Use of direct dynamics simulations to determine unimolecular reaction paths and Arrhenius parameters for large molecules

Journal of Chemical Theory and Computation

Volumn 7, Issue 11, 2011, Pages 3478-3483

  Yang, Li ^a   Sun, Rui ^a   Hase, William L ^a  

^a TEXAS TECH UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 80755176412     PISSN: 15499618     EISSN: 15499626     Source Type: Journal    
DOI: 10.1021/ct200459v     Document Type: Article

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