夏平; 刘慧

    2004-01-01

    The valence electron structures of Al-Mg alloy with minor Sc and Zr were calculated according to the empirical electron theory(EET) in solid. The results show that because of the strong interaction of Al atom with Zr and Sc atom in melting during solidification, the Al3 Sc and Al3 (Sc1-xZrx) particles which act as heterogeneous nuclear are firstly crystallized in alloy to make grains refine. In progress of solidification, the Al-Sc, Al-Zr-Sc segregation regions are formed in solid solution matrix of Al-Mg alloy owing to the strong interaction of Al atom with Zr, Scatoms in bulk of alloy, so in the following homogenization treatment, the finer dispersed Al3 Sc and Al3 (Sc1-x Zrx) second-particles which are coherence with the matrix are precipitated in the segregation region. These finer second particles with the strong Al-Zr, Al-Sc covalent bonds can strengthen the covalent bonds in matrix of the alloy, and also enhance the hardness and strength of Al-Mg alloy. Those finer second-particles precipitated in interface of sub-grains can also strengthen the covalence bonds there, and effectively hinder the interface of sub-grains from migrating and restrain the sub-grains from growing, and cause better thermal stability of Al-Mg alloy.

  1. Microstructure evolution of the 1469 Al–Cu–Li–Sc alloy during homogenization

    Energy Technology Data Exchange (ETDEWEB)

    Jia, Min, E-mail: jm_lushan@163.com; Zheng, Ziqiao, E-mail: csu1469@163.com; Gong, Zhu, E-mail: start123gz@163.com

    2014-11-25

    Highlights: • The formation of the W phase (AlCuSc) was found in the 1469 Al-Cu–Li–Sc alloy. • The W phase formed during the homogenization process. • We model the formation process of the W phase. • The formation of the W phase consumes lots of Cu and Sc atoms. - Abstract: The present work aims to clarify the formation of the W phase (AlCuSc) and its formation time in the high Cu content alloy with Sc addition. The microstructure evolution during the two-step homogenization annealing process was investigated in the 1469 Al–Cu–Li–Sc alloy. No evidences of the Al{sub 3}Sc phase and the W phase were found in the solidification structure. The arrays of the W phases were found to form after homogenization. The AlCu phases with traces of Sc that formed during solidification suppose to be the precursor of the W phases, and then transform into the W phases by consuming the Sc atoms that fixed in the supersaturate solid solution. The formation of the W phase inhibits the precipitation of the Al{sub 3}Sc phase. A corresponding model of the W phase formation mechanism is proposed.

  2. On the semi-classical limit of scalar products of the XXZ spin chain

    Energy Technology Data Exchange (ETDEWEB)

    Jiang, Yunfeng; Brunekreef, Joren [Institut für Theoretische Physik, ETH Zürich,Wolfgang Pauli Strasse 27, CH-8093 Zürich (Switzerland)

    2017-03-03

    We study the scalar products between Bethe states in the XXZ spin chain with anisotropy |Δ|>1 in the semi-classical limit where the length of the spin chain and the number of magnons tend to infinity with their ratio kept finite and fixed. Our method is a natural yet non-trivial generalization of similar methods developed for the XXX spin chain. The final result can be written in a compact form as a contour integral in terms of Faddeev’s quantum dilogarithm function, which in the isotropic limit reduces to the classical dilogarithm function.

  3. On the semi-classical limit of scalar products of the XXZ spin chain

    International Nuclear Information System (INIS)

    Jiang, Yunfeng; Brunekreef, Joren

    2017-01-01

    We study the scalar products between Bethe states in the XXZ spin chain with anisotropy |Δ|>1 in the semi-classical limit where the length of the spin chain and the number of magnons tend to infinity with their ratio kept finite and fixed. Our method is a natural yet non-trivial generalization of similar methods developed for the XXX spin chain. The final result can be written in a compact form as a contour integral in terms of Faddeev’s quantum dilogarithm function, which in the isotropic limit reduces to the classical dilogarithm function.

  4. Semiclassical approach to Regge poles trajectories calculations for nonsingular potentials: Thomas-Fermi type

    International Nuclear Information System (INIS)

    Belov, S M; Avdonina, N B; Felfli, Z; Marletta, M; Msezane, A Z; Naboko, S N

    2004-01-01

    A simple semiclassical approach, based on the investigation of anti-Stokes line topology, is presented for calculating Regge poles for nonsingular (Thomas-Fermi type) potentials, namely potentials with singularities at the origin weaker than order -2. The anti-Stokes lines for Thomas-Fermi potentials have a more complicated structure than those of singular potentials and require careful application of complex analysis. The explicit solution of the Bohr-Sommerfeld quantization condition is used to obtain approximate Regge poles. We introduce and employ three hypotheses to obtain several terms of the Regge pole approximation

  5. Development of SC structure modularization in Nuclear Power Plant

    Energy Technology Data Exchange (ETDEWEB)

    Mun, Taeyoup [Korea Hydro and Nuclear Power Co., Ltd., Seoul (Korea, Republic of)

    2008-04-15

    New Focus on NPP are Rising Concerns on Global Warming, Potential energy crisis (geo-political), Improved reliability and safety of nuclear power plant, Advent of Generation 3+ NPP technology and Economical Energy Resource. New NPPs are 6 units in Korea and 23 in Asia being built, 32 units being planned in China by 2020 (150 by 2050), 10 units being planned in US by 2020 and IAEA expects $200 billions on NPP construction next 25 years (up to 30% of total world energy). {open_square} SC(Steel Plate Concrete) structure {center_dot} Steel Plate is used as a Structural Element instead of Reinforcing Bars in RC {center_dot} SC structure consists of Steel Plate with Headed Studs. Connected by Tie-bars - The Primary Purpose of Tie-bars is to Stiffen and Hold Together the Plates during Construction Process - Headed Studs are Welded to the Inside of Steel Plate for composite action {open_square} Benefits of SC Structure {center_dot} Shorten Construction Duration for Re bar, Forming and Scaffolding Works {center_dot} Minimize Site Labors {center_dot} Improve the Construction Quality {center_dot} Enable Construction Sites to be kept Clean {open_square} SC Modularization {center_dot} Fit for Modular Construction for Structural Features {center_dot} Fit for Modular Construction for Structural Features {center_dot} Inattentively Effective for Integrated Modules {center_dot} Pre-fabrication, Pre-assembly and Modularization {open_square} Project Overview {center_dot} Project Name: Development of SC structure for Modularization in NPP {center_dot} Project Type: Electric Power Industry R and D (Ministry of Knowledge Economy) {center_dot} Duration: Sep. 2005 {approx} Aug. 2008 (36 Months) {center_dot} Research Team and Scopes - Project Management: Korea Hydro and Nuclear Power Company (KHNP) - Development of Code and Standards for SC Structure: Korea Society of Steel Construction (KSSC) Korea Electric Power Research Institute (KEPRI) - Development of SC Structural Analysis and Design

  6. Lightweight hydrogen-storage material Mg0.65Sc0.35D2 studied with 2H and 2H–{45Sc} MAS NMR exchange spectroscopy

    NARCIS (Netherlands)

    Srinivasan, S.; Magusin, P.C.M.M.

    2011-01-01

    Using double-quantum 2H MAS NMR with 45Sc recoupling and Bloch–Siegert compensated 2H–{45Sc} TRAPDOR we have identified the overlapping NMR signals of deuterium with and without scandium neighbors in Mg0.65Sc0.35D2, a candidate lightweight material for hydrogen storage. At room temperature we also

  7. Role of cell death in the propagation of PrP(Sc) in immune cells.

    Science.gov (United States)

    Takahashi, Kenichi; Inoshima, Yasuo; Ishiguro, Naotaka

    2015-03-01

    A number of studies have suggested that macrophages, dendritic cells, and follicular dendritic cells play an important role in the propagation of PrP(Sc). Both accumulation and proteolysis of PrP(Sc) have been demonstrated in peripheral macrophages. Macrophages may act as reservoirs for PrP(Sc) particles if the cells die during transient PrP(Sc) propagation. However, whether cell death plays a role in PrP(Sc) propagation in macrophages remains unclear. In this study, we investigated the possibility of propagation and transmission of PrP(Sc) between dead immune cells and living neural cells. We found that under specific conditions, transient PrP(Sc) propagation occurs in dead cells, indicating that interaction between PrP(C) and PrP(Sc) on plasma membrane lipid rafts might be important for PrP(Sc) propagation. Co-culturing of killed donor PrP(Sc)-infected macrophages with recipient N2a-3 neuroblastoma cells accelerated PrP(Sc) transmission. Our results suggest that cell death may play an important role in PrP(Sc) propagation, whereas transient PrP(Sc) propagation in macrophages has little effect on PrP(Sc) transmission.

  8. CERN Technical Training 2004: New Short Courses (SC) on Microsoft Outlook

    CERN Multimedia

    Monique Duval

    2004-01-01

    The CERN Technical Training programme is now proposing a new format for courses on Microsoft Outlook. Three two-hours Short Courses (SC) will cover basic and advanced functionalities of the recommended mail client for email at CERN. Each module can be followed independently. The next scheduled sessions will take place as follows: Outlook (SC I): E-mail. Next session: 22.10.2004 (9h00-11h00) Outlook (SC II): Calendar, Tasks and Notes. Next session: 22.10.2004 (14h00-16h00) Outlook (SC III): Meetings and Delegation. Next session: 9.11.2004 (14h00-16h00) In particular, SC I will cover how to open, create and send email, work with attachments, use stationery, organise mail, and work with the address book, SC II will show how to work with the calendar, tasks and notes, and SC III will cover how to organise and manage meetings, work with meeting requests, share tasks, and use email and calendar delegation. The number of participants to each session is limited to 8. The instructor is English-French bilingual, and...

  9. One-Step Partially Purified Lipases (ScLipA and ScLipB from Schizophyllum commune UTARA1 Obtained via Solid State Fermentation and Their Applications

    Directory of Open Access Journals (Sweden)

    Yew Chee Kam

    2017-12-01

    Full Text Available Lipases with unique characteristics are of value in industrial applications, especially those targeting cost-effectiveness and less downstream processes. The aims of this research were to: (i optimize the fermentation parameters via solid state fermentation (SSF; and (ii study the performance in hydrolysis and esterification processes of the one-step partially purified Schizophyllum commune UTARA1 lipases. Lipase was produced by cultivating S. commune UTARA1 on sugarcane bagasse (SB with used cooking oil (UCO via SSF and its production was optimized using Design-Expert® 7.0.0. Fractions 30% (ScLipA and 70% (ScLipB which contained high lipase activity were obtained by stepwise (NH42SO4 precipitation. Crude fish oil, coconut oil and butter were used to investigate the lipase hydrolysis capabilities by a free glycerol assay. Results showed that ScLipA has affinities for long, medium and short chain triglycerides, as all the oils investigated were degraded, whereas ScLipB has affinities for long chain triglycerides as it only degrades crude fish oil. During esterification, ScLipA was able to synthesize trilaurin and triacetin. Conversely, ScLipB was specific towards the formation of 2-mono-olein and triacetin. From the results obtained, it was determined that ScLipA and ScLipB are sn-2 regioselective lipases. Hence, the one-step partial purification strategy proved to be feasible for partial purification of S. commune UTARA1 lipases that has potential use in industrial applications.

  10. Baculovirus display of single chain antibody (scFv using a novel signal peptide

    Directory of Open Access Journals (Sweden)

    Gonzalez Gaëlle

    2010-11-01

    Full Text Available Abstract Background Cells permissive to virus can become refractory to viral replication upon intracellular expression of single chain fragment variable (scFv antibodies directed towards viral structural or regulatory proteins, or virus-coded enzymes. For example, an intrabody derived from MH-SVM33, a monoclonal antibody against a conserved C-terminal epitope of the HIV-1 matrix protein (MAp17, was found to exert an inhibitory effect on HIV-1 replication. Results Two versions of MH-SVM33-derived scFv were constructed in recombinant baculoviruses (BVs and expressed in BV-infected Sf9 cells, N-myristoylation-competent scFvG2/p17 and N-myristoylation-incompetent scFvE2/p17 protein, both carrying a C-terminal HA tag. ScFvG2/p17 expression resulted in an insoluble, membrane-associated protein, whereas scFvE2/p17 was recovered in both soluble and membrane-incorporated forms. When coexpressed with the HIV-1 Pr55Gag precursor, scFvG2/p17 and scFvE2/p17 did not show any detectable negative effect on virus-like particle (VLP assembly and egress, and both failed to be encapsidated in VLP. However, soluble scFvE2/p17 isolated from Sf9 cell lysates was capable of binding to its specific antigen, in the form of a synthetic p17 peptide or as Gag polyprotein-embedded epitope. Significant amounts of scFvE2/p17 were released in the extracellular medium of BV-infected cells in high-molecular weight, pelletable form. This particulate form corresponded to BV particles displaying scFvE2/p17 molecules, inserted into the BV envelope via the scFv N-terminal region. The BV-displayed scFvE2/p17 molecules were found to be immunologically functional, as they reacted with the C-terminal epitope of MAp17. Fusion of the N-terminal 18 amino acid residues from the scFvE2/p17 sequence (N18E2 to another scFv recognizing CD147 (scFv-M6-1B9 conferred the property of BV-display to the resulting chimeric scFv-N18E2/M6. Conclusion Expression of scFvE2/p17 in insect cells using a BV

  11. IEC SC15E: Report on liaison activities of CIGRÉ-SC15

    DEFF Research Database (Denmark)

    Henriksen, Mogens

    2000-01-01

    WG’s activities under CIGRÉ SC15:WG 15.01 - Fluid impregnated systems.WG 15.02 - Dielectric Liquids.WG 15.03 - Gas Insulation.WG 15.04 - Outdoor Insulation.WG 15.05 - Capacitors.WG 15.07 - Solid Insulating Materials for Rotating Machines.WG 15/33.08 - Insulation Monitoring and Life Estimation. WG...

  12. Laser photoelectron spectrometry of Sc- and Y-

    International Nuclear Information System (INIS)

    Feigerle, C.S.; Herman, Z.; Lineberger, W.C.

    1981-01-01

    The photoelectron spectra of Sc - and Y - have been obtained in a crossed ion- and laser-beam experiment. Analysis of the Sc - spectrum yields two bound terms of 3d4s 2 4p configuration ( 1 D 0 and 3 D 0 ), with EA(Sc) = 0.189 +- 0.020 eV and an excited-state binding energy of 0.042 +- 0.020 eV. Similarly, the (4d5s 2 5p) 1 D 0 ground state of Y - is bound by 0.308 +- 0.012 eV and a (4d5s 2 5p) 3 D 0 excited term is bound by 0.165 +- 0.025 eV. With the determination of the bound electronic configuration of Sc - as 3d4s 2 4p, the order of filling of electron shells of the first transition series negative ions is found to be 4s 2 ep, 3d4s 2 4p, the order of filling of electron shells of the first transition series negative ions is found to be 4s 2 4p, 3d4s 2 4p, followed by 3dsup(k) 4s 2 (k = 3, 4, ..., 10). (orig.)

  13. The SC gets ready for visitors

    CERN Multimedia

    Antonella Del Rosso

    2012-01-01

    Hall 300, which houses the Synchrocyclotron (SC), CERN’s first accelerator, is getting ready to host a brand-new exhibition. The site will be one of the stops on the new visit itineraries that will be inaugurated for the 2013 CERN Open Day.   The Synchrocyclotron through the years. Just as it did in the late 1950s, when the accelerator was first installed, the gigantic red structure of the Synchrocyclotron's magnet occupies a large part of the 300-square-metre hall. “We have completed the first phase of the project that will give the SC a new lease of life,” says Marco Silari, the project leader and a member of CERN’s Radiation Protection Group. “We have removed all the equipment that was not an integral part of the accelerator. The hall is now ready for the civil-engineering work that will precede the installation of the exhibition.” The SC was witness to a big part of the history of CERN. The accelerator produced ...

  14. On the evaluation of semiclassical nuclear many-particle many-hole level densities

    International Nuclear Information System (INIS)

    Blin, A.H.; Hiller, B.; Schuck, P.; Yannouleas, C.

    1985-10-01

    An exact general scheme is described to calculate the m-particle n-hole fermion level densities for an arbitrary single particle Hamiltonian taking into account the Pauli exclusion principle. This technique is applied to obtain level densities of the three dimensional isotropic harmonic oscillator semiclassically in the Thomas-Fermi approach. In addition, we study the l-particle l-hole level density of the Woods-Saxon potential. For the harmonic oscillator we analyze the temperature dependence of the linear response function and the influence of pairing correlations on the l-particle l-hole level density. Finally, a Taylor expansion method of the m-particle n-hole level densities is discussed

  15. Semiclassical corrections to the interaction energy of a hard-sphere Boltzmann gas

    Energy Technology Data Exchange (ETDEWEB)

    Bhaduri, R K [Department of Physics and Astronomy, McMaster University, Hamilton, L8S 4M1 (Canada); Dijk, W van [Department of Physics and Astronomy, McMaster University, Hamilton, L8S 4M1 (Canada); Srivastava, M K [Institute Instrumentation Center, IIT, Roorkee 247 667 (India)

    2006-11-01

    Quantum effects in statistical mechanics are important when the thermal wavelength is of the order of, or greater than, the mean interatomic spacing. This is examined in depth taking the example of a hard-sphere Boltzmann gas. Using the virial expansion for the equation of state, it is shown that the interaction energy of a classical hard-sphere gas is exactly zero. When the (second) virial coefficient of such a gas is obtained quantum mechanically, however, the quantum contribution to the interaction energy is shown to be substantial. The importance of the semiclassical corrections to the interaction energy shows up dramatically in such a system.

  16. Semiclassical corrections to the interaction energy of a hard-sphere Boltzmann gas

    International Nuclear Information System (INIS)

    Bhaduri, R K; Dijk, W van; Srivastava, M K

    2006-01-01

    Quantum effects in statistical mechanics are important when the thermal wavelength is of the order of, or greater than, the mean interatomic spacing. This is examined in depth taking the example of a hard-sphere Boltzmann gas. Using the virial expansion for the equation of state, it is shown that the interaction energy of a classical hard-sphere gas is exactly zero. When the (second) virial coefficient of such a gas is obtained quantum mechanically, however, the quantum contribution to the interaction energy is shown to be substantial. The importance of the semiclassical corrections to the interaction energy shows up dramatically in such a system

  17. CERN Technical Training 2004: New Short Courses (SC) on Microsoft Outlook

    CERN Multimedia

    Monique Duval

    2004-01-01

    The CERN Technical Training programme is now proposing a new format for courses on Microsoft Outlook. Three two-hours Short Courses (SC) will cover basic and advanced functionalities of the recommended mail client for email at CERN. Each module can be followed independently. The next scheduled sessions will take place as follows: Outlook (SC I): E-mail. Next session: 31.8.2004 (9h00-11h00) Outlook (SC II): Calendar, Tasks and Notes. Next session: 31.8.2004 (14h00-16h00) Outlook (SC III): Meetings and Delegation. Next session: 7.9.2004 (14h00-16h00) In particular, SC I will cover how to open, create and send email, work with attachments, use stationery, organise mail, and work with the address book, SC II will show how to work with the calendar, tasks and notes, and SC III will cover how to organise and manage meetings, work with meeting requests, share tasks, and use email and calendar delegation. The number of participants to each session is limited to 8. The instructor is English-French bilingual, and she...

  18. Semiclassical Path Integral Calculation of Nonlinear Optical Spectroscopy.

    Science.gov (United States)

    Provazza, Justin; Segatta, Francesco; Garavelli, Marco; Coker, David F

    2018-02-13

    Computation of nonlinear optical response functions allows for an in-depth connection between theory and experiment. Experimentally recorded spectra provide a high density of information, but to objectively disentangle overlapping signals and to reach a detailed and reliable understanding of the system dynamics, measurements must be integrated with theoretical approaches. Here, we present a new, highly accurate and efficient trajectory-based semiclassical path integral method for computing higher order nonlinear optical response functions for non-Markovian open quantum systems. The approach is, in principle, applicable to general Hamiltonians and does not require any restrictions on the form of the intrasystem or system-bath couplings. This method is systematically improvable and is shown to be valid in parameter regimes where perturbation theory-based methods qualitatively breakdown. As a test of the methodology presented here, we study a system-bath model for a coupled dimer for which we compare against numerically exact results and standard approximate perturbation theory-based calculations. Additionally, we study a monomer with discrete vibronic states that serves as the starting point for future investigation of vibronic signatures in nonlinear electronic spectroscopy.

  19. Polymorphous GdScO3 as high permittivity dielectric

    International Nuclear Information System (INIS)

    Schäfer, A.; Rahmanizadeh, K.; Bihlmayer, G.; Luysberg, M.; Wendt, F.; Besmehn, A.; Fox, A.

    2015-01-01

    Four different polymorphs of GdScO 3 are assessed theoretically and experimentally with respect to their suitability as a dielectric. The calculations carried out by density functional theory reveal lattice constants, band gaps and the energies of formation of three crystal phases. Experimentally all three crystal phases and the amorphous phase can be realized as thin films by pulsed laser deposition using various growth templates. Their respective crystal structures are confirmed by X-ray diffraction and transmission electron microscopy reflecting the calculated lattice constants. X-ray photoelectron spectroscopy unveils the band gaps of the different polymorphs of GdScO 3 which are above 5 eV for all films demonstrating good insulating properties. From capacitance voltage measurements, high permittivities of up to 27 for hexagonal GdScO 3 are deduced. - Highlights: • Different epitaxial polymorph phases of GdScO 3 were grown by pulsed laser deposition. • The cubic phase of GdScO 3 is reported for the first time. • All phases are proven to be useful for the use in silicon based and III–V based microelectronic devices.

  20. Piezoelectric coefficients and spontaneous polarization of ScAlN

    International Nuclear Information System (INIS)

    Caro, Miguel A; Laurila, Tomi; Zhang, Siyuan; Moram, Michelle A; Riekkinen, Tommi; Ylilammi, Markku; Molarius, Jyrki; Lopez-Acevedo, Olga

    2015-01-01

    We present a computational study of spontaneous polarization and piezoelectricity in Sc x Al 1−x N alloys in the compositional range from x = 0 to x = 0.5, obtained in the context of density functional theory and the Berry-phase theory of electric polarization using large periodic supercells. We report composition-dependent values of piezoelectric coefficients e ij , piezoelectric moduli d ij and elastic constants C ij . The theoretical findings are complemented with experimental measurement of e 33 for a series of sputtered ScAlN films carried out with a piezoelectric resonator. The rapid increase with Sc content of the piezoelectric response reported in previous studies is confirmed for the available data. A detailed description of the full methodology required to calculate the piezoelectric properties of ScAlN, with application to other complex alloys, is presented. In particular, we find that the large amount of internal strain present in ScAlN and its intricate relation with electric polarization make configurational sampling and the use of large supercells at different compositions necessary in order to accurately derive the piezoelectric response of the material. (paper)

  1. The SC15 protein of Schizophyllum commune mediates formation of aerial hyphae and attachment in the absence of the SC3 hydrophobin

    NARCIS (Netherlands)

    Lugones, L G; de Jong, J F; de Vries, O M H; Jalving, R; Dijksterhuis, J; Wösten, H A B

    Disruption of the SC3 gene in the basidiomycete Schizophyllum commune affected not only formation of aerial hyphae but also attachment to hydrophobic surfaces. However, these processes were not completely abolished, indicating involvement of other molecules. We here show that the SC15 protein

  2. FRACTIONAL RECRYSTALLIZATION KINETICS IN DIRECTLY COLD ROLLED Al-Mg, Al-Mg-Sc AND Al-Mg-Sc-Zr ALLOY

    Directory of Open Access Journals (Sweden)

    M. S. Kaiser

    2014-12-01

    Full Text Available The evaluation of texture as a function of recrystallization has been characterized for directly cold rolled Al-6Mg, Al-6Mg-0.4Sc and Al-6Mg-0.4Sc-0.2Zr alloys. Samples were annealed isothermally at 400 °C for 1 to 240 minutes to allow recrystallization. Recrystallization kinetics of the alloys is analyzed from the micro-hardness variation. Isothermally annealed samples of aluminum alloys were also studied using JMAK type analysis to see if there exists any correlation between the methods. Recrystallization fraction behavior between two methods the scandium added alloys show the higher variation due to precipitation hardening and higher recrystallization behavior. The scandium and zirconium as a combined shows the more variation due to formation of Al3(Sc, Zr precipitate. From the microstructure it is also observed that the base Al-Mg alloy attained almost fully re-crystallized state after annealing at 400 °C for 60 minutes

  3. Creep properties and precipitate evolution in Al-Li alloys microalloyed with Sc and Yb

    Energy Technology Data Exchange (ETDEWEB)

    Krug, Matthew E. [Department of Materials Science and Engineering, Northwestern University, 2220 Campus Drive, Evanston, IL 60208 (United States); Seidman, David N. [Department of Materials Science and Engineering, Northwestern University, 2220 Campus Drive, Evanston, IL 60208 (United States); Northwestern Center for Atom Probe Tomography, Northwestern University, 2220 Campus Drive, Evanston, IL 60208 (United States); Dunand, David C., E-mail: dunand@northwestern.edu [Department of Materials Science and Engineering, Northwestern University, 2220 Campus Drive, Evanston, IL 60208 (United States)

    2012-07-30

    Highlights: Black-Right-Pointing-Pointer We examine the creep behavior of Al-alloys with Li and rare earth element additions. Black-Right-Pointing-Pointer These alloys exhibit threshold stresses below which no measurable creep occurs. Black-Right-Pointing-Pointer Larger precipitate size and lattice parameter mismatch increase creep resistance. Black-Right-Pointing-Pointer A simple parameter describes the threshold stress behavior in ternary Al-Sc-X alloys. Black-Right-Pointing-Pointer The findings are explained by a recent model of dislocation-precipitate interactions. - Abstract: A dilute Al-Sc alloy (Al-0.12 Sc, at.%, Al-Sc), its counterpart with a Li addition (Al-2.9 Li-0.11 Sc, at.%, Al-Li-Sc), as well as a quaternary alloy (Al-5.53 Li-0.048 Sc-0.009 Yb, at.%, Al-Li-Sc-Yb) were isothermally aged at 325 Degree-Sign C, and in some cases isochronally aged to 450 Degree-Sign C. As the {alpha} Prime -Al{sub 3}(Li,Sc) and Al{sub 3}(Li,Sc,Yb) precipitates, with L1{sub 2} structure, coarsen in the two Li-containing alloys, their Li and Yb concentrations decrease and their Sc concentration increases. A significant interfacial excess of Li also segregates at the {alpha}-Al matrix/{alpha} Prime -Al{sub 3}Sc(Li,Sc,Yb) precipitate interface: 5.99 {+-} 0.05 atoms nm{sup -2} in Al-Li-Sc and 13.2 {+-} 0.4 atoms nm{sup -2} in Al-Li-Sc-Yb after aging isochronally to 450 Degree-Sign C. During compression creep at 300 Degree-Sign C, the aged alloys exhibit threshold stresses between 8 and 22 MPa. A recent threshold stress model based on elastic interactions between dislocations and precipitates predicts correctly that Li additions in the Al-Li-Sc alloy reduce the threshold stress, while Yb in the Al-Li-Sc-Yb alloy increases it. The model is also in agreement with the threshold stresses of all Al-Sc-X alloys published to date.

  4. Semiclassical solution to the BFKL equation with massive gluons

    International Nuclear Information System (INIS)

    Levin, Eugene; Lipatov, Lev; Siddikov, Marat

    2015-01-01

    In this paper we proceed to study the high energy behavior of scattering amplitudes in a simple field model, with the Higgs mechanism for the gauge boson mass. The spectrum of the j-plane singularities of the t-channel partial waves and the corresponding eigenfunctions of the BFKL equation in leading log(1/x) approximation were previously calculated numerically. Here we develop a semiclassical approach to investigate the influence of the exponential decrease of the impact parameter dependence existing in this model, on the high energy asymptotic behavior of the scattering amplitude. This approach is much simpler than our earlier numerical calculations, and it reproduces those results. The analytical (semi-analytical) solutions which have been found in the approximation can be used to incorporate correctly the large impact parameter behavior in the framework of CGC/saturation approach. This behavior is interesting as it provides the high energy amplitude for the electroweak theory, which can be measured experimentally. (orig.)

  5. From quantum to semiclassical kinetic equations: Nuclear matter estimates

    International Nuclear Information System (INIS)

    Galetti, D.; Mizrahi, S.S.; Nemes, M.C.; Toledo Piza, A.F.R. de

    1985-01-01

    Starting from the exact microscopic time evolution of the quantum one body density associated with a many fermion system semiclassical approximations are derived to it. In the limit where small momentum transfer two body collisions are dominant we get a Fokker-Planck equation and work out friction and diffusion tensors explicitly for nuclear matter. If arbitrary momentum transfers are considered a Boltzmann equation is derived and used to calculate the viscosity coefficient of nuclear matter. A derivation is given of the collision term used by Landau to describe the damping of zero sound waves at low temperature in Plasmas. Memory effects are essential for this. The damping of zero sound waves in nuclear matter is also calculated and the value so obtained associated with the bulk value of the damping of giant resonances in finite nuclei. The bulk value is estimated to be quite small indicating the importance of the nuclear surface for the damping. (Author) [pt

  6. Local Impact Simulation of SC Wall Structures using Aircraft Engine Projectile

    International Nuclear Information System (INIS)

    Chung, Chulhun; Lee, Jungwhee; Lee, Hanjoo; Jung, Raeyoung; Hyun, Changhun

    2013-01-01

    SC wall structure developed for nuclear power plant buildings consists of plain concrete and two steel plates on both surface of the concrete, while RC structure consists of re bar and concrete. SC structure has higher scabbing resistance than RC structure due to the action of steel plate on the rear side of impact. Therefore SC structure is known as more effective structure from the viewpoint of aircraft crash than RC structure. However, most of the recent researches and experiments about local impact damage deal with RC structures, and the effect of re bar and steel plate is not considered reasonably. Although Walter et al. and Make-work et al. suggested a formula for evaluating perforation depth of steel plate covered RC walls, most of the previous researches about SC structure are focused on perforation and scabbing due to the impact of hard projectile, rather than soft projectile such as an aircraft. In this research a soft projectile, i. e. aircraft engine, is utilized for impact simulation of RC and SC walls. To evaluate local damage of SC wall structures, parametric study with the variables of wall thickness and steel ratio of the cover plate is performed, and the results are compared with those of RC structures. Since scabbing was prevented by the steel plates, penetration mode of damage was observed in SC walls while scabbing damage was occurred in RC walls. It is confirmed that the rear steel plate not only contains concrete debris, but also reduces the internal damage of the concrete walls. Penetration depth of SC walls did not largely vary due to the increasing steel ratio, and similar results to RC walls were observed when the wall thickness is larger than a certain value since the impact resistance of SC wall is mainly governed by the thickness of concrete part. Therefore, it is expected that similar level of impact resistance to RC structure can be produced with the minimum thickness of steel plates of SC structure. According to these results, SC

  7. Radiolabeling of DOTATOC with the long-lived positron emitter {sup 44}Sc

    Energy Technology Data Exchange (ETDEWEB)

    Pruszynski, Marek; Majkowska-Pilip, Agnieszka [Centre of Radiochemistry and Nuclear Chemistry, Institute of Nuclear Chemistry and Technology, Dorodna 16, 03-195 Warszawa (Poland); Loktionova, Natalia S.; Eppard, Elisabeth [Institute of Nuclear Chemistry, Johannes Gutenberg-University of Mainz, Fritz-Strassmann-Weg 2, D-55128 Mainz (Germany); Roesch, Frank, E-mail: frank.roesch@uni-mainz.de [Institute of Nuclear Chemistry, Johannes Gutenberg-University of Mainz, Fritz-Strassmann-Weg 2, D-55128 Mainz (Germany)

    2012-06-15

    The positron-emitting radionuclide {sup 44}Sc with a half-life of 3.97 h and a {beta}{sup +} branching of 94.3% is of potential interest for clinical PET. As so far it is available from a {sup 44}Ti/{sup 44}Sc generator in Mainz, where long-lived {sup 44}Ti decays to no-carrier-added (nca) {sup 44}Sc. The {sup 44}Sc is a trivalent metal cation and should be suitable for complexation with many well established bifunctional chelators conjugated to peptides or other molecular targeting vectors. Thus, the aim of this work was to investigate the potential of {sup 44}Sc for labeling of DOTA-conjugated peptides. DOTA-D-Phe{sup 1}-Tyr{sup 3}-octreotide (DOTATOC) was used as a model molecule to study and optimize labeling procedure. Reaction parameters such as buffer conditions, concentration of peptide, pH range, reaction temperature and time were optimized. Addition of 21 nmol of DOTATOC to {sup 44}Sc in ammonium acetate buffer pH 4.0 provided labeling yields >98% within 25 min of heating in an oil-bath at 95 Degree-Sign C. This time can be reduced to 3 min only by applying microwave supported heating. {sup 44}Sc-DOTATOC was found to be stable in 0.9% NaCl, PBS pH 7.4, fetal calf and human serums, and also in the presence of competing metal cations (Fe{sup 3+}, Ca{sup 2+}, Cu{sup 2+}, Mg{sup 2+}), as well as other ligand competitors, like EDTA and DTPA, even after almost 25 h incubation at 37 Degree-Sign C. Present study shows that nca {sup 44}Sc forms stable complexes with the macrocyclic ligand DOTA and that {sup 44}Sc-DOTATOC and analog targeting vectors may be synthesized for further preclinical and clinical investigations. - Highlights: Black-Right-Pointing-Pointer Labeling of somatostatin analouges with positron emitter {sup 44}Sc was tested. Black-Right-Pointing-Pointer DOTATOC was labeled with {sup 44}Sc isotope. Black-Right-Pointing-Pointer Optimal conditions for {sup 44}Sc-DOTATOC synthesis were found. Black-Right-Pointing-Pointer Stability of {sup 44}Sc

  8. New counterterms induced by trans-Planckian physics in semiclassical gravity

    International Nuclear Information System (INIS)

    Nacir, D. Lopez; Mazzitelli, F. D.

    2008-01-01

    We consider free and self-interacting quantum scalar fields satisfying modified dispersion relations in the framework of Einstein-Aether theory. Using adiabatic regularization, we study the renormalization of the equation for the mean value of the field in the self-interacting case, and the renormalization of the semiclassical Einstein-Aether equations for free fields. In both cases we consider Bianchi type I background spacetimes. Contrary to what happens for free fields in flat Robertson-Walker spacetimes, the self-interaction and/or the anisotropy produce nonpurely geometric terms in the adiabatic expansion, i.e. terms that involve both the metric g μν and the aether field u μ . We argue that, in a general spacetime, the renormalization of the theory would involve new counterterms constructed with g μν and u μ , generating a fine-tuning problem for the Einstein-Aether theory.

  9. Calculation of the level density parameter using semi-classical approach

    International Nuclear Information System (INIS)

    Canbula, B.; Babacan, H.

    2011-01-01

    The level density parameters (level density parameter a and energy shift δ) for back-shifted Fermi gas model have been determined for 1136 nuclei for which complete level scheme is available. Level density parameter is calculated by using the semi-classical single particle level density, which can be obtained analytically through spherical harmonic oscillator potential. This method also enables us to analyze the Coulomb potential's effect on the level density parameter. The dependence of this parameter on energy has been also investigated. Another parameter, δ, is determined by fitting of the experimental level scheme and the average resonance spacings for 289 nuclei. Only level scheme is used for optimization procedure for remaining 847 nuclei. Level densities for some nuclei have been calculated by using these parameter values. Obtained results have been compared with the experimental level scheme and the resonance spacing data.

  10. Gadolinium scandium germanide, Gd2Sc3Ge4

    Directory of Open Access Journals (Sweden)

    Sumohan Misra

    2009-04-01

    Full Text Available Gd2Sc3Ge4 adopts the orthorhombic Pu5Rh4-type structure. The crystal structure contains six sites in the asymmetric unit: two sites are statistically occupied by rare-earth atoms with Gd:Sc ratios of 0.967 (4:0.033 (4 and 0.031 (3:0.969 (3, one site (.m. symmetry is occupied by Sc atoms, and three distinct sites (two of which with .m. symmetry are occupied by Ge atoms. The rare-earth atoms form two-dimensional slabs with Ge atoms occupying the trigonal-prismatic voids.

  11. Stable long-time semiclassical description of zero-point energy in high-dimensional molecular systems.

    Science.gov (United States)

    Garashchuk, Sophya; Rassolov, Vitaly A

    2008-07-14

    Semiclassical implementation of the quantum trajectory formalism [J. Chem. Phys. 120, 1181 (2004)] is further developed to give a stable long-time description of zero-point energy in anharmonic systems of high dimensionality. The method is based on a numerically cheap linearized quantum force approach; stabilizing terms compensating for the linearization errors are added into the time-evolution equations for the classical and nonclassical components of the momentum operator. The wave function normalization and energy are rigorously conserved. Numerical tests are performed for model systems of up to 40 degrees of freedom.

  12. Kuang's Semi-Classical Formalism for Calculating Electron Capture Cross Sections: A Space- Physics Application

    Science.gov (United States)

    Barghouty, A. F.

    2014-01-01

    Accurate estimates of electroncapture cross sections at energies relevant to the modeling of the transport, acceleration, and interaction of energetic neutral atoms (ENA) in space (approximately few MeV per nucleon) and especially for multi-electron ions must rely on detailed, but computationally expensive, quantum-mechanical description of the collision process. Kuang's semi-classical approach is an elegant and efficient way to arrive at these estimates. Motivated by ENA modeling efforts for apace applications, we shall briefly present this approach along with sample applications and report on current progress.

  13. The hyperbola billiard: A model for the semiclassical quantization of chaotic systems

    International Nuclear Information System (INIS)

    Sieber, M.

    1991-04-01

    Classical and quantum mechanical properties of a chaotic billiard system are studied with special emphasis on a detailed numerical investigation of the periodic-orbit theory of Gutzwiller. This theory gives semiclassical approximations to the quantum mechanical energies of a classically chaotic system by means of a sum over all periodic orbits of the system. Parts of the derivation of the periodic-orbit theory are reviewed. The convergence properties of the periodic-orbit sum are discussed and smoothing techniques are introduced, which allow the determination of the energies by absolutely convergent sums. A code is introduced for the periodic orbits of the hyperbola billiard, a chaotic system which is bounded by the x-axis, the y-axis and the hyperbola y=1/x. An extremum principle for the periodic orbits is proved, which allows a very fast and accurate determination of the periodic orbits. The distributions of lengths and Lyapunov exponents of the orbits are studied. The quantum mechanical energies of the hyperbola billiard are determined by a boundary element method. A correction to the asymptotic approximation for the spectral staircase N(E), which counts the number of energy eigenvalues of the Schroedinger equation below a given energy E, is determined numerically. The properties of the periodic-orbit theory are investigated by an evaluation of the unsmoothed Gutzwiller trace formula and various versions of smoothed trace formulae. The advantage of different smoothing methods are discussed and compared. The effect of the semiclassical approximation is demonstrated by a smoothing, which leads to a truncation of the periodic-orbit sum. An alternative approximation for the energies in terms of a dynamical zeta function is investigated and shown to yield comparable results as the previous trace formulae. An approximation to this zeta function in analogy to the Riemann-Siegel formula for the Riemann zeta function is studied. (orig./HSI)

  14. Cloning, purification, crystallization and preliminary X-ray diffraction analysis of nitrile hydratase from the themophilic Bacillus smithii SC-J05-1

    International Nuclear Information System (INIS)

    Hourai, Shinji; Ishii, Takeshi; Miki, Misao; Takashima, Yoshiki; Mitsuda, Satoshi; Yanagi, Kazunori

    2005-01-01

    The nitrile hydratase from the themophilic B. smithii SC-J05-1 (Bs NHase) has been purified, cloned and crystallized. Nitrile hydratase (NHase) converts nitriles to the corresponding amides and is recognized as having important industrial applications. Purification, cloning, crystallization and initial crystallographic studies of the NHase from Bacillus smithii SC-J05-1 (Bs NHase) were conducted to analyze the activity, specificity and thermal stability of this hydrolytic enzyme. Bs NHase was purified to homogeneity from microbial cells of B. smithii SC-J05-1 and the nucleotide sequences of both the α- and β-subunits were determined. Purified Bs NHase was used for crystallization and several crystal forms were obtained by the vapour-diffusion method. Microseeding and the addition of magnesium ions were essential components to obtain crystals suitable for X-ray diffraction analysis

  15. Stark broadening of the Hα line of hydrogen at low densities: quantal and semiclassical results

    International Nuclear Information System (INIS)

    Stehle, C.; Feautrier, N.

    1984-01-01

    Stark profiles of the Hα lines of hydrogen are computed at low densities in the 'impact' theory. By a comparison with quantal results, it is shown that a simple semiclassical perturbational approach with appropriate cutoffs is sufficient to give accurate profiles in the line centre. Neglecting the natural broadening and the fine-structure effects, the authors prove that the electronic broadening is negligible and that the profile has a Lorentzian shape. An analytical expression of the half width is given. (author)

  16. Semi-classical precompound decay models for heavy ion reactions of 10-100 MeV/nucleon

    International Nuclear Information System (INIS)

    Blann, M.

    1986-01-01

    The hybrid and Boltzmann master equation, which predict heavy ion precompound decay phenomena, are investigated. These are both semi-classical approaches. The physical concepts of these two models are discussed, and their numerical formulations are summarized. Their success in reproducing experimentally measured (HI,n) spectra and in estimating limits on beam momentum transfer due to the precompound nucleon emission cascade are summarized. Results of calculations for subthreshold pion production are presented and compared with experimental yields. 19 refs., 5 figs

  17. Monitor of SC beam profiles

    CERN Document Server

    CERN PhotoLab

    1977-01-01

    A high-resolution secondary emission grid for the measurement of SC beam profiles. Modern techniques of metal-ceramic bonding, developed for micro-electronics, have been used in its construction. (See Annual Report 1977 p. 105 Fig. 12.)

  18. Performance Analysis of OFDM 60GHz System and SC-FDE 60GHz System

    Directory of Open Access Journals (Sweden)

    Han Xueyan

    2016-01-01

    Full Text Available In this paper, the performance of 60GHz wireless communication system with SC and OFDM is studied, the models of OFDM 60GHz system and SC 60GHz frequency domain equalization (SC-FDE system are established, and the bit error rate (BER performance of OFDM 60GHz system and SC-FDE 60GHz system in 802.15.3c channels is compared. The simulation results show that SC-FDE 60GHz system has a slight advantage over OFDM system in line-of-sight (LOS channels, while OFDM 60GHz system has a slight advantage over SC-FDE system in non-line-of-sight (NLOS channels. For 60GHz system, OFDM 60GHz system has a slight advantage over SC-FDE system in overcoming multipath fading, but the performance of both is close whether in the LOS or NLOS case.

  19. Gallium-containing Heusler phases ScRh{sub 2}Ga, ScPd{sub 2}Ga, TmRh{sub 2}Ga and LuRh{sub 2}Ga. Magnetic and solid state NMR-spectroscopic characterization

    Energy Technology Data Exchange (ETDEWEB)

    Heletta, Lukas; Seidel, Stefan; Poettgen, Rainer [Muenster Univ. (Germany). Inst. fuer Anorganische und Analytische Chemie; Benndorf, Christopher [Leipzig Univ. (Germany). Inst. fuer Mineralogie, Kristallographie und Materialwissenschaften; Eckert, Hellmut [Muenster Univ. (Germany). Inst. fuer Physikalische Chemie; Sao Paulo Univ., Sao Carlos (Brazil). Inst. of Physics

    2017-10-01

    The gallium-containing Heusler phases ScRh{sub 2}Ga, ScPd{sub 2}Ga, TmRh{sub 2}Ga and LuRh{sub 2}Ga have been synthesized by arc-melting of the elements followed by different annealing sequences to improve phase purity. The samples have been studied by powder X-ray diffraction. The structures of Lu{sub 0.97}Rh{sub 2}Ga{sub 1.03} (Fm3m, a=632.94(5) pm, wR2=0.0590, 46 F{sup 2} values, seven variables) and Sc{sub 0.88}Rh{sub 2}Ga{sub 1.12} (a=618.91(4) pm, wR2=0.0284, 44 F{sup 2} values, six variables) have been refined from single crystal X-ray diffractometer data. Both gallides show structural disorder through Lu/Ga and Sc/Ga mixing. Temperature dependent magnetic susceptibility measurements showed Pauli paramagnetism for ScRh{sub 2}Ga, ScPd{sub 2}Ga, and LuRh{sub 2}Ga and Curie-Weiss paramagnetism for TmRh{sub 2}Ga. {sup 45}Sc and {sup 71}Ga solid state MAS NMR spectroscopic investigations of the Sc containing compounds confirmed the site mixing effects typically observed for Heusler phases. The data indicate that the effect of mixed Sc/Ga occupancy is significantly stronger in ScRh{sub 2}Ga than in ScPd{sub 2}Ga.

  20. PEMODELAN KONDUKTIVITAS ION DALAM STRUKTUR Li2Sc3(PO43 (Modeling Ionic Conductivity in Li2Sc3(PO43 Structure

    Directory of Open Access Journals (Sweden)

    Akram La Kilo

    2011-11-01

    Full Text Available ABSTRAK Fasa Li2Sc3(PO43 merupakan material konduktor superionik yang dapat diaplikasikan sebagai baterai yang dapat diisi ulang (rechargeable. Ion Li+ dalam struktur Li2Sc3(PO4 dapat mengalami migrasi dari posisi terisi ke posisi kosong. Penelitian ini telah memodelkan migrasi ion Li+ dalam struktur Li2Sc3(PO4 dengan menggunakan metode bond valence sum (BVS. Metode ini dapat memprediksi bilangan oksidasi suatu atom berdasarkan jarak dengan atom-atom tetangga. Source code berbasis BVS yang digunakan adalah JUMPITER yang mensimulasi efek gaya listrik eksternal yang bertindak pada ion litium sehingga nilai BVS litium dapat dipetakan terhadap jarak. Hasil simulasi menunjukkan bahwa konduksi ion Li+ dapat terjadi pada arah [010], [101], dan [120]. Namun, lintasan konduksi ion Li+ lebih mudah terjadi pada arah [120] atau bidang ab dengan nilai maksimum BVS adalah 0,982. ABSTRACT g-phase of Li2Sc3(PO43 is a lithium super ionic conductor which can be applied as a rechargeable lithium battery. Lithium ions of g-Li2Sc3(PO43 can migrate from occupied site to vacant site. In this research, simulation of Li+ ions migration in the structure of g-Li2Sc3(PO43 carried out using bond valence sum (BVS to predict the oxidation state of Li+ion based on the distance of the ion to neighboring atoms. BVS-based code used JUMPITER to simulate the effect of external electrical force acting on the lithium ions to produce the lithium BVS value which can be mapped to the distance. The simulation results shows that Li+ ion conduction can be occurred on [010], [101], and [120] directions. However, the Li ion conduction pathway occur more easily in the direction of [120] or ab plane with the BVS maximum value is 0.982.

  1. Initial studies of Bremsstrahlung energy deposition in small-bore superconducting undulator structures in linac environments

    Energy Technology Data Exchange (ETDEWEB)

    Cremer, T.; Tatchyn, R. [Stanford Univ., CA (United States)

    1995-12-31

    One of the more promising technologies for developing minimal-length insertion devices for linac-driven, single-pass Free Electron Lasers (FELs) operating in the x-ray range is based on the use of superconducting (SC) materials. In recent FEL simulations, for example, a bifilar helical SC device with a 2 cm period and 1.8 T field was found to require a 30 m saturation length for operation at 1.5{Angstrom} on a 15 GeV linac, more than 40% shorter than an alternative hybrid/permanent magnet (hybrid/PM) undulator. AT the same time, however, SC technology is known to present characteristic difficulties for insertion device design, both in engineering detail and in operation. Perhaps the most critical problem, as observed, e.g., by Madey and co-workers in their initial FEL experiments, was the frequent quenching induced by scattered electrons upstream of their (bifilar) device. Postulating that this quenching was precipitated by directly-scattered or bremsstrahlung-induced particle energy deposited into the SC material or into material contiguous with it, the importance of numerical and experimental characterizations of this phenomenon for linac-based, user-facility SC undulator design becomes evident. In this paper we discuss selected prior experimental results and report on initial EGS4 code studies of scattered and bremsstrahlung induced particle energy deposition into SC structures with geometries comparable to a small-bore bifilar helical undulator.

  2. File list: Unc.PSC.50.AllAg.EpiSC [Chip-atlas[Archive

    Lifescience Database Archive (English)

    Full Text Available Unc.PSC.50.AllAg.EpiSC mm9 Unclassified Pluripotent stem cell EpiSC SRX1074917,SRX1...074905,SRX1074908 http://dbarchive.biosciencedbc.jp/kyushu-u/mm9/assembled/Unc.PSC.50.AllAg.EpiSC.bed ...

  3. File list: Unc.PSC.05.AllAg.EpiSC [Chip-atlas[Archive

    Lifescience Database Archive (English)

    Full Text Available Unc.PSC.05.AllAg.EpiSC mm9 Unclassified Pluripotent stem cell EpiSC SRX1074917,SRX1...074908,SRX1074905 http://dbarchive.biosciencedbc.jp/kyushu-u/mm9/assembled/Unc.PSC.05.AllAg.EpiSC.bed ...

  4. File list: Unc.PSC.20.AllAg.EpiSC [Chip-atlas[Archive

    Lifescience Database Archive (English)

    Full Text Available Unc.PSC.20.AllAg.EpiSC mm9 Unclassified Pluripotent stem cell EpiSC SRX1074917,SRX1...074908,SRX1074905 http://dbarchive.biosciencedbc.jp/kyushu-u/mm9/assembled/Unc.PSC.20.AllAg.EpiSC.bed ...

  5. Phase relationship in AL-Cu-Sc alloys at 450-500 deg C

    International Nuclear Information System (INIS)

    Kharakterova, M.L.

    1991-01-01

    Al-Cu-Sc alloys containing up to 40% Cu and up to 6% Sc at 450 deg C and 500 deg C are studied using light microscopy, X-ray-spectral microanalysis, X-ray diffraction analysis, scanning electron microscopy, measurement of microhardness and electric resistance. It is determined, that in equilibrium with aluminium solid solution under the given temperature ther are Al 3 Sc, CuAl 2 phases of the respective binary systems and W (ScCu 6.6-4 Al 5.4-8 ) ternary phase. Isothermal cross sections of Al-Cu-Sc system at 450 and 500 deg C are plotted. Microhardness of equilibrium phases is measured. Combined solubility of copper and scandium in aluminium is determined

  6. Effect of Sc addition on microstructure and mechanical properties of 1460 alloy

    Directory of Open Access Journals (Sweden)

    Juan Ma

    2014-02-01

    Full Text Available The effect of minor addition of Sc on microstructure, age hardening behavior, tensile properties and fracture morphology of 1460 alloy have been studied. It is found that Sc content increase from 0.11 wt% to 0.22 wt% is favorable for grain refinement in as-cast alloy but results in a coarsening of Cu-rich particles. The alloy with 0.11 wt% Sc exhibits enhanced mechanical properties and age hardening effect. Transmission electron microscopy (TEM investigations on the alloy with 0.11 wt% Sc have suggested that a large amount of Al3(Sc, Zr particles precipitated at the earlier aging may inhibit recrystallization effectively.

  7. Coherent and Semiclassical States of a Charged Particle in Electromagnetic Fields

    Science.gov (United States)

    Pereira, A. S.

    2018-03-01

    In the present article, we extend our study (Bagrov et al., Braz. J. Phys. 45, 369, 2015) of generalized coherent states (GCS) of a one-dimensional particle considering such important physical system as a three-dimensional charged particle in electric and magnetic fields. Constructing GCS in a many-dimensional case, we meet technical complications that make the consideration nontrivial and instructive. The GCS of the system under consideration are constructed. We study the properties of this GCS such as completeness relations, minimization of uncertainty relations, and so on. We point out which family of the obtained GCS of a charged particle in a magnetic field is related to the CS constructed first by Malkin and Man'ko. We obtain conditions under which some of the GCS can be considered as semiclassical states (SS).

  8. Semi-classical derivation of charge-quantization through charge-field self-interaction

    International Nuclear Information System (INIS)

    Kosok, M.; Madhyastha, V.L.

    1990-01-01

    A semi-classical synthesis of classical mechanics, wave mechanics, and special relativity yields a unique nonlinear energy-wave structure of relations (velocity triad uv = c 2 ) fundamental to modern physics. Through the above vehicle, using Maxwell's equations, charge quantization and the fine structure constant are derived. It is shown that the numerical value of the nonlinear charge-field self-interaction range for the electron is of the order of 10 -13 m, which is greater than the classical electron radius but less than the Compton wavelength of the electron. Finally, it is suggested that the structure of the electron-in-space is expressed by a self-extending nonlinear ''fractal geometry'' based on derived numerical values obtained from our model, thus opening this presentation of charge-field structure to experimental testing for possible verification

  9. Coherent and Semiclassical States of a Charged Particle in Electromagnetic Fields

    Science.gov (United States)

    Pereira, A. S.

    2018-06-01

    In the present article, we extend our study (Bagrov et al., Braz. J. Phys. 45, 369, 2015) of generalized coherent states (GCS) of a one-dimensional particle considering such important physical system as a three-dimensional charged particle in electric and magnetic fields. Constructing GCS in a many-dimensional case, we meet technical complications that make the consideration nontrivial and instructive. The GCS of the system under consideration are constructed. We study the properties of this GCS such as completeness relations, minimization of uncertainty relations, and so on. We point out which family of the obtained GCS of a charged particle in a magnetic field is related to the CS constructed first by Malkin and Man'ko. We obtain conditions under which some of the GCS can be considered as semiclassical states (SS).

  10. Mathematical models of some geomagnetic storms with SC

    International Nuclear Information System (INIS)

    Ivanova, P.K.

    1990-01-01

    Regressive equations for H horizontal component of three geomagnetic storms with Sc:0.1.03.82, 24.01.74 and 23.03.69 -are calculated using step-by-step regression analysis. These equations relate H with parameters of solar wind and interplanetary magnetic field. Nonlinear, square, logarithmic and trigonometric dependences are considered, as well. Most essential parameters, which contribute mostly into Sc, are determined from multiplicity (46 factors) of independent parameters

  11. Radiation protection Group (SC/RP) desperately seeking...

    CERN Document Server

    A. Hervé, Y. Donjoux / SC

    2006-01-01

    We are trying to trace two transit permits (passavants), which constitute the customs clearance documentation for two 'AD6'portable radiation detectors. The two permits (No. 1308 and No. 1309) were sent in the same internal mail envelope towards the middle of March 2006 but never reached their final destination. After weeks of searching in vain, we are now appealing for your help. If you have these two permits in your possession, please get in touch with us. Many thanks in advance. A.HERVE - SC/RP- ( 163168 / 70927) Y.DONJOUX - SC/RP - (160105 / 73171)

  12. [Roberts-SC phocomelia syndrome].

    Science.gov (United States)

    Musfeld, D A; Bühler, E M; Heinzl, S

    2001-01-01

    The Roberts-SC phocomelia syndrome is a rare autosomal recessive inherited disorder clinically manifested by tetraphocomelia, pre- and postnatal growth retardation, and craniofacial abnormalities (skull, eyes, lip, and palate), accompanied at times by centromer puffing and splitting, renal abnormalities, heart defect, clitoral or penile enlargement, and bilateral corneal opacities. Mental retardation is common in surviving patients.

  13. Model of Dees and Rotco for the 600 MeV SC

    CERN Multimedia

    CERN PhotoLab

    1978-01-01

    The accelerating frequency of the 600 MeV Synchro-Cyclotron (SC) was modulated by the varying capacity of a rotating condenser ("Rotco", the most delicate component of the SC). A 1/5-scale model, dating from the design-period of the SC, was used to study improvements to the SC RF-system, and also the acceleration of ions, first Helium and, at the time of this picture, Carbon. In the middle of the picture is the case containing the Dees. To the left, at the wide end of the cone, a rotco. Reinhold Hohbach is busy with measurements. See also 7805235 (Annual Report 1978, p.110).

  14. First coil for the SC

    CERN Multimedia

    CERN PhotoLab

    1955-01-01

    The coils for the SC magnet were stored in the large hangar of the Cointrin Airport (to make sure that they would be available before snow and ice would block the roads and canals from Belgium, where they were built).

  15. Theoretical study of stability and superconductivity of ScHn (n =4 -8 ) at high pressure

    Science.gov (United States)

    Qian, Shifeng; Sheng, Xiaowei; Yan, Xiaozhen; Chen, Yangmei; Song, Bo

    2017-09-01

    The synthesis of hydrogen sulfides, with the potential of high-temperature superconductivity, was recently proposed at high Tc = 203 K. It motivated us to employ an ab initio approach for the predictions of crystal structures to find the stable scandium hydrides. In addition to the earlier predicted three stoichiometries of ScH, ScH2, and ScH3, we identify three other metallic stoichiometries of ScH4, ScH6, and ScH8, which show superconductivity at significantly higher temperatures. The phases of ScH4 and ScH6, whose stability does not require extremely high pressures (ZPE), are primarily ionic compounds containing exotic quasimolecular H2 arrangements. The present electron-phonon calculations revealed the superconductive potential of ScH4 and ScH6 with estimated Tc of 98 K and 129 K at 200 GPa and 130 GPa, respectively. The superconductivity of ScHn stems from the large electron-phonon coupling associated with the wagging, bending, and intermediate-frequency modes attributed mainly to the hydrogen atoms.

  16. Methods for production of UNK SC-dipoles magnetic measurements

    International Nuclear Information System (INIS)

    Smirnov, N.L.

    1991-01-01

    Many SC-dipoles for UNK will require from the chosen magnetic measurement methods high accuracy and efficiency. The brief of using methods, their possibilities and analysis of their errors are given. The measurements results for a full-scale model of SC-dipole SPDM1 are presented. 5 refs.; 4 figs.; 4 tabs

  17. Study of the hyperfine magnetic field at Ta181 site in the Heusler Co2 Sc Sn, Co2 Sc Ga and Co2 Hf Sn alloys

    International Nuclear Information System (INIS)

    Attili, R.N.

    1992-01-01

    The hyperfine magnetic fields acting on 181 Ta nuclei at the Sc and Hf sites have been measured in Heusler alloys Co 2 Sc Sn and Co 2 Sc Ga and Co 2 Hf Sn using the Time Differential Perturbed γ-γ Angular Correlation (TDPAC) technique. The measurements were carried out using an automatic spectrometer consisting of two Ba F 2 detectors and the conventional electronics. The magnitude of hyperfine magnetic field at 181 Ta was measured for all the alloys. The signs of the were determined in the cases of Co 2 Sc Sn and Co 2 Hf Sn alloys by performing the Perturbed Angular Correlation measurements with an external polarizing magnetic field of ≅ 5 k Gauss. The hyperfine magnetic fields obtained are -187,6± 3,3 and 90,0 ± 2,1 kOe measured at 77 K for Co 2 Sc Sn and Co 2 Sc Ga alloys respectively, and -342,4 ± 10,1 kOe measured at the room temperature for Co 2 Hf Sn alloy. These results are discussed and compared with the hyperfine magnetic field systematics in Co-based Heusler alloy. (author)

  18. Level densities and γ strength functions in light Sc and Ti isotopes

    International Nuclear Information System (INIS)

    Burger, A.; Larsen, A.C.; Syed, N.U.H.; Guttormsen, M.; Nyhus, H.; Siem, S.; Harissopulos, S.; Konstantinopoulos, T.; Lagoyannis, A.; Perdidakis, G.; Spyrou, A.; Kmiecik, M.; Mazurek, K.; Krticka, M.; Loennroth, T.; Norby, M.; Voinov, A.

    2010-01-01

    We present preliminary results from a measurement of nuclear level densities and the γ-ray strength of light Sc (Sc 43 , Sc 45 ) and Ti (Ti 44 , Ti 45 and Ti 46 ) isotopes using the Oslo Method. The article begins with a presentation of the experimental setup. (authors)

  19. The data acquisition system (DAS) for the improved CERN SC

    CERN Document Server

    Beger, H; Fiebig, A; Schroot, H

    1975-01-01

    A digital data acquisition system (DAS) based on a minicomputer is described which registers the failure sequences in various equipment areas of the CERN synchrocyclotron (henceforward referred to as the SC). The avalanches of failure signals which occur from time to time are tapped from the alarm/security systems, time-resolved to 10 msec and recorded on a printer in order to aid SC failure diagnosis. The mechanisms of the DAS and its relation to the SC equipment are explained in some detail. All programs were constructed at assembler language level for speed and for ease of on-line program maintenance. The alarm sequences recorded have been of considerable help during the running in of the new radiofrequency system. Now that the new SC is operational, the DAS furnishes useful data from several equipment areas to the operators and engineers.

  20. Paracyclophane functionalized with Sc and Li for hydrogen storage

    Science.gov (United States)

    Sathe, Rohit Y.; Dhilip Kumar, T. J.

    2018-01-01

    Li and Sc metals functionalized on the delocalized π -electrons of benzene rings in [2,2]paracyclophane structure are studied for hydrogen storage efficiency by using the M06 DFT functional with 6-311G(d,p) basis set. It is found that Sc and Li functionalized [2,2]paracyclophane complexes can hold up to 10 H2 molecules and 8 H2 molecules by Kubas-Niu-Jena interaction and charge polarization mechanism with hydrogen weight percentage of 11.4 and 13.5, respectively. Molecular dynamics simulation at various temperatures showed appreciable thermal stability while the chemical potential calculation at room temperature reveals that Sc functionalized [2,2]paracyclophane system will be a promising hydrogen storage material.

  1. Toward low-cost affinity reagents: lyophilized yeast-scFv probes specific for pathogen antigens.

    Directory of Open Access Journals (Sweden)

    Sean A Gray

    Full Text Available The generation of affinity reagents, usually monoclonal antibodies, remains a critical bottleneck in biomedical research and diagnostic test development. Recombinant antibody-like proteins such as scFv have yet to replace traditional monoclonal antibodies in antigen detection applications, in large part because of poor performance of scFv in solution. To address this limitation, we have developed assays that use whole yeast cells expressing scFv on their surfaces (yeast-scFv in place of soluble purified scFv or traditional monoclonal antibodies. In this study, a nonimmune library of human scFv displayed on the surfaces of yeast cells was screened for clones that bind to recombinant cyst proteins of Entamoeba histolytica, an enteric pathogen of humans. Selected yeast-scFv clones were stabilized by lyophilization and used in detection assay formats in which the yeast-scFv served as solid support-bound monoclonal antibodies. Specific binding of antigen to the yeast-scFv was detected by staining with rabbit polyclonal antibodies. In flow cytometry-based assays, lyophilized yeast-scFv reagents retained full binding activity and specificity for their cognate antigens after 4 weeks of storage at room temperature in the absence of desiccants or stabilizers. Because flow cytometry is not available to all potential assay users, an immunofluorescence assay was also developed that detects antigen with similar sensitivity and specificity. Antigen-specific whole-cell yeast-scFv reagents can be selected from nonimmune libraries in 2-3 weeks, produced in vast quantities, and packaged in lyophilized form for extended shelf life. Lyophilized yeast-scFv show promise as low cost, renewable alternatives to monoclonal antibodies for diagnosis and research.

  2. Semi-classical description of Rydberg atoms in strong, single-cycle electromagnetic pulses

    International Nuclear Information System (INIS)

    Jensen, R.V.; Sanders, M.M.

    1993-01-01

    Recent experimental measurements of the excitation and ionization of Rydberg atoms by single-cycle, electromagnetic pulses have revealed a variety of novel features. Because many quantum states are strongly coupled by the broadband radiation in the short pulse, the traditional methods of quantum mechanics are inadequate to account for the experimental results. We have therefore developed a semi-classical description of the interaction of both hydrogenic and non-hydrogenic atoms with single-cycle pulses of intense, electromagnetic radiation which is based on the strong correspondence theory of Percival and Richards. This theory, which was originally introduced for the description of strong atomic collisions, accounts for some of the surprising features of the experimental measurements and provides new predictions for future experimental studies

  3. Bayesian narrowband interference mitigation in SC-FDMA

    KAUST Repository

    Ali, Anum; Masood, Mudassir; Al-Ghadhban, Samir; Al-Naffouri, Tareq Y.

    2015-01-01

    This paper presents a novel narrowband interference (NBI) mitigation scheme for SC-FDMA systems. The proposed scheme exploits the frequency domain sparsity of the unknown NBI signal and adopts a low complexity Bayesian sparse recovery procedure. In practice, however, the sparsity of the NBI is destroyed by a grid mismatch between NBI sources and SC-FDMA system. Towards this end, an accurate grid mismatch model is presented and a sparsifying transform is utilized to restore the sparsity of the unknown signal. Numerical results are presented that depict the suitability of the proposed scheme for NBI mitigation.

  4. Bayesian narrowband interference mitigation in SC-FDMA

    KAUST Repository

    Ali, Anum

    2015-08-12

    This paper presents a novel narrowband interference (NBI) mitigation scheme for SC-FDMA systems. The proposed scheme exploits the frequency domain sparsity of the unknown NBI signal and adopts a low complexity Bayesian sparse recovery procedure. In practice, however, the sparsity of the NBI is destroyed by a grid mismatch between NBI sources and SC-FDMA system. Towards this end, an accurate grid mismatch model is presented and a sparsifying transform is utilized to restore the sparsity of the unknown signal. Numerical results are presented that depict the suitability of the proposed scheme for NBI mitigation.

  5. In-situ observation of recrystallization in an AlMgScZr alloy using confocal laser scanning microscopy

    International Nuclear Information System (INIS)

    Taendl, J.; Nambu, S.; Orthacker, A.; Kothleitner, G.; Inoue, J.; Koseki, T.; Poletti, C.

    2015-01-01

    In this work we present a novel in-situ approach to study the recrystallization behavior of age hardening alloys. We use confocal laser scanning microscopy (CLSM) at 400 °C to investigate the static recrystallization of an AlMg4Sc0.4Zr0.12 alloy in-situ. The results are combined with electron backscatter diffraction (EBSD) and transmission electron microscopy (TEM) analyses. It was found that CLSM is a powerful tool to visualize both the local initiation and temporal sequence of recrystallization. After fast nucleation and initial growth, the grain growth rate decreases and the grain boundary migration stops after some minutes due to Zener pinning from Al 3 (Sc,Zr) precipitates produced during the heat treatment. EBSD and TEM analyses confirm both the boundary movements and the particle-boundary interactions. - Highlights: • First time that CLSM is used to study recrystallization in-situ. • The start and end of recrystallization can be directly observed. • The procedure is easy to apply and requires only simple data interpretation. • In-situ observations on the surface correlate to modifications inside the bulk. • In-situ observations correlate to EBSD and EFTEM analyses.

  6. In-situ observation of recrystallization in an AlMgScZr alloy using confocal laser scanning microscopy

    Energy Technology Data Exchange (ETDEWEB)

    Taendl, J., E-mail: johannes.taendl@tugraz.atl [Institute of Materials Science and Welding, Graz University of Technology, Graz (Austria); Nambu, S. [Department of Materials Engineering, The University of Tokyo, Tokyo 113-8656 (Japan); Orthacker, A.; Kothleitner, G. [Institute of Electron Microscopy and Nanoanalysis, Graz University of Technology, Graz (Austria); Graz Center for Electron Microscopy, Graz (Austria); Inoue, J.; Koseki, T. [Department of Materials Engineering, The University of Tokyo, Tokyo 113-8656 (Japan); Poletti, C. [Institute of Materials Science and Welding, Graz University of Technology, Graz (Austria)

    2015-10-15

    In this work we present a novel in-situ approach to study the recrystallization behavior of age hardening alloys. We use confocal laser scanning microscopy (CLSM) at 400 °C to investigate the static recrystallization of an AlMg4Sc0.4Zr0.12 alloy in-situ. The results are combined with electron backscatter diffraction (EBSD) and transmission electron microscopy (TEM) analyses. It was found that CLSM is a powerful tool to visualize both the local initiation and temporal sequence of recrystallization. After fast nucleation and initial growth, the grain growth rate decreases and the grain boundary migration stops after some minutes due to Zener pinning from Al{sub 3}(Sc,Zr) precipitates produced during the heat treatment. EBSD and TEM analyses confirm both the boundary movements and the particle-boundary interactions. - Highlights: • First time that CLSM is used to study recrystallization in-situ. • The start and end of recrystallization can be directly observed. • The procedure is easy to apply and requires only simple data interpretation. • In-situ observations on the surface correlate to modifications inside the bulk. • In-situ observations correlate to EBSD and EFTEM analyses.

  7. Ternary scandium-rich indides Sc{sub 50}T{sub 13}In{sub 3} and Sc{sub 50}Rh{sub 13}In{sub 3}O{sub y} (T = Rh, Ir; y {approx} 8) - synthesis and crystal structure

    Energy Technology Data Exchange (ETDEWEB)

    Zaremba, R.; Poettgen, R. [Inst. fuer Anorganische und Analytische Chemie, Univ. Muenster (Germany)

    2007-12-15

    New intermetallic compounds Sc{sub 50}Rh{sub 13.3}In{sub 2.7} and Sc{sub 50}Ir{sub 13.6}In{sub 2.4} and the suboxides Sc{sub 49.2}Rh{sub 13}In{sub 3.8}O{sub 8.8} and Sc{sub 49.2}Rh{sub 13.7}In{sub 2.8}O{sub 8.0} were synthesized from the elements or with Sc{sub 2}O{sub 3} as an oxygen source, respectively, in sealed tantalum tubes in a water-cooled sample chamber of an induction furnace. They crystallize with a new cubic structure type, space group F m anti 3, a = 1772.5(6) pm, wR2 = 0.032, 1111 F{sup 2} values, 34 variables for Sc{sub 50}Rh{sub 13.3}In{sub 2.7}, a = 1766.5(6) pm, wR2 = 0.041, 745 F{sup 2} values, 34 variables for Sc{sub 50}Ir{sub 13.6}In{sub 2.4}, a = 1764.4(2) pm, wR2 = 0.044, 640 F{sup 2} values, 41 variables for Sc{sub 49.2}Rh{sub 13}In{sub 3.8}O{sub 8.8}, and a = 1761.5(6) pm, wR2 = 0.054, 740 F{sup 2} values, 42 variables for Sc{sub 49.2}Rh{sub 13.7}In{sub 2.8}O{sub 8.0}. The main structural motifs are rhodium-centered indium cubes in an fcc like arrangement in which the octahedral and tetrahedral voids are filled by In2Sc{sub 12} and In1Sc{sub 12} icosahedra, respectively, resembling a Li{sub 3}Bi-like structure. The Rh1 (Ir1) and Sc4 atoms lie between these polyhedral units. The oxygen atoms partially fill Sc{sub 6} octahedra in Sc{sub 49.2}Rh{sub 13}In{sub 3.8}O{sub 8.8} and Sc{sub 49.2}Rh{sub 13.7}In{sub 2.8}O{sub 8.0} with Sc-O distances of 214 - 230 pm. These octahedra are condensed via common edges and faces, encapsulating the In2Sc{sub 12} icosahedra. Due to the high scandium content one observes strong Sc-Sc bonding with Sc-Sc distances ranging from 303 to 362 pm in Sc{sub 49.2}Rh{sub 13}In{sub 3.8}O{sub 8.8}. The shortest distances occur for Sc-Rh (267 - 295 pm). The crystal chemical relationship with the Li{sub 3}Bi-related suboxide Ti{sub 12}Sn{sub 3}O{sub 10} is discussed. (orig.)

  8. Static resistance function for steel-plate composite (SC) walls subject to impactive loading

    International Nuclear Information System (INIS)

    Bruhl, Jakob C.; Varma, Amit H.; Kim, Joo Min

    2015-01-01

    Highlights: • An idealized static resistance function for SC walls is proposed. • The influence of design parameters on static resistance is explained. • SDOF models can accurately estimate global response of SC walls to missile impact. - Abstract: Steel-plate composite (SC) walls consist of a plain concrete core reinforced with two steel faceplates on the surfaces. Modules (consisting of steel faceplates, shear connectors and tie-bars) can be shop-fabricated and shipped to the site for erection and concrete casting, which expedites construction schedule and thus economy. SC structures have recently been used in nuclear power plant designs and are being considered for the next generation of small modular reactors. Design for impactive and impulsive loading is an important consideration for SC walls in safety-related nuclear facilities. The authors have previously developed design methods to prevent local failure (perforation) of SC walls due to missile impact. This paper presents the development of static resistance functions for use in single-degree-of-freedom (SDOF) analyses to predict the maximum displacement response of SC walls subjected to missile impact and designed to resist local failure (perforation). The static resistance function for SC walls is developed using results of numerical analyses and parametric studies conducted using benchmarked 3D finite element (FE) models. The influence of various design parameters are discussed and used to develop idealized bilinear resistance functions for SC walls with fixed edges and simply supported edges. Results from dynamic non-linear FE analysis of SC panels subjected to rigid missile impact are compared with the maximum displacements predicted by SDOF analyses using the bilinear resistance function.

  9. Static resistance function for steel-plate composite (SC) walls subject to impactive loading

    Energy Technology Data Exchange (ETDEWEB)

    Bruhl, Jakob C., E-mail: jbruhl@purdue.edu; Varma, Amit H., E-mail: ahvarma@purdue.edu; Kim, Joo Min, E-mail: kim1493@purdue.edu

    2015-12-15

    Highlights: • An idealized static resistance function for SC walls is proposed. • The influence of design parameters on static resistance is explained. • SDOF models can accurately estimate global response of SC walls to missile impact. - Abstract: Steel-plate composite (SC) walls consist of a plain concrete core reinforced with two steel faceplates on the surfaces. Modules (consisting of steel faceplates, shear connectors and tie-bars) can be shop-fabricated and shipped to the site for erection and concrete casting, which expedites construction schedule and thus economy. SC structures have recently been used in nuclear power plant designs and are being considered for the next generation of small modular reactors. Design for impactive and impulsive loading is an important consideration for SC walls in safety-related nuclear facilities. The authors have previously developed design methods to prevent local failure (perforation) of SC walls due to missile impact. This paper presents the development of static resistance functions for use in single-degree-of-freedom (SDOF) analyses to predict the maximum displacement response of SC walls subjected to missile impact and designed to resist local failure (perforation). The static resistance function for SC walls is developed using results of numerical analyses and parametric studies conducted using benchmarked 3D finite element (FE) models. The influence of various design parameters are discussed and used to develop idealized bilinear resistance functions for SC walls with fixed edges and simply supported edges. Results from dynamic non-linear FE analysis of SC panels subjected to rigid missile impact are compared with the maximum displacements predicted by SDOF analyses using the bilinear resistance function.

  10. Sc-Decorated Porous Graphene for High-Capacity Hydrogen Storage: First-Principles Calculations.

    Science.gov (United States)

    Chen, Yuhong; Wang, Jing; Yuan, Lihua; Zhang, Meiling; Zhang, Cairong

    2017-08-02

    The generalized gradient approximation (GGA) function based on density functional theory is adopted to investigate the optimized geometrical structure, electron structure and hydrogen storage performance of Sc modified porous graphene (PG). It is found that the carbon ring center is the most stable adsorbed position for a single Sc atom on PG, and the maximum number of adsorbed H₂ molecules is four with the average adsorption energy of -0.429 eV/H₂. By adding a second Sc atom on the other side of the system, the hydrogen storage capacity of the system can be improved effectively. Two Sc atoms located on opposite sides of the PG carbon ring center hole is the most suitable hydrogen storage structure, and the hydrogen storage capacity reach a maximum 9.09 wt % at the average adsorption energy of -0.296 eV/H₂. The adsorption of H₂ molecules in the PG system is mainly attributed to orbital hybridization among H, Sc, and C atoms, and Coulomb attraction between negatively charged H₂ molecules and positively charged Sc atoms.

  11. Establishment and characterization of Roberts syndrome and SC phocomelia model medaka (Oryzias latipes).

    Science.gov (United States)

    Morita, Akihiro; Nakahira, Kumiko; Hasegawa, Taeko; Uchida, Kaoru; Taniguchi, Yoshihito; Takeda, Shunichi; Toyoda, Atsushi; Sakaki, Yoshiyuki; Shimada, Atsuko; Takeda, Hiroyuki; Yanagihara, Itaru

    2012-06-01

    Roberts syndrome and SC phocomelia (RBS/SC) are genetic autosomal recessive syndromes caused by establishment of cohesion 1 homolog 2 ( ESCO 2) mutation. RBS/SC appear to have a variety of clinical features, even with the same mutation of the ESCO2 gene. Here, we established and genetically characterized a medaka model of RBS/SC by reverse genetics. The RBS/SC model was screened from a mutant medaka library produced by the Targeting Induced Local Lesions in Genomes method. The medaka mutant carrying the homozygous mutation at R80S in the conserved region of ESCO2 exhibited clinical variety (i.e. developmental arrest with craniofacial and chromosomal abnormalities and embryonic lethality) as characterized in RBS/SC. Moreover, widespread apoptosis and downregulation of some gene expression, including notch1a, were detected in the R80S mutant. The R80S mutant is the animal model for RBS/SC and a valuable resource that provides the opportunity to extend knowledge of ESCO2. Downregulation of some gene expression in the R80S mutant is an important clue explaining non-correlation between genotype and phenotype in RBS/SC. © 2012 The Authors Development, Growth & Differentiation © 2012 Japanese Society of Developmental Biologists.

  12. Improved Soluble ScFv ELISA Screening Approach for Antibody Discovery Using Phage Display Technology.

    Science.gov (United States)

    Tohidkia, Mohammad R; Sepehri, Maryam; Khajeh, Shirin; Barar, Jaleh; Omidi, Yadollah

    2017-09-01

    Phage display technology (PDT) is a powerful tool for the isolation of recombinant antibody (Ab) fragments. Using PDT, target molecule-specific phage-Ab clones are enriched through the "biopanning" process. The individual specific binders are screened by the monoclonal scFv enzyme-linked immunosorbent assay (ELISA) that may associate with inevitable false-negative results. Thus, in this study, three strategies were investigated for optimization of the scFvs screening using Tomlinson I and J libraries, including (1) optimizing the expression of functional scFvs, (2) improving the sensitivity of ELISA, and (3) preparing different samples containing scFvs. The expression of all scFv Abs was significantly enhanced when scFv clones were cultivated in the terrific broth (TB) medium at the optimum temperature of 30 °C. The protein A-conjugated with horseradish peroxidase (HRP) was found to be a well-suited reagent for the detection of Ag-bound scFvs in comparison with either anti-c-myc Ab or the mixing procedure. Based on our findings, it seems there is no universal media supplement for an improved expression of all scFvs derived from both Tomlinson I and J libraries. We thus propose that expression of scFv fragments in a microplate scale is largely dependent on a variety of parameters, in particular the scFv clones and relevant sequences.

  13. The semiclassical density of states for the quantum asymmetric top

    International Nuclear Information System (INIS)

    Agnew, Alfonso; Bourget, Alain

    2008-01-01

    In the quantization of a rotating rigid body, a top, one is concerned with the Hamiltonian operator L α = α 2 0 L 2 x + α 2 1 L 2 y + α 2 2 L 2 z , where α 0 ≤ α 1 ≤ α 2 . An explicit formula is known for the eigenvalues of L α in the case of the spherical top (α 1 = α 2 = α 3 ) and symmetrical top (α 1 = α 2 ≠ α 3 ) (Landau and Lifshitz 1981 Quantum Mechanics: Non-Relativistic Theory 3rd edn (Portsmouth, NH: Butterworth-Heinemann)). However, for the asymmetrical top, no such explicit expression exists, and the study of the spectrum is much more complex. In this paper, we compute the semiclassical density of states for the eigenvalues of the family of operators L α = α 2 0 L 2 x + α 2 1 L 2 y + α 2 2 L 2 z for any α 0 1 2

  14. Adventures of the coupled Yang-Mills oscillators: I. Semiclassical expansion

    International Nuclear Information System (INIS)

    Matinyan, Sergei G; Mueller, Berndt

    2006-01-01

    We study the quantum mechanical motion in the x 2 y 2 potentials with n 2, 3, which arise in the spatially homogeneous limit of the Yang-Mills (YM) equations. These systems show strong stochasticity in the classical limit (ℎ = 0) and exhibit a quantum mechanical confinement feature. We calculate the partition function Z(t) going beyond the Thomas-Fermi (TF) approximation by means of the semiclassical expansion using the Wigner-Kirkwood (WK) method. We derive a novel compact form of the differential equation for the WK function. After separating the motion in the channels of the equipotential surface from the motion in the central region, we show that the leading higher order corrections to the TF term vanish up to eighth order in ℎ, if we treat the quantum motion in the hyperbolic channels correctly by adiabatic separation of the degrees of freedom. Finally, we obtain an asymptotic expansion of the partition function in terms of the parameter g 2 ℎ 4 t 3

  15. Thermal spin pumping mediated by magnons in the semiclassical regime

    International Nuclear Information System (INIS)

    Nakata, Kouki

    2012-01-01

    We microscopically analyze thermal spin pumping mediated by magnons, at the interface between a ferromagnetic insulator and a non-magnetic metal, in the semiclassical regime. The generation of a spin current is discussed by calculating the thermal spin transfer torque, which breaks the spin conservation law for conduction electrons and operates the coherent magnon state. Inhomogeneous thermal fluctuations between conduction electrons and magnons induce a net spin current, which is pumped into the adjacent non-magnetic metal. The pumped spin current is proportional to the temperature difference. When the effective temperature of magnons is lower than that of conduction electrons, localized spins lose spin angular momentum by emitting magnons and conduction electrons flip from down to up by absorbing all the emitted momentum, and vice versa. Magnons at the zero mode cannot contribute to thermal spin pumping because they are eliminated by the spin-flip condition. Consequently thermal spin pumping does not cost any kind of applied magnetic fields

  16. Rotary condenser for SC2

    CERN Multimedia

    1975-01-01

    During 1975 the SC2 performance was improved among other things by redesigning some of the elements of the ROTCO (Annual Report 1975, p. 55). The photo shows an interior wiew of the housing of the rotary condenser and of the sixteen sets of shaped stator blades.

  17. An analysis of the accuracy of an initial value representation surface hopping wave function in the interaction and asymptotic regions

    International Nuclear Information System (INIS)

    Sergeev, Alexey; Herman, Michael F.

    2006-01-01

    The behavior of an initial value representation surface hopping wave function is examined. Since this method is an initial value representation for the semiclassical solution of the time independent Schroedinger equation for nonadiabatic problems, it has computational advantages over the primitive surface hopping wave function. The primitive wave function has been shown to provide transition probabilities that accurately compare with quantum results for model problems. The analysis presented in this work shows that the multistate initial value representation surface hopping wave function should approach the primitive result in asymptotic regions and provide transition probabilities with the same level of accuracy for scattering problems as the primitive method

  18. Low-β SC linacs: past, present, and future

    International Nuclear Information System (INIS)

    Bollinger, L. M.

    1998-01-01

    This paper is a general review of superconducting low-β technology and applications from its beginning in 1969 into the near-term future. The emphasis is on studies of accelerating resonators and on SC linacs that boost the energy of heavy-ion beams from tandem electrostatic accelerators used for nuclear-physics research. Other topics are positive-ion SC injectors to replace tandems and the need for accelerating structures with β outside of the present proven range, 0.008 < β < 0.2

  19. Semi-classical approaches for the proton emission in intermediate energy heavy ion reactions

    International Nuclear Information System (INIS)

    Gregoire, C.; Scheuter, F.; Remaud, B.; Sebille, F.

    1984-05-01

    Semi-classical approaches are proposed to study the transition between the one- and two-body processes in intermediate energy heavy ion collisions. The Landau-Vlasov equation is used as a transport equation for nucleons in the nuclear matter. We apply our formalism to the fast proton ejection. On the one hand, the effects of the nucleon-nucleon collisions are studied for the particles which travel through the nucleus cores. On the other hand, the inertial emission turns out to be an important proton emission mechanism. Our results conflict the interpretation of the proton spectra in terms of moving sources. Reasonable agreements with the experimental data are found without reference to any thermal equilibrium

  20. SC-HTGR Performance Impact for Arid Sites

    International Nuclear Information System (INIS)

    Lommers, L.; Geschwindt, J.; Southworth, F.; Shahrokhi, F.

    2014-01-01

    The SC-HTGR provides high temperature steam which can support industrial process heat applications as well as high efficiency electricity generation. The increased generating efficiency resulting from using high steam temperature provides greater plant output than lower temperature concepts, and it also reduces the fraction of waste heat which must be rejected. This capability is particularly attractive for sites with little or no water for heat rejection. This high temperature capability provides greater flexibility for these sites, and it results in a smaller performance penalty than for lower temperature systems when dry cooling must be used. The performance of the SC-HTGR for a conventional site with wet cooling is discussed first. Then the performance for arid sites is evaluated. Dry cooling performance is evaluated for both moderately arid sites and very hot sites. Offdesign performance of the dry cooling system under extreme conditions is also considered. Finally, operating strategies are explored for sites where some cooling water may be available but only in very limited quantities. Results of these assessments confirm that the higher operating temperatures of the SC-HTGR are very beneficial for arid sites, providing significant advantages for both gross and net power generation. (author)

  1. Technical Training: CERN Technical Training 2004 - New Short Courses (SC) on Microsoft Outlook

    CERN Multimedia

    Monique Duval

    2004-01-01

    The CERN Technical Training programme is now proposing a new format for courses on Microsoft Outlook. Three two-hours Short Courses (SC) will cover basic and advanced functionalities of the recommended mail client for email at CERN. Each module can be followed independently. The next scheduled sessions will take place as follows: Outlook (SC I): E-mail. Next session: 31.8.2004 (9h00-11h00) Outlook (SC II): Calendar, Tasks and Notes. Next session: 31.8.2004 (14h00-16h00) Outlook (SC III): Meetings and Delegation. Next session: 7.9.2004 (14h00-16h00) In particular, SC I will cover how to open, create and send email, work with attachments, use stationery, organise mail, and work with the address book, SC II will show how to work with the calendar, tasks and notes, and SC III will cover how to organise and manage meetings, work with meeting requests, share tasks, and use email and calendar delegation. The number of participants to each session is limited to 8. The instructor is English-French bilingual, and s...

  2. Semiclassical wave packet treatment of scattering resonances: application to the delta zero-point energy effect in recombination reactions.

    Science.gov (United States)

    Vetoshkin, Evgeny; Babikov, Dmitri

    2007-09-28

    For the first time Feshbach-type resonances important in recombination reactions are characterized using the semiclassical wave packet method. This approximation allows us to determine the energies, lifetimes, and wave functions of the resonances and also to observe a very interesting correlation between them. Most important is that this approach permits description of a quantum delta-zero-point energy effect in recombination reactions and reproduces the anomalous rates of ozone formation.

  3. Sc-Decorated Porous Graphene for High-Capacity Hydrogen Storage: First-Principles Calculations

    Directory of Open Access Journals (Sweden)

    Yuhong Chen

    2017-08-01

    Full Text Available The generalized gradient approximation (GGA function based on density functional theory is adopted to investigate the optimized geometrical structure, electron structure and hydrogen storage performance of Sc modified porous graphene (PG. It is found that the carbon ring center is the most stable adsorbed position for a single Sc atom on PG, and the maximum number of adsorbed H2 molecules is four with the average adsorption energy of −0.429 eV/H2. By adding a second Sc atom on the other side of the system, the hydrogen storage capacity of the system can be improved effectively. Two Sc atoms located on opposite sides of the PG carbon ring center hole is the most suitable hydrogen storage structure, and the hydrogen storage capacity reach a maximum 9.09 wt % at the average adsorption energy of −0.296 eV/H2. The adsorption of H2 molecules in the PG system is mainly attributed to orbital hybridization among H, Sc, and C atoms, and Coulomb attraction between negatively charged H2 molecules and positively charged Sc atoms.

  4. Emission ability of La-Sc-Mo cathode

    International Nuclear Information System (INIS)

    Yang Jiancan; Nie Zuoren; Xi Xiaoli; Wang Yiman

    2004-01-01

    In this paper La-Sc-Mo cathode has been prepared and its electron emission ability was measured. This type of cathode shows good electron emission performance that the saturated current density is 6.74 A cm -1 and the work function is about 2.59 eV at 1300 deg. C, which is much lower than thoriated tungsten cathode (Th-W). So it is a potential cathode to replace the Th-W cathode with radioactive pollution. Surface analysis shows that good emission ability due to the 20 nm surplus La layer and the element Sc may do good to the La diffusion to the surface

  5. Asymmetric recombination and electron spin relaxation in the semiclassical theory of radical pair reactions

    International Nuclear Information System (INIS)

    Lewis, Alan M.; Manolopoulos, David E.; Hore, P. J.

    2014-01-01

    We describe how the semiclassical theory of radical pair recombination reactions recently introduced by two of us [D. E. Manolopoulos and P. J. Hore, J. Chem. Phys. 139, 124106 (2013)] can be generalised to allow for different singlet and triplet recombination rates. This is a non-trivial generalisation because when the recombination rates are different the recombination process is dynamically coupled to the coherent electron spin dynamics of the radical pair. Furthermore, because the recombination operator is a two-electron operator, it is no longer sufficient simply to consider the two electrons as classical vectors: one has to consider the complete set of 16 two-electron spin operators as independent classical variables. The resulting semiclassical theory is first validated by comparison with exact quantum mechanical results for a model radical pair containing 12 nuclear spins. It is then used to shed light on the spin dynamics of a carotenoid-porphyrin-fullerene triad containing considerably more nuclear spins which has recently been used to establish a “proof of principle” for the operation of a chemical compass [K. Maeda, K. B. Henbest, F. Cintolesi, I. Kuprov, C. T. Rodgers, P. A. Liddell, D. Gust, C. R. Timmel, and P. J. Hore, Nature (London) 453, 387 (2008)]. We find in particular that the intriguing biphasic behaviour that has been observed in the effect of an Earth-strength magnetic field on the time-dependent survival probability of the photo-excited C ·+ PF ·− radical pair arises from a delicate balance between its asymmetric recombination and the relaxation of the electron spin in the carotenoid radical

  6. Mass number dependence of total neutron cross section; a discussion based on the semi-classical optical model

    International Nuclear Information System (INIS)

    Angeli, Istvan

    1990-01-01

    The dependence of total neutron cross section on mass number can be calculated by the black nucleus formula, according to the optical model. The fine structure of mass number dependence is studied, and a correction factor formula is given on the basis of a semi-classical optical model. Yielding results in good agreement with experimental data. In addition to the mass number dependence, the neutron-energy dependence can also be calculated using this model. (K.A.)

  7. DIMM-SC: a Dirichlet mixture model for clustering droplet-based single cell transcriptomic data.

    Science.gov (United States)

    Sun, Zhe; Wang, Ting; Deng, Ke; Wang, Xiao-Feng; Lafyatis, Robert; Ding, Ying; Hu, Ming; Chen, Wei

    2018-01-01

    Single cell transcriptome sequencing (scRNA-Seq) has become a revolutionary tool to study cellular and molecular processes at single cell resolution. Among existing technologies, the recently developed droplet-based platform enables efficient parallel processing of thousands of single cells with direct counting of transcript copies using Unique Molecular Identifier (UMI). Despite the technology advances, statistical methods and computational tools are still lacking for analyzing droplet-based scRNA-Seq data. Particularly, model-based approaches for clustering large-scale single cell transcriptomic data are still under-explored. We developed DIMM-SC, a Dirichlet Mixture Model for clustering droplet-based Single Cell transcriptomic data. This approach explicitly models UMI count data from scRNA-Seq experiments and characterizes variations across different cell clusters via a Dirichlet mixture prior. We performed comprehensive simulations to evaluate DIMM-SC and compared it with existing clustering methods such as K-means, CellTree and Seurat. In addition, we analyzed public scRNA-Seq datasets with known cluster labels and in-house scRNA-Seq datasets from a study of systemic sclerosis with prior biological knowledge to benchmark and validate DIMM-SC. Both simulation studies and real data applications demonstrated that overall, DIMM-SC achieves substantially improved clustering accuracy and much lower clustering variability compared to other existing clustering methods. More importantly, as a model-based approach, DIMM-SC is able to quantify the clustering uncertainty for each single cell, facilitating rigorous statistical inference and biological interpretations, which are typically unavailable from existing clustering methods. DIMM-SC has been implemented in a user-friendly R package with a detailed tutorial available on www.pitt.edu/∼wec47/singlecell.html. wei.chen@chp.edu or hum@ccf.org. Supplementary data are available at Bioinformatics online. © The Author

  8. Semiclassical study of the collision of a highly excited Rydberg atom with the molecules HF and HCl

    International Nuclear Information System (INIS)

    Kimura, M.; Lane, N.F.

    1990-01-01

    The semiclassical impact-parameter method is applied to the processes of state changing and energy transfer in the collision of a highly excited Rydberg atom (n≥20) with the polar molecules HF and HCl. The relative motion of the molecule and atomic nucleus is taken to be rectilinear; the electron-molecule and ion core-molecule interactions are represented by cutoff dipole forms. Cross sections for transitions involving quantum numbers n and l of the atom and rotational quantum number j of the molecule are obtained for a range of collision energies and initial atomic and molecular states. Comparisons are made with the results of earlier classical studies and with the quantum-mechanical impulse approximation. Collision rates are calculated and compared with experimental values for l mixing and n and j changing. The agreement between experiment and theory is shown to be satisfactory, within the uncertainties of both the measurements and the theory. Cases of agreement and disagreement between various theories are examined. One finding of the present work is that the quantum-mechanical impulse approximation appears to significantly overestimate the values of various state-changing cross sections when the internal energy defect is small. The validity of the impulse approximation for collisions of Rydberg atoms with polar molecules is discussed

  9. Semiclassical asymptotics for the scattering amplitude in the presence of focal points at infinity

    Energy Technology Data Exchange (ETDEWEB)

    Hohberger, H.

    2006-10-16

    We consider scattering in R{sup n}, n{>=}2, described by the Schroedinger operator P(h)=-h{sup 2}{delta}+V, where V is a short-range potential. With the aid of Maslov theory, we give a geometrical formula for the semiclassical asymptotics as h{yields}0 of the scattering amplitude f({omega}{sub -},{omega}{sub +};{lambda},h) ({omega}{sub +}{ne}{omega}{sub -}) which remains valid in the presence of focal points at infinity (caustics). Crucial for this analysis are precise estimates on the asymptotics of the classical phase trajectories and the relationship between caustics in euclidean phase space and caustics at infinity. (orig.)

  10. 4SC-202 activates ASK1-dependent mitochondrial apoptosis pathway to inhibit hepatocellular carcinoma cells

    International Nuclear Information System (INIS)

    Fu, Meili; Wan, Fuqiang; Li, Zhengling; Zhang, Fenghua

    2016-01-01

    The aim of the present study is to investigate the potential anti-hepatocellular carcinoma (HCC) cell activity by 4SC-202, a novel class I HDAC inhibitor (HDACi). The associated signaling mechanisms were also analyzed. We showed that 4SC-202 treatment induced potent cytotoxic and proliferation–inhibitory activities against established HCC cell lines (HepG2, HepB3, SMMC-7721) and patient-derived primary HCC cells. Further, adding 4SC-202 in HCC cells activated mitochondrial apoptosis pathway, which was evidenced by mitochondrial permeability transition pore (mPTP) opening, cytochrome C cytosol release and caspase-3/-9 activation. Inhibition of this apoptosis pathway, by caspase-3/-9 inhibitors, mPTP blockers, or by shRNA-mediated knockdown of cyclophilin-D (Cyp-D, a key component of mPTP), significantly attenuated 4SC-202-induced HCC cell death and apoptosis. Reversely, over-expression of Cyp-D enhanced 4SC-202's sensitivity in HCC cells. Further studies showed that 4SC-202 induced apoptosis signal-regulating kinase 1 (ASK1) activation, causing it translocation to mitochondria and physical association with Cyp-D. This mitochondrial ASK1-Cyp-D complexation appeared required for mediating 4SC-202-induced apoptosis activation. ASK1 stable knockdown by targeted-shRNAs largely inhibited 4SC-202-induced mPTP opening, cytochrome C release, and following HCC cell apoptotic death. Together, we suggest that 4SC-202 activates ASK1-dependent mitochondrial apoptosis pathway to potently inhibit human HCC cells. - Highlights: • 4SC-202 exerts potent anti-proliferative and cytotoxic activity against established/primary HCC cells. • SC-202-induced anti-HCC cell activity relies on caspase-dependent apoptosis activation. • 4SC-202 activates Cyp-D-dependent mitochondrial apoptosis pathway in HCC cells. • 4SC-202 activates ASK1 in HCC cells, causing it translocation to mitochondria. • Mitochondrial ASK1-Cyp-D complexation mediates 4SC-202's activity in HCC cells.

  11. 4SC-202 activates ASK1-dependent mitochondrial apoptosis pathway to inhibit hepatocellular carcinoma cells

    Energy Technology Data Exchange (ETDEWEB)

    Fu, Meili, E-mail: fumeilidrlinyi@tom.com [Department of Infectious Disease, Linyi People' s Hospital, Linyi 276000 (China); Wan, Fuqiang [Department of Head and Neck Surgery, Linyi Tumor Hospital, Linyi 276000 (China); Li, Zhengling [Department of Nursing, Tengzhou Central People' s Hospital, Tengzhou 277500 (China); Zhang, Fenghua [Department of Operating Room, Linyi People' s Hospital, Linyi 276000 (China)

    2016-03-04

    The aim of the present study is to investigate the potential anti-hepatocellular carcinoma (HCC) cell activity by 4SC-202, a novel class I HDAC inhibitor (HDACi). The associated signaling mechanisms were also analyzed. We showed that 4SC-202 treatment induced potent cytotoxic and proliferation–inhibitory activities against established HCC cell lines (HepG2, HepB3, SMMC-7721) and patient-derived primary HCC cells. Further, adding 4SC-202 in HCC cells activated mitochondrial apoptosis pathway, which was evidenced by mitochondrial permeability transition pore (mPTP) opening, cytochrome C cytosol release and caspase-3/-9 activation. Inhibition of this apoptosis pathway, by caspase-3/-9 inhibitors, mPTP blockers, or by shRNA-mediated knockdown of cyclophilin-D (Cyp-D, a key component of mPTP), significantly attenuated 4SC-202-induced HCC cell death and apoptosis. Reversely, over-expression of Cyp-D enhanced 4SC-202's sensitivity in HCC cells. Further studies showed that 4SC-202 induced apoptosis signal-regulating kinase 1 (ASK1) activation, causing it translocation to mitochondria and physical association with Cyp-D. This mitochondrial ASK1-Cyp-D complexation appeared required for mediating 4SC-202-induced apoptosis activation. ASK1 stable knockdown by targeted-shRNAs largely inhibited 4SC-202-induced mPTP opening, cytochrome C release, and following HCC cell apoptotic death. Together, we suggest that 4SC-202 activates ASK1-dependent mitochondrial apoptosis pathway to potently inhibit human HCC cells. - Highlights: • 4SC-202 exerts potent anti-proliferative and cytotoxic activity against established/primary HCC cells. • SC-202-induced anti-HCC cell activity relies on caspase-dependent apoptosis activation. • 4SC-202 activates Cyp-D-dependent mitochondrial apoptosis pathway in HCC cells. • 4SC-202 activates ASK1 in HCC cells, causing it translocation to mitochondria. • Mitochondrial ASK1-Cyp-D complexation mediates 4SC-202's activity in HCC cells.

  12. On the Anticipatory Aspects of the Four Interactions: what the Known Classical and Semi-Classical Solutions Teach us

    International Nuclear Information System (INIS)

    Lusanna, Luca

    2004-01-01

    The four (electro-magnetic, weak, strong and gravitational) interactions are described by singular Lagrangians and by Dirac-Bergmann theory of Hamiltonian constraints. As a consequence a subset of the original configuration variables are gauge variables, not determined by the equations of motion. Only at the Hamiltonian level it is possible to separate the gauge variables from the deterministic physical degrees of freedom, the Dirac observables, and to formulate a well posed Cauchy problem for them both in special and general relativity. Then the requirement of causality dictates the choice of retarded solutions at the classical level. However both the problems of the classical theory of the electron, leading to the choice of (1/2) (retarded + advanced) solutions, and the regularization of quantum field theory, leading to the Feynman propagator, introduce anticipatory aspects. The determination of the relativistic Darwin potential as a semi-classical approximation to the Lienard-Wiechert solution for particles with Grassmann-valued electric charges, regularizing the Coulomb self-energies, shows that these anticipatory effects live beyond the semi-classical approximation (tree level) under the form of radiative corrections, at least for the electro-magnetic interaction.Talk and 'best contribution' at The Sixth International Conference on Computing Anticipatory Systems CASYS'03, Liege August 11-16, 2003

  13. Reconciling semiclassical and Bohmian mechanics. III. Scattering states for continuous potentials

    International Nuclear Information System (INIS)

    Trahan, Corey; Poirier, Bill

    2006-01-01

    In a previous paper [B. Poirier, J. Chem. Phys. 121, 4501 (2004)] a unique bipolar decomposition Ψ=Ψ 1 +Ψ 2 was presented for stationary bound states Ψ of the one-dimensional Schroedinger equation, such that the components Ψ 1 and Ψ 2 approach their semiclassical WKB analogs in the large-action limit. The corresponding bipolar quantum trajectories, as defined in the usual Bohmian mechanical formulation, are classical-like and well behaved, even when Ψ has many nodes or is wildly oscillatory. A modification for discontinuous potential stationary scattering states was presented in a second, companion paper [C. Trahan and B. Poirier, J. Chem. Phys.124, 034115 (2006), previous paper], whose generalization for continuous potentials is given here. The result is an exact quantum scattering methodology using classical trajectories. For additional convenience in handling the tunneling case, a constant-velocity-trajectory version is also developed

  14. Thermoelectric performance of functionalized Sc2C MXenes

    KAUST Repository

    Kumar, S.; Schwingenschlö gl, Udo

    2016-01-01

    Functionalization of the MXene Sc2C, which has the rare property to realize semiconducting states for various functionalizations including O, F, and OH, is studied with respect to the electronic and thermal behavior. The lowest lattice thermal conductivity is obtained for OH functionalization and an additional 30% decrease can be achieved by confining the phonon mean free path to 100 nm. Despite a relatively low Seebeck coefficient, Sc2C(OH)2 is a candidate for intermediate-temperature thermoelectric applications due to compensation by a high electrical conductivity and very low lattice thermal conductivity.

  15. Thermoelectric performance of functionalized Sc2C MXenes

    KAUST Repository

    Kumar, S.

    2016-07-05

    Functionalization of the MXene Sc2C, which has the rare property to realize semiconducting states for various functionalizations including O, F, and OH, is studied with respect to the electronic and thermal behavior. The lowest lattice thermal conductivity is obtained for OH functionalization and an additional 30% decrease can be achieved by confining the phonon mean free path to 100 nm. Despite a relatively low Seebeck coefficient, Sc2C(OH)2 is a candidate for intermediate-temperature thermoelectric applications due to compensation by a high electrical conductivity and very low lattice thermal conductivity.

  16. Energy Levels and Radiative Rates for Transitions in F-like Sc XIII and Ne-like Sc XII and Y XXX

    Directory of Open Access Journals (Sweden)

    Kanti M. Aggarwal

    2018-05-01

    Full Text Available Energy levels, radiative rates and lifetimes are reported for F-like Sc XIII and Ne-like Sc XII and Y XXX for which the general-purpose relativistic atomic structure package (GRASP has been adopted. For all three ions, limited data exist in the literature but comparisons have been made wherever possible to assess the accuracy of the calculations. In the present work, the lowest 102, 125 and 139 levels have been considered for the respective ions. Additionally, calculations have also been performed with the flexible atomic code (FAC to (particularly confirm the accuracy of energy levels.

  17. An ideal scintillator – ZnO:Sc for sub-nanosecond pulsed radiation detection

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, Kan, E-mail: zhangkan8414@163.com [Northwest Institute of Nuclear Technology, Xi’an 710024 (China); Ouyang, Xiaoping [Northwest Institute of Nuclear Technology, Xi’an 710024 (China); Xi’an Jiaotong University, Xi’an 710049 (China); Song, Zhaohui; Han, Hetong [Northwest Institute of Nuclear Technology, Xi’an 710024 (China); Zuo, Yanbin [China Nonferrous Metal Guilin Research Institute of Geology for Mineral Resource, Guilin 541004 (China); Guan, Xingyin [Northwest Institute of Nuclear Technology, Xi’an 710024 (China); Xi’an Jiaotong University, Xi’an 710049 (China); Tan, Xinjian; Zhang, Zichuan; Liu, Junhong [Northwest Institute of Nuclear Technology, Xi’an 710024 (China)

    2014-08-21

    ZnO-based scintillators are particularly well suited for use as ultrafast pulsed radiation detectors which have shown broad application prospects in various fields such as the inertial confinement fusion (ICF) diagnosis, the nuclear reaction mechanism, etc. Using the hydro-thermal method, a ZnO single-crystal doped with Scandium (ZnO:Sc) sample was prepared. As a new ZnO-based scintillator, the scintillation characteristics of ZnO:Sc have not been reported previously. In this paper, optical and scintillation characteristics of ZnO:Sc single-crystal were studied. Also a scintillation detector based on ZnO:Sc was designed. Excited by the alpha-particle, the rise time of ZnO:Sc detectors was from 162.5 to 170.7 ps, and the fall time was from 300.4 to 328.8 ps.

  18. An ideal scintillator – ZnO:Sc for sub-nanosecond pulsed radiation detection

    International Nuclear Information System (INIS)

    Zhang, Kan; Ouyang, Xiaoping; Song, Zhaohui; Han, Hetong; Zuo, Yanbin; Guan, Xingyin; Tan, Xinjian; Zhang, Zichuan; Liu, Junhong

    2014-01-01

    ZnO-based scintillators are particularly well suited for use as ultrafast pulsed radiation detectors which have shown broad application prospects in various fields such as the inertial confinement fusion (ICF) diagnosis, the nuclear reaction mechanism, etc. Using the hydro-thermal method, a ZnO single-crystal doped with Scandium (ZnO:Sc) sample was prepared. As a new ZnO-based scintillator, the scintillation characteristics of ZnO:Sc have not been reported previously. In this paper, optical and scintillation characteristics of ZnO:Sc single-crystal were studied. Also a scintillation detector based on ZnO:Sc was designed. Excited by the alpha-particle, the rise time of ZnO:Sc detectors was from 162.5 to 170.7 ps, and the fall time was from 300.4 to 328.8 ps

  19. Chronic hypoxia suppresses the CO2 response of solitary complex (SC) neurons from rats.

    Science.gov (United States)

    Nichols, Nicole L; Wilkinson, Katherine A; Powell, Frank L; Dean, Jay B; Putnam, Robert W

    2009-09-30

    We studied the effect of chronic hypobaric hypoxia (CHx; 10-11% O(2)) on the response to hypercapnia (15% CO(2)) of individual solitary complex (SC) neurons from adult rats. We simultaneously measured the intracellular pH and firing rate responses to hypercapnia of SC neurons in superfused medullary slices from control and CHx-adapted adult rats using the blind whole cell patch clamp technique and fluorescence imaging microscopy. We found that CHx caused the percentage of SC neurons inhibited by hypercapnia to significantly increase from about 10% up to about 30%, but did not significantly alter the percentage of SC neurons activated by hypercapnia (50% in control vs. 35% in CHx). Further, the magnitudes of the responses of SC neurons from control rats (chemosensitivity index for activated neurons of 166+/-11% and for inhibited neurons of 45+/-15%) were the same in SC neurons from CHx-adapted rats. This plasticity induced in chemosensitive SC neurons by CHx appears to involve intrinsic changes in neuronal properties since they were the same in synaptic blockade medium.

  20. Strongly coupled semiclassical plasma: interaction model and some properties

    International Nuclear Information System (INIS)

    Baimbetov, N.F.; Bekenov, N.A.

    1999-01-01

    In the report a fully ionized strongly coupled hydrogen plasma is considered. The density number is considered within range n=n e =n i ≅(10 21 -2·10 25 )sm -3 , and the temperature domian is T≅(5·10 4 -10 6 ) K. The coupling parameter Γ is defined by Γ=e 2 /αk B T, where k B is the Boltzmann constant and e is electrical charge, α=(3/4πn) 1/3 is the average distance between the particles (Wigner-Seitz radius). The dimensionless density parameter r s =α/α B is given in terms of the Bohr radius α B =ℎ 2 /me 2 ∼0.529·10 - 8 sm. The degeneracy parameter for the electron was defined by the ratio between the thermal energy k B T and the Fermi energy E F :Θ=k B T/E F ∼0.54·r s /Γ. The intermediate temperature-density region, where Γ≥1; Θ≅1; T>13.6 eV is examined. A semiclassical effective potential which account for the short-range, quantum diffraction and symmetry effects of charge carriers screening