Direct ab initio dynamics study on the rate constants and kinetics isotope effects of CH3O+H→CH2O+H2 reaction

Journal of Chemical Physics

Volumn 121, Issue 19, 2004, Pages 9474-9480

  Li, Qian Shu ^a,b   Zhang, Yue ^a,c   Zhang, Shaowen ^a  

^a BEIJING INSTITUTE OF TECHNOLOGY   (China)

^b JILIN UNIVERSITY   (China)

^c Shijiazhuang College   (China)

Author keywords

[No Author keywords available]

Indexed keywords

CORRELATION METHODS; HYDROGEN; HYDROGEN INORGANIC COMPOUNDS; ISOTOPES; NATURAL FREQUENCIES; OPTIMIZATION; REACTION KINETICS; VARIATIONAL TECHNIQUES;

DUNNING'S CORRELATION; FORWARD RATE CONSTANTS; HYDROGEN ABSTRACTION REACTION; KINETICS ISOTOPE EFFECTS;

RATE CONSTANTS;

EID: 10844276290     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1807391     Document Type: Article

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