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Theoretical Chemistry Accounts

Volumn 128, Issue 2, 2011, Pages 183-189

Dual-level direct dynamics studies on the hydrogen abstraction reactions of fluorine atoms with CF3CH2X(X=F, Cl)

(5) Wang, Li a Zhao, Yuan a Zhang, Jing a Dai, Yanna a Zhang, Jinglai a

a HENAN UNIVERSITY (China)

Author keywords

DFT; Direct dynamics method; Rate constants

Indexed keywords

EID: 78650991304 PISSN: 1432881X EISSN: None Source Type: Journal
DOI: 10.1007/s00214-010-0813-8 Document Type: Article

Times cited : (14)

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