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In this study, a variety of methods are tested and compared for the numerical solution of the Schr\"odinger equation for few-body systems with explicitely time-dependent Hamiltonians, with the aim to find the optimal one. The configuration…

Quantum Physics · Physics 2013-02-01 Jonas C. Cremon

We show that a pseudospectral representation of the wavefunction using multiple spatial domains of variable size yields a highly accurate, yet efficient method to solve the time-dependent Schr\"odinger equation. The overall spatial domain…

Quantum Physics · Physics 2016-12-06 R. Esteban Goetz , Andrea Simoni , Christiane P. Koch

This paper presents a new technique to calculate the evolution of a quantum wavefunction in a chosen spatial basis by minimizing the accumulated action. Introduction of a finite temporal basis reduces the problem to a set of linear…

Computational Physics · Physics 2015-05-19 Zachary B. Walters

The semiclassical Schr\"{o}dinger equation with multiscale and random potentials often appears when studying electron dynamics in heterogeneous quantum systems. As time evolves, the wavefunction develops high-frequency oscillations in both…

Numerical Analysis · Mathematics 2019-07-02 Jingrun Chen , Dingjiong Ma , Zhiwen Zhang

We present an ab initio approach to solve the time-dependent Schr\"odinger equation to treat electron and photon impact multiple ionization of atoms or molecules. It combines the already known time scaled coordinate method with a new high…

We present a new parallel numerical method for solving the non-stationary Schr\"odinger equation with linear nonlocal condition and time-dependent potential which does not commute with the stationary part of the Hamiltonian. The given…

Numerical Analysis · Mathematics 2018-09-21 Dmytro Sytnyk

In this work, we propose an efficient and robust multigrid method for solving the time-fractional heat equation. Due to the nonlocal property of fractional differential operators, numerical methods usually generate systems of equations for…

Numerical Analysis · Mathematics 2017-08-28 Francisco J. Gaspar , Carmen Rodrigo

In this paper, the trial function method is employed to find the exact solutions for high-order nonlinear Schr\"odinger equations with time-dependent coefficients. This system describes the propagation of ultrashort light pulses in…

Pattern Formation and Solitons · Physics 2020-10-15 Xin-Lei Mai , Wei Li

The semiclassical Schr\"odinger equation with time-dependent potentials is an important model to study electron dynamics under external controls in the mean-field picture. In this paper, we propose two multiscale finite element methods to…

Computational Engineering, Finance, and Science · Computer Science 2019-09-17 Jingrun Chen , Sijing Li , Zhiwen Zhang

A global solution of the Schr\"odinger equation for explicitly time-dependent Hamiltonians is derived by integrating the non-linear differential equation associated with the time-dependent wave operator. A fast iterative solution method is…

Quantum Physics · Physics 2015-05-18 Arnaud Leclerc , Georges Jolicard

A detailed exposition of highly efficient and accurate method for the propagation of the time-dependent Schr\"odinger equation is presented. The method is readily generalized to solve an arbitrary set of ODE's. The propagation is based on a…

Quantum Physics · Physics 2017-05-12 Ido Schaefer , Hillel Tal-Ezer , Ronnie Kosloff

Linear combinations of complex gaussian functions, where the linear and nonlinear parameters are allowed to vary, are shown to provide an extremely flexible and effective approach for solving the time-dependent Schr\"odinger equation in one…

Quantum Physics · Physics 2023-03-08 Simen Kvaal , Caroline Lasser , Thomas Bondo Pedersen , Ludwik Adamowicz

We present an approach to numerically solving the time-dependent Schroedinger equation and other parabolic equations by the split-step technique with fast Fourier transform, which suppresses the backreflection of waves from the grid…

Atomic Physics · Physics 2007-05-23 A. A. Gonoskov , I. A. Gonoskov

The numerical simulation of the time-dependent Schr\"odinger equation for quantum systems is a very active research topic. Yet, resolving the solution sufficiently in space and time is challenging and mandates the use of modern…

Numerical Analysis · Mathematics 2020-06-11 Hannah Rittich , Robert Speck

We consider the expansion of wave packets governed by the free Schr\"odinger equation. This seemingly simple task plays an important role in simulations of various quantum experiments and in particular in the field of matter-wave…

Computational Physics · Physics 2023-03-17 Jan-Frederik Mennemann , Sebastian Erne , Igor Mazets , Norbert J. Mauser

We present a program to simulate the dynamics of a wave packet interacting with a time-dependent potential. The time-dependent Schr\"odinger equation is solved on a one-, two-, or three-dimensional spatial grid using the split operator…

Computational Physics · Physics 2013-11-21 C. M. Dion , A. Hashemloo , G. Rahali

Time-parallel methods can reduce the wall clock time required for the accurate numerical solution of differential equations by parallelizing across the time-dimension. In this paper, we present and test the convergence behavior of a…

Numerical Analysis · Mathematics 2025-02-03 Ignace Bossuyt , Giovanni Samaey , Stefan Vandewalle

It is shown how using the classical Hamilton-Jacobi equation one can arrive at the time-dependent wave equation. Although the former equation was originally used by E.Schroedinger to get the wave equation, we propose a different approach.…

Quantum Physics · Physics 2007-05-23 A. Granik

A propagator for the one dimensional time-dependent Schr\"odinger equation with an asymmetric rectangular potential is obtained using the multiple-scattering theory approach. It allows for the consideration of the reflection and…

Quantum Physics · Physics 2015-09-10 Victor F. Los , Mykola "Nicholas" V. Los

This report discusses two new ideas for using perturbation methods to solve the time-independent Schr\"odinger equation. The first concept begins with rewriting the perturbation equations in a form that is closely related to matrix…

Quantum Physics · Physics 2013-10-25 Gerald I. Kerley
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