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
Subject
Applied Mathematics,Modeling and Simulation,General Computer Science,Theoretical Computer Science
Cited by
2 articles.
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