Finite element calculations for systems with multiple Coulomb centers
DOI10.1016/J.CAM.2012.02.005zbMATH Open1252.82065OpenAlexW2061444241MaRDI QIDQ448453FDOQ448453
Authors: Moritz Braun
Publication date: 6 September 2012
Published in: Journal of Computational and Applied Mathematics (Search for Journal in Brave)
Full work available at URL: https://doi.org/10.1016/j.cam.2012.02.005
Recommendations
- Finite difference schemes and block Rayleigh quotient iteration for electronic structure calculations on composite grids
- Finite Element Approximations to the Discrete Spectrum of the Schrödinger Operator with the Coulomb Potential
- Computational considerations in solving the many electron problem for molecular systems
- Efficient evaluation of the matrix elements of the Coulomb potential between plane waves and Gaussians
- Density functional theory calculations using the finite element method
method of finite elements\texttt{Fortran}\texttt{Python}Coulomb centercusp conditioneffective Schrödinger equation
NLS equations (nonlinear Schrödinger equations) (35Q55) Finite element, Rayleigh-Ritz and Galerkin methods for boundary value problems involving PDEs (65N30) Interacting particle systems in time-dependent statistical mechanics (82C22)
Cites Work
Cited In (2)
Uses Software
This page was built for publication: Finite element calculations for systems with multiple Coulomb centers
Report a bug (only for logged in users!)Click here to report a bug for this page (MaRDI item Q448453)