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

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

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