Density Functional Theory of Highly Excited States of Coulomb Systems-Reference-Cited by-同舟云学术

Density Functional Theory of Highly Excited States of Coulomb Systems

Published:2021-06-21 Issue:6 Volume:9 Page:73
ISSN:2079-3197
Container-title:Computation
language:en
Short-container-title:Computation

Author:

Nagy Ágnes^ORCID

Abstract

The density functional theory proposed earlier for excited states of Coulomb systems is discussed. The localized Hartree–Fock (LHF) and the Krieger, Li, and Iafrate (KLI) methods combined with correlation are generalized for excited states. Illustrative examples include some highly excited states of Li and Na atoms.

Funder

Nemzeti Kutatási Fejlesztési és Innovációs Hivatal

Publisher

MDPI AG

Subject

Applied Mathematics,Modeling and Simulation,General Computer Science,Theoretical Computer Science

Link

https://www.mdpi.com/2079-3197/9/6/73/pdf

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