A multireference n-electron Valence State Perturbation Theory study of the electronic spectrum of s-tetrazine

Theoretical Chemistry Accounts

Volumn 123, Issue 3-4, 2009, Pages 287-298

  Angeli, Celestino ^a   Cimiraglia, Renzo ^a   Cestari, Mirko ^b  

^a UNIVERSITY OF FERRARA   (Italy)

^b UNIVERSITY OF PADOVA   (Italy)

Author keywords

Electronic spectrum; Excited states; Multireference Perturbation Theory; NEVPT; Quasi degenerate Perturbation Theory; S tetrazine

Indexed keywords

EID: 67449135873     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-009-0560-x     Document Type: Article

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