Theories for individual excited states

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6 Citations (Scopus)

Abstract

Variational and nonvariational density functional theories of a single excited state are reviewed. The asymptotic behavior of the exchange correlation potential in these theories is studied. Generalized OPM and KLI approximations are discussed. Cusp relation for the Kohn-Sham and exchange correlation potentials is proved in the KLI approximation.

Original languageEnglish
Pages (from-to)256-264
Number of pages9
JournalInternational Journal of Quantum Chemistry
Volume99
Issue number4
DOIs
Publication statusPublished - Jun 23 2004

Keywords

  • Asymptotic behavior of the exchange correlation potential
  • Cusp relation for the exchange correlation potential
  • Theories for a single excited state

ASJC Scopus subject areas

  • Atomic and Molecular Physics, and Optics
  • Condensed Matter Physics
  • Physical and Theoretical Chemistry

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