Theoretical investigation of the potential energy surface for the N(4S) + C2H3 reaction via density functional theory and ab initio molecular electronic structure theory

Journal of Molecular Structure: THEOCHEM

Volumn 847, Issue 1-3, 2007, Pages 79-85

  Feng, Changjun ^a   Zhang, Weichao ^a   Du, Benni ^a   Mu, Lailong ^a  

^a JIANGSU NORMAL UNIVERSITY   (China)

Author keywords

C2H3; CBS APNO; G3; G3B3; N(4S); Reaction mechanism

Indexed keywords

EID: 36048987033     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2007.09.001     Document Type: Article

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