Open AccessCommunications: Accurate description of atoms and molecules by natural orbital functional theory
Author(s) -
Mario Piris,
Jon M. Matxain,
Xabier López,
Jesús M. Ugalde
Publication year - 2010
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 - 10.1063/1.3298694
Subject(s) - excited state , density functional theory , lambda , spin (aerodynamics) , physics , atomic physics , functional theory , molecule , atoms in molecules , atomic orbital , ground state , matrix (chemical analysis) , quantum mechanics , chemistry , thermodynamics , chromatography , electron
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