Direct ab initio classical trajectory calculations for the N(2D)+CH4 insertion reaction

Journal of Molecular Structure: THEOCHEM

Volumn 492, Issue 1-3, 1999, Pages 151-158

  Takayanagi, T ^a   Kurosaki, Y ^a  

^a JAPAN ATOMIC ENERGY AGENCY   (Japan)

Author keywords

Ab initio molecular orbital calculations; Classical trajectory; Reaction dynamics

Indexed keywords

AMINE; DEUTERIUM; METHANE;

ARTICLE; CHEMICAL BOND; DISSOCIATION; ENERGY; MOLECULAR DYNAMICS; REACTION ANALYSIS;

EID: 0033615912     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(99)00156-6     Document Type: Article

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