The exact form of the Pauli potential for the ground state of two‐ and three‐level atoms and ions

A. Nagy, N. H. March

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Abstract

The square root of the electron density satisfies a Schrödinger equation having a correction term, called the Pauli potential, in addition to the Kohn–Sham potential. The Pauli potential is given in exact form for the ground state of two‐ and three‐level atoms and ions (e.g., Be and C). Expressions for the kinetic energy and the one‐body virial are also derived.

Original languageEnglish
Pages (from-to)615-623
Number of pages9
JournalInternational Journal of Quantum Chemistry
Volume39
Issue number4
DOIs
Publication statusPublished - 1991

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ASJC Scopus subject areas

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

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