A DFT study of the G3-Factor and derivatives

Journal of Molecular Structure: THEOCHEM

Volumn 803, Issue 1-3, 2007, Pages 17-21

  Lacaze Dufaure, Corinne ^a   Najjar, Fadia ^b   André Barrès, Christiane ^b  

^a INSTITUT CARNOT CIRIMAT   (France)

^b Université Paul Sabatier Toulouse III   (France)

Author keywords

Density Functional Theory; Endoperoxides; G Factors; Malaria; Singlet triplet splitting

Indexed keywords

EID: 33846583728     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2006.09.017     Document Type: Article

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