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We consider the singular semiclassical initial value problem for the phase space Schrodinger equation. We approximate semiclassical quantum evolution in phase space by analyzing initial states as superpositions of Gaussian wave packets and…

Mathematical Physics · Physics 2014-02-28 P. D. Karageorge , G. N. Makrakis

This paper concerns an approximation of the expectation values of the position and momentum of the solution to the semiclassical Schr\"odinger equation with a Gaussian as the initial condition. Of particular interest is the approximation…

Mathematical Physics · Physics 2021-10-28 Tomoki Ohsawa

In this paper, we integrate neural networks and Gaussian wave packets to numerically solve the Schr\"odinger equation with a smooth potential near the semi-classical limit. Our focus is not only on accurately obtaining solutions when the…

Computational Physics · Physics 2025-09-08 Jizu Huang , Rukang You , Tao Zhou

We assess the suitability of quantum and semiclassical initial value representations, exemplified by the coupled coherent states (CCS) method and the Herman Kluk (HK) propagator, respectively, for modeling the dynamics of an electronic wave…

Atomic Physics · Physics 2015-06-19 C. Zagoya , J. Wu , M. Ronto , D. V. Shalashilin , C. Figueira de Morisson Faria

Quantized systems whose underlying classical dynamics possess an elaborate mixture of regular and chaotic motion can exhibit rather subtle long-time quantum transport phenomena. In a short wavelength regime where semiclassical theories are…

Chaotic Dynamics · Physics 2013-05-29 Christoph-Marian Goletz , Frank Grossmann , Steven Tomsovic

We present a construction of the Anisotropic Gaussian Semi-Classical Schr\"{o}dinger Propagator, emblematic of a class of Fourier Integral Operators of quadratic phase kernels related to the Schr\"{o}dinger equation. We deduce a set of…

Mathematical Physics · Physics 2021-08-26 Panos D. Karageorge , George N. Makrakis

We review some recent results obtained for the time evolution of wave packets for systems of equations of pseudo-differential type, including Schr{\"o}dinger ones, and discuss their application to the approximation of the associated unitary…

Analysis of PDEs · Mathematics 2020-11-04 Clotilde Kammerer , Caroline Lasser , Didier Robert

The numerical treatment of quantum mechanics in the semi-classical regime is known to be computationally demanding, due to the highly oscillatory behaviour of the wave function and its large spatial extension. A recently proposed…

Quantum Physics · Physics 2024-02-13 Christoph Nölle

In this work, we study the semi-classical limit of the Schr\"odinger equation with random inputs, and show that the semi-classical Schr\"odinger equation produces $O(\varepsilon)$ oscillations in the random variable space. With the Gaussian…

Numerical Analysis · Mathematics 2019-10-14 Shi Jin , Liu Liu , Giovanni Russo , Zhennan Zhou

In this paper, we reformulate the semi-classical Schr\"odinger equation in the presence of electromagnetic field by the Gaussian wave packets transform. With this approach, the highly oscillatory Schr\"odinger equation is equivalently…

Numerical Analysis · Mathematics 2018-02-13 Zhennan Zhou , Giovanni Russo

Many approximate solutions of the time-dependent Schr\"odinger equation can be formulated as exact solutions of a nonlinear Schr\"odinger equation with an effective Hamiltonian operator depending on the state of the system. We show that…

Quantum Physics · Physics 2024-09-26 Jiří J. L. Vaníček

The semiclassically scaled time-dependent multi-particle Schr\"odinger equation describes, inter alia, quantum dynamics of nuclei in a molecule. It poses the combined computational challenges of high oscillations and high dimensions. This…

Numerical Analysis · Mathematics 2020-12-02 Caroline Lasser , Christian Lubich

In this article, we analyze the propagation of Wigner measures of a family of solutions to a system of semi-classical pseudodifferential equations presenting eigenvalues crossings on hypersurfaces. We prove the propagation along classical…

Mathematical Physics · Physics 2008-11-14 Thomas Duyckaerts , Clotilde Fermanian Kammerer , Thierry Jecko

We study the evolution of the most general initial Gaussian packet with nonzero correlation coefficient between the coordinate and momentum operators in the presence of a repulsive delta potential barrier, using the known exact propagator…

Quantum Physics · Physics 2014-01-17 V. V. Dodonov , A. V. Dodonov

We derive an exact analytical solution to the time-dependent Schr\"odinger equation for transmission of a Gaussian wave packet through an arbitrary potential of finite range. We consider the situation where the initial Gaussian wave packet…

Quantum Physics · Physics 2012-05-03 Sergio Cordero , Gaston Garcia-Calderon

We consider a model of an electron in a crystal moving under the influence of an external electric field: Schroedinger's equation in one spatial dimension with a potential which is the sum of a periodic function $V$ and a smooth function…

Mathematical Physics · Physics 2022-08-23 Alexander B. Watson , Michael I. Weinstein

We consider the propagation of wave packets for a nonlinear Schr\"odinger equation, with a matrix-valued potential, in the semi-classical limit. For a matrix-valued potential, Strichartz estimates are available under long range assumptions.…

Analysis of PDEs · Mathematics 2012-03-21 Lysianne Hari

We consider semi-classical time evolution for the phase space Schr\"{o}dinger equation. We construct a semi-classical phase space propagator in terms of semi-classical wave packets by the Anisotropic Gaussian Approximation, related to the…

Mathematical Physics · Physics 2020-05-19 P. D. Karageorge , G. N. Makrakis

We numerically compare the semiclassical ``frozen Gaussian'' Herman-Kluk propagator [Chem. Phys. 91, 27 (1984)] and the ``thawed Gaussian'' propagator put forward recently by Baranger et al. [J. Phys. A 34, 7227 (2001)] by studying the…

Quantum Physics · Physics 2009-11-10 C. Harabati , J. M. Rost , F. Grossmann

We consider semiclassically scaled, weakly nonlinear Schr\"odinger equations with external confining potentials and additional angular-momentum rotation term. This type of model arises in the Gross-Pitaevskii theory of trapped, rotating…

Analysis of PDEs · Mathematics 2024-08-05 Xiaoan Shen , Christof Sparber
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