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Repartitioned Brillouin-Wigner perturbation theory with a size-consistent second-order correlation energy.
Carter-Fenk, Kevin; Head-Gordon, Martin.
  • Carter-Fenk K; Kenneth S. Pitzer Center for Theoretical Chemistry, Department of Chemistry, University of California, Berkeley, California 94720, USA.
  • Head-Gordon M; Kenneth S. Pitzer Center for Theoretical Chemistry, Department of Chemistry, University of California, Berkeley, California 94720, USA.
J Chem Phys ; 158(23)2023 Jun 21.
Article en En | MEDLINE | ID: mdl-37338032