A CAS-DFT study of fundamental degenerate and nearly degenerate systems

Molecular Physics

Volumn 105, Issue 19-22, 2007, Pages 2667-2679

  Ukai, Takeshi ^a   Nakata, Kazuto ^a   Yamanaka, Shusuke ^a,b   Takada, Toshikazu ^b,c   Yamaguchi, Kizashi ^a,b  

^a OSAKA UNIVERSITY   (Japan)

^b JAPAN SCIENCE AND TECHNOLOGY AGENCY   (Japan)

^c RIKEN   (Japan)

Author keywords

CAS DFT; Degenerate systems; Molecular magnetism

Indexed keywords

EXCITED STATES; GROUND STATE; LIGANDS; TRANSITION METALS;

ATOMIC MULTIPLET STATES; AUXILIARY VARIABLES; DEGENERATE SYSTEMS; MOLECULAR MAGNETISM;

ATOMIC PHYSICS;

EID: 38849181129     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268970701618440     Document Type: Article

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