The generalized active space concept in multiconfigurational self-consistent field methods

Journal of Chemical Physics

Volumn 135, Issue 4, 2011, Pages

  Ma, Dongxia ^a   Li Manni, Giovanni ^b   Gagliardi, Laura ^a  

^a University of Minnesota   (United States)

^b UNIVERSITY OF GENEVA   (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVE SPACES; ARBITRARY NUMBER; CAS-SCF; COMPLETE ACTIVE SPACE; MULTICONFIGURATIONAL SELF-CONSISTENT FIELDS; SELF-CONSISTENT FIELD;

GADOLINIUM; GASES; WAVE FUNCTIONS;

CURRENT VOLTAGE CHARACTERISTICS;

EID: 79961081433     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3611401     Document Type: Article

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