Explicitly correlated internally contracted multireference coupled-cluster singles and doubles theory: Ic-MRCCSD(F12*)

Chemical Physics Letters

Volumn 565, Issue , 2013, Pages 122-127

  Liu, Wenlan ^a   Hanauer, Matthias ^a   Köhn, Andreas ^a  

^a JOHANNES GUTENBERG UNIVERSITY   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVE SPACES; COMPUTATIONAL COSTS; CONNECTED TRIPLES; COUPLED-CLUSTER SINGLES AND DOUBLES; MULTI REFERENCE; SINGLET-TRIPLET; SPECTROSCOPIC CONSTANTS; SPLITTINGS;

QUANTUM CHEMISTRY;

NUMERICAL METHODS;

EID: 84875438635     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2012.12.052     Document Type: Article

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