Exchange and correlation energy in density functional theory. Comparison of accurate DFT quantities with traditional Hartree-Fock based ones and generalized gradient approximations for the molecules Li2, N2, F2.

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)5007
JournalJournal of Chemical Physics
Publication statusPublished - 1997

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