The effect of Pauli repulsion on the molecular exchange-correlation Kohn-Sham potential. A comparitive calculation of Ne2 and N2.

  • O.V. Gritsenko
  • , P.R.T. Schipper
  • , E.J. Baerends

    Research output: Contribution to JournalArticleAcademicpeer-review

    497 Downloads (Pure)
    Original languageEnglish
    Pages (from-to)3450-3457
    JournalPhysical Review A. Atomic, Molecular and Optical Physics
    Volume57
    DOIs
    Publication statusPublished - 1998

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