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A finite element methodology for large classes of variational boundary value problems is defined which involves discretizing two linear operators: (1) the differential operator defining the spatial boundary value problem; and (2) a Riesz…

Numerical Analysis · Mathematics 2017-12-08 Brendan Keith , Socratis Petrides , Federico Fuentes , Leszek Demkowicz

We present a method that gives highly accurate electrostatic potentials for systems where we have periodic boundary conditions in two spatial directions but free boundary conditions in the third direction. These boundary conditions are…

Materials Science · Physics 2009-11-13 Luigi Genovese , Thierry Deutsch , Stefan Goedecker

In this paper we present a novel fast method to solve Poisson equation in an arbitrary two dimensional region with Neumann boundary condition. The basic idea is to solve the original Poisson problem by a two-step procedure: the first one…

Mathematical Physics · Physics 2012-07-19 Zu-Hui Ma , Weng Cho Chew , Lijun Jiang

The one-dimensional Vlasov-Poisson system is considered and a particle method is developed to approximate solutions without compact support which tend to a fixed background of charge as $| x | \to \infty$. Such a system of equations can be…

Numerical Analysis · Mathematics 2014-01-03 Stephen Pankavich

In this paper, we study the well-posedness of Poisson-Nernst-Planck system with no-flux boundary condition and singular permanent charges in two dimension. The main difficulty comes from the lack of integrability of singular permanent…

Analysis of PDEs · Mathematics 2021-10-14 Chia-Yu Hsieh , Yong Yu

We present an explicit solver of the three-dimensional screened and unscreened Poisson's equation which combines accuracy, computational efficiency and versatility. The solver, based on a mixed plane-wave / interpolating scaling function…

Materials Science · Physics 2013-03-27 Alessandro Cerioni , Luigi Genovese , Alessandro Mirone , Vicente Armando Sole

We review two common numerical schemes for Coulomb potential evaluation that differ only in their radial part of the solutions in the spherical harmonic expansion (SHE). One is based on finite-difference method (FDM) while the other is…

Chemical Physics · Physics 2022-05-25 Po-Hao Chang , Zachary Buschmann , Rajendra R. Zope

We propose an Extended Hybrid High-Order scheme for the Poisson problem with solution possessing weak singularities. Some general assumptions are stated on the nature of this singularity and the remaining part of the solution. The method is…

Numerical Analysis · Mathematics 2022-05-16 Liam Yemm

We present a method for treatment of three charged particles. The proposed method has universal character and is applicable both for bound and continuum states. A finite rank approximation is used for Coulomb potential in three-body system…

Nuclear Theory · Physics 2010-12-16 Vladimir B. Belyaev , Andrey A. Naumkin

We construct and analyze a finite volume scheme for numerical solution of a three-dimensional Poisson equation. This is an extension of a two-dimensional approach by Suli 1991. Here we derive optimal convergence rates in the discrete H^1…

Numerical Analysis · Mathematics 2014-06-20 Mohammad Asadzadeh , Krzysztof Bartoszek

In this work, we present two numerical methods to approximate solutions of systems of dissipative sine-Gordon equations that arise in the study of one-dimensional, semi-infinite arrays of Josephson junctions coupled through superconducting…

Numerical Analysis · Mathematics 2011-12-06 J. E. Macías-Díaz , S. Jerez-Galiano

We present a real-space adaptive-coordinate method, which combines the advantages of the finite-difference approach with the accuracy and flexibility of the adaptive coordinate method. The discretized Kohn-Sham equations are written in…

mtrl-th · Physics 2009-10-28 Francois Gygi , Giulia Galli

A variational approach is used to develop a robust numerical procedure for solving the nonlinear Poisson-Boltzmann equation. Following Maggs et al., we construct an appropriate constrained free energy functional, such that its…

Soft Condensed Matter · Physics 2020-04-29 M. Baptista , R. Schmitz , B. Duenweg

The Fast Multipole Method (FMM) provides a highly efficient computational tool for solving constant coefficient partial differential equations (e.g. the Poisson equation) on infinite domains. The solution to such an equation is given as the…

Numerical Analysis · Mathematics 2012-01-04 A. Gillman , P. G. Martinsson

Interpolating scaling functions give a faithful representation of a localized charge distribution by its values on a grid. For such charge distributions, using a Fast Fourier method, we obtain highly accurate electrostatic potentials for…

Materials Science · Physics 2009-11-11 Luigi Genovese , Thierry Deutsch , Alexey Neelov , Stefan Goedecker , Gregory Beylkin

Calculations of the ground state of inhomogeneous many-electron systems involve a solving of the Poisson equation for Coulomb potential and the Schroedinger equation for single-particle orbitals. Due to nonlinearity and complexity this set…

Materials Science · Physics 2009-11-11 A. Ya. Shul'man

We describe a new, adaptive solver for the two-dimensional Poisson equation in complicated geometries. Using classical potential theory, we represent the solution as the sum of a volume potential and a double layer potential. Rather than…

Numerical Analysis · Mathematics 2022-11-29 Fredrik Fryklund , Leslie Greengard

An efficient algorithm for solving Poisson's equation in two and three spatial dimensions is discussed. The algorithm, which is described in detail, is based on the integral form of Poisson's equation and utilizes spherical coordinates and…

Astrophysics · Physics 2009-10-22 Ewald Mueller , Matthias Steinmetz

This paper deals with a one-dimensional wave equation being subjected to a unilateral boundary condition. An approximation of this problem combining the finite element and mass redistribution methods is proposed. The mass redistribution…

Numerical Analysis · Mathematics 2016-01-06 Farshid Dabaghi , Pavel Krejci , Adrien Petrov , Jérôme Pousin , Yves Renard

Singular charge sources in terms of Dirac delta functions present a well-known numerical challenge for solving Poisson's equation. For a sharp interface between inhomogeneous media, singular charges could be analytically treated by…

Numerical Analysis · Mathematics 2019-10-02 Siwen Wang , Arum Lee , Emil Alexov , Shan Zhao