Finite dimensional approximations for the electronic ground state solution of a molecular system

DOI10.1002/MMA.793zbMath1119.35095OpenAlexW2084303191MaRDI QIDQ3445537

Aihui Zhou

Publication date: 11 June 2007

Published in: Mathematical Methods in the Applied Sciences (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1002/mma.793

zbMATH Keywords

Galerkin discretizationnonlinear eigenvalueThomas-Fermi-von Weizsäcker 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)

Related Items (14)

The spectral-Galerkin approximation of nonlinear eigenvalue problems ⋮ Numerical analysis of nonlinear eigenvalue problems ⋮ Adaptive multigrid method for quantum eigenvalue problems ⋮ An overview of \textit{a posteriori} error estimation and post-processing methods for nonlinear eigenvalue problems ⋮ Multigrid method for nonlinear eigenvalue problems based on Newton iteration ⋮ Numerical analysis of finite dimensional approximations of Kohn-Sham models ⋮ Lindstedt Poincaré technique applied to molecular potentials ⋮ \({h-P}\) finite element approximation for full-potential electronic structure calculations ⋮ Finite element approximations of nonlinear eigenvalue problems in quantum physics ⋮ Two-scale finite element discretizations for nonlinear eigenvalue problems in quantum physics ⋮ Numerical approximations of a nonlinear eigenvalue problem and applications to a density functional model ⋮ On discrete ground states of rotating Bose-Einstein condensates ⋮ Multiscale Analysis and Computation for a Stationary Schrödinger--Poisson System in Heterogeneous Nanostructures ⋮ Adaptive Finite Element Approximations for Kohn--Sham Models

Cites Work

• Pair correlations and exchange phenomena in the free electron gas
• An Introduction to Banach Space Theory
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