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Related papers: Phase Space Approach to Solving the Time-independe…

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We propose a new method for solving quantum mechanical problems, which combines the flexibility of Gaussian basis set methods with the numerical accuracy of the Fourier method. The method is based on the incorporation of periodic boundary…

Quantum Physics · Physics 2010-10-14 Asaf Shimshovitz , David J. Tannor

The von Neumann lattice refers to a discrete basis of Gaussians located on a lattice in phase space. It provides an attractive approach for solving quantum mechanical problems, allowing the pruning of tensor-product basis sets using phase…

Quantum Physics · Physics 2016-03-15 Shai Machnes , Elie Assémat , David Tannor

In this paper, we propose a numerical method to approximate the solution of the time-dependent Schr\"odinger equation with periodic boundary condition in a high-dimensional setting. We discretize space by using the Fourier pseudo-spectral…

Numerical Analysis · Mathematics 2019-05-20 Yuya Suzuki , Dirk Nuyens

We approximate the solution for the time dependent Schr\"odinger equation (TDSE) in two steps. We first use a pseudo-spectral collocation method that uses samples of functions on rank-1 or rank-r lattice points with unitary Fourier…

Numerical Analysis · Mathematics 2020-07-01 Yuya Suzuki , Gowri Suryanarayana , Dirk Nuyens

We introduce a numerical method for the solution of the time-dependent Schrodinger equation with a smooth potential, based on its reformulation as a Volterra integral equation. We present versions of the method both for periodic boundary…

Numerical Analysis · Mathematics 2021-08-03 Jason Kaye , Alex Barnett , Leslie Greengard

Employing the phase-space representation of second order ordinary differential equations we developed a method to find the eigenvalues and eigenfunctions of the 1-dimensional time independent Schr\"odinger equation for quantum model…

Quantum Physics · Physics 2021-08-27 Juan C. Morales , Carlos A. Arango

Using the simplest but fundamental example, the problem of the infinite potential well, this paper makes an ideological attempt (supported by rigorous mathematical proofs) to approach the issue of…

Quantum Physics · Physics 2022-01-03 E. E. Perepelkin , B. I. Sadovnikov , N. G. Inozemtseva , I. I. Aleksandrov

A method of solving the time-dependent Schr\"odinger equation is presented, in which a finite region of space is treated explicitly, with the boundary conditions for matching the wave-functions on to the rest of the system replaced by an…

Materials Science · Physics 2009-11-13 J. E. Inglesfield

In the present paper we introduce a new methodology for the construction of numerical methods for the approximate solution of the one-dimensional Schr\"odinger equation. The new methodology is based on the requirement of vanishing the…

Numerical Analysis · Mathematics 2008-11-18 Z. A. Anastassi , D. S. Vlachos , T. E. Simos

The integrating factor technique is widely used to solve numerically (in particular) the Schr\"odinger equation in the context of spectral methods. Here, we present an improvement of this method exploiting the freedom provided by the gauge…

Analysis of PDEs · Mathematics 2023-02-14 Martino Lovisetto , D Clamond , B Marcos

We present a novel numerical method and algorithm for the solution of the 3D axially symmetric time-dependent Schr\"odinger equation in cylindrical coordinates, involving singular Coulomb potential terms besides a smooth time-dependent…

Atomic Physics · Physics 2017-07-11 Szilárd Majorosi , Attila Czirják

The time-dependent one-dimensional nonlinear Schr\"odinger equation (NLSE) is solved numerically by a hybrid pseudospectral-variational quantum algorithm that connects a pseudospectral step for the Hamiltonian term with a variational step…

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

The linear Schr\"odinger equation with piecewise constant potential in one spatial dimension is a well-studied textbook problem. It is one of only a few solvable models in quantum mechanics and shares many qualitative features with…

Analysis of PDEs · Mathematics 2018-07-02 Natalie E Sheils , Bernard Deconinck

A matrix inverse free method to solve time-dependent Schrodinger equation is presented. The method is not subject to form of Hamiltonian and adopting real space grid system such as structured and unstructured grid, and achieves the order N…

Computational Physics · Physics 2007-05-23 Katsuhiro Watanabe , Akihito Kikuchi

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

A variationally improved Sturmian approximation for solving time-independent Schr\"odinger equation is developed. This approximation is used to obtain the energy levels of a quartic anharmonic oscillator, a quartic potential, and a Gaussian…

Quantum Physics · Physics 2009-11-07 Ali Mostafazadeh

We consider the problem of constructing transparent boundary conditions for the time-dependent Schr\"odinger equation with a compactly supported binding potential and, if desired, a spatially uniform, time-dependent electromagnetic vector…

Numerical Analysis · Mathematics 2019-07-08 Jason Kaye , Leslie Greengard

In this paper, we present a simple analytical method for obtaining a nonspreading solution of the time-dependent Schr\"odinger equation, which is given by the Airy function. The solution is derived by imposing a restriction on the phase…

Quantum Physics · Physics 2016-12-19 Tamoghna Majumdar , Maitraya Kanta Bhattacharyya , Kumble Rajesh Nayak

We propose an approximate solution of the time-dependent Schr\"odinger equation using the method of stationary states combined with a variational matrix method for finding the energies and eigenstates. We illustrate the effectiveness of the…

Quantum Physics · Physics 2009-11-11 Paolo Amore , Alfredo Aranda , Francisco M. Fernandez , Hugh Jones
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