Ring-polymer molecular dynamics: Rate coefficient calculations for energetically symmetric (near thermoneutral) insertion reactions (X + H 2 ) → HX + H(X = C( 1D ), S( 1D ))
Suleimanov, Yury V., Kong, Wendi J., Guo, Hua, Green, William H.Том:
141
Мова:
english
Журнал:
The Journal of Chemical Physics
DOI:
10.1063/1.4904080
Date:
December, 2014
Файл:
PDF, 436 KB
english, 2014