Numerical analysis of finite dimensional approximations of Kohn-Sham models

DOI10.1007/S10444-011-9235-YzbMath1278.35225arXiv1108.1891OpenAlexW2018566483MaRDI QIDQ1946518

Huajie Chen, Lianhua He, Zhang Yang, Xin-Gao Gong, Aihui Zhou

Publication date: 15 April 2013

Published in: Advances in Computational Mathematics (Search for Journal in Brave)

Full work available at URL: https://arxiv.org/abs/1108.1891

zbMATH Keywords

convergenceerror estimatenonlinear eigenvalue problemdensity functional theoryKohn-Sham equation

Mathematics Subject Classification ID

Error bounds for boundary value problems involving PDEs (65N15) Closed and approximate solutions to the Schrödinger, Dirac, Klein-Gordon and other equations of quantum mechanics (81Q05) Finite element, Rayleigh-Ritz and Galerkin methods for boundary value problems involving PDEs (65N30) NLS equations (nonlinear Schrödinger equations) (35Q55) Numerical methods for eigenvalue problems for boundary value problems involving PDEs (65N25)

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