| Literature DB >> 20849136 |
Hai-Anh Le1, Terry J Frankcombe, Michael A Collins.
Abstract
An accurate potential energy surface for H(3)(+) + CO has been constructed by interpolation of ab initio data. The reaction cross sections and thermal rate coefficients for the production of HCO(+) and HOC(+) have been evaluated using quasiclassical trajectory simulations.Entities:
Year: 2010 PMID： 20849136 DOI： 10.1021/jp1060182
Source DB: PubMed Journal: J Phys Chem A ISSN： 1089-5639 Impact factor: 2.781