Open AccessComplete-active-space extended Koopmans theorem method
Author(s) -
Ernest R. Davidson,
J. V. Ortiz,
Viktor N. Staroverov
Publication year - 2021
Publication title -
the journal of chemical physics
Language(s) - Uncategorized
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/5.0058080
Subject(s) - wave function , equivalence (formal languages) , ionization , atomic physics , atomic orbital , basis (linear algebra) , basis set , physics , configuration interaction , ion , operator (biology) , space (punctuation) , quantum mechanics , electron , chemistry , mathematics , molecule , geometry , pure mathematics , biochemistry , linguistics , philosophy , repressor , transcription factor , gene
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