Modification for spin-adapted version of configuration interaction singles with perturbative doubles

Chemical Physics Letters

Volumn 443, Issue 4-6, 2007, Pages 389-397

  Mochizuki, Yuji ^a,b,c   Tanaka, Kiyoshi ^c,d  

^a RIKKYO UNIVERSITY   (Japan)

^b JAPAN SCIENCE AND TECHNOLOGY AGENCY   (Japan)

^c INSTITUTE OF INDUSTRIAL SCIENCE   (Japan)

^d UNIVERSITY OF TOKYO   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

INTERACTION SINGLES; PERTURBATIVE DOUBLES; SPIN-ADAPTED VERSION;

DIFFERENTIAL EQUATIONS; EXCITED STATES; MATHEMATICAL OPERATORS; MOLECULAR DYNAMICS; MOLECULAR INTERACTIONS; VALENCE BANDS;

PERTURBATION TECHNIQUES;

EID: 34447649719     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2007.06.059     Document Type: Article

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