Open AccessCommunication: DFT treatment of strong correlation in 3d transition-metal diatomics
Author(s) -
Erin R. Johnson,
Axel D. Becke
Publication year - 2017
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/1.4985084
Subject(s) - diatomic molecule , density functional theory , electronic correlation , transition metal , work (physics) , chemistry , electron , atomic physics , computational chemistry , physics , quantum mechanics , molecule , catalysis , biochemistry
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