Open AccessCommunication: Rigorous quantum dynamics of O + O2 exchange reactions on an ab initio potential energy surface substantiate the negative temperature dependence of rate coefficients
Author(s) -
Yaqin Li,
Zhigang Sun,
Bin Jiang,
Daiqian Xie,
Richard Dawes,
Hua Guo
Publication year - 2014
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/1.4894069
Subject(s) - excited state , potential energy surface , diatomic molecule , work (physics) , ab initio , chemistry , potential energy , wave packet , quantum , kinetic isotope effect , atomic physics , thermodynamics , physics , deuterium , quantum mechanics , molecule , organic chemistry
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