Direct dynamic study on the hydrogen abstraction reaction of H 2co with nco

International Journal of Chemical Kinetics

Volumn 41, Issue 6, 2009, Pages 394-400

  Sun, Hao ^a,b   Huang, Xu Ri ^a   Pan, Xiu Mei ^b   Wang, Rong Shun ^b   Sun, Chia Chung ^a  

^a JILIN UNIVERSITY   (China)

^b NORTHEAST NORMAL UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO DYNAMICS; CANONICAL VARIATIONAL TRANSITION-STATE THEORIES; DIRECT DYNAMICS; ENERGY SURFACE; EXPERIMENTAL VALUES; HYDROGEN ABSTRACTION REACTION; HYDROGEN-ABSTRACTION; REACTION ENTHALPIES; SINGLE-POINT ENERGY; SMALL-CURVATURE TUNNELING; TEMPERATURE RANGE;

ABSTRACTING; ELECTRONIC STATES; HYDROGEN; POTENTIAL ENERGY; POTENTIAL ENERGY SURFACES; QUANTUM CHEMISTRY; REACTION KINETICS;

RATE CONSTANTS;

EID: 66149175150     PISSN: 05388066     EISSN: 10974601     Source Type: Journal    
DOI: 10.1002/kin.20417     Document Type: Article

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