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In order to solve the time-independent three-dimensional Schr\"odinger equation, one can transform the time-dependent Schr\"odinger equation to imaginary time and use a parallelized iterative method to obtain the full three-dimensional…

High Energy Physics - Phenomenology · Physics 2021-12-16 Rafael L. Delgado , Sebastian Steinbeißer , Michael Strickland , Johannes H. Weber

The Finite-Difference Time-Domain (FDTD) method is a well-known technique for the analysis of quantum devices. It solves a discretized Schrodinger equation in an explicitly iterative process. However, the method requires the spatial grid…

Quantum Physics · Physics 2012-12-05 Frederick Ira Moxley , Weizhong Dai

We describe a parallel algorithm for solving the time-independent 3d Schrodinger equation using the finite difference time domain (FDTD) method. We introduce an optimized parallelization scheme that reduces communication overhead between…

Quantum Physics · Physics 2014-11-18 Michael Strickland , David Yager-Elorriaga

In this paper, an improvement of the finite difference time domain (FDTD) method using a non-standard finite difference scheme is presented. The standard numerical scheme for the second derivative in the spatial domain is replaced by a…

Computational Physics · Physics 2018-08-21 I Wayan Sudiarta

A symplectic pseudospectral time-domain (SPSTD) scheme is developed to solve Schrodinger equation. Instead of spatial finite differences in conventional finite-difference time-domain (FDTD) method, the fast Fourier transform is used to…

Computational Physics · Physics 2018-05-09 Jing Shen , Wei E. I. Sha , Xiaojing Kuang , Jinhua Hu , Zhixiang Huang , Xianliang Wu

The finite difference time domain (FDTD) method has been successfully applied to obtain energies and wave functions for two electrons in a quantum dot modeled by a three dimensional harmonic potential. The FDTD method uses the…

Computational Physics · Physics 2017-06-12 I Wayan Sudiarta , Lily Maysari Angraini

Time-dependent density-functional theory (TDDFT) is a central tool for studying the dynamical electronic structure of molecules and solids, yet aspects of its mathematical foundations remain insufficiently understood. In this work, we…

We develop a quantum algorithm for solving high-dimensional time-fractional heat equations. By applying the dimension extension technique from [FKW23], the $d+1$-dimensional time-fractional equation is reformulated as a local partial…

Numerical Analysis · Mathematics 2025-09-25 Shi Jin , Nana Liu , Yue Yu

We study the relativistic version of Schr\"odinger equation for a point particle in 1-d with potential of the first derivative of the delta function. The momentum cutoff regularization is used to study the bound state and scattering states.…

High Energy Physics - Theory · Physics 2015-08-05 M. H. Al-Hashimi , A. M. Shalaby

The Schr\"odinger equation in the presence of an external electromagnetic field is an important problem in computational quantum mechanics. It also provides a nice example of a differential equation whose flow can be split with benefit into…

Numerical Analysis · Mathematics 2016-04-28 Marco Caliari , Alexander Ostermann , Chiara Piazzola

Accurately solving the Schr\"odinger equation remains a central challenge in computational physics, chemistry, and materials science. Here, we propose an alternative eigenvalue problem based on a system's autocorrelation function, avoiding…

Quantum Physics · Physics 2025-07-22 Timothy Stroschein , Davide Castaldo , Markus Reiher

The Finite Difference Time Domain (FDTD) method is a widely used numerical technique for solving Maxwell's equations, particularly in computational electromagnetics and photonics. It enables accurate modeling of wave propagation in complex…

Computation and Language · Computer Science 2025-04-15 Yifei He , Måns I. Andersson , Stefano Markidis

We discuss the functional Schroedinger picture for fermions in external fields for both stationary and time-dependent problems. We give formal results for the ground state and the solution of the time-dependent Schroedinger equation for QED…

High Energy Physics - Theory · Physics 2009-10-22 Claus Kiefer , Andreas Wipf

We introduce the concept of strong quantum speedup. We prove that approximating the ground state energy of an instance of the time-independent Schr\"odinger equation, with $d$ degrees of freedom, $d$ large, enjoys strong exponential quantum…

Quantum Physics · Physics 2013-09-04 Anargyros Papageorgiou , Joseph F. Traub

In this paper, we try to give a new approach to the quantum mechanics(QM) on the framework of quantum field theory(QFT). Firstly, we make a detail study on the (non-relativistic) Schr\"odinger field theory, obtaining the Schr\"odinger…

General Physics · Physics 2013-02-18 Yulei Feng

We present an efficient method for propagating the time-dependent Kohn-Sham equations in free space, based on the recently introduced Fourier contour deformation (FCD) approach. For potentials which are constant outside a bounded domain,…

Chemical Physics · Physics 2023-07-10 Jason Kaye , Alex Barnett , Leslie Greengard , Umberto De Giovannini , Angel Rubio

Considered is the Schr\"odinger equation in a finite-dimensional space as an equation of mathematical physics derivable from the variational principle and treatable in terms of the Lagrange-Hamilton formalism. It provides an interesting…

Mathematical Physics · Physics 2010-03-17 J. J. Sławianowski , V. Kovalchuk

An exactly solvable position-dependent mass Schr\"odinger equation in two dimensions, depicting a particle moving in a semi-infinite layer, is re-examined in the light of recent theories describing superintegrable two-dimensional systems…

Mathematical Physics · Physics 2008-04-24 Christiane Quesne

This paper addresses the focusing cubic-quintic nonlinear Schrodinger equation in three space dimensions. Especially, we study the global dynamics of solutions whose energy and mass equal to those of the ground state in the sprits of…

Analysis of PDEs · Mathematics 2022-10-18 Masaru Hamano , Hiroaki Kikuchi , Minami Watanabe

We analyze the Schr\"odingerization method for quantum simulation of a general class of non-unitary dynamics with inhomogeneous source terms. The Schr\"odingerization technique, introduced in [31], transforms any linear ordinary and partial…

Numerical Analysis · Mathematics 2025-04-15 Shi Jin , Nana Liu , Chuwen Ma
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