Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5376502 | Chemical Physics | 2007 | 14 Pages |
Abstract
Extensive quasiclassical trajectory calculations of the rate coefficients, cross sections and product distributions of the OHÂ +Â CO reaction have been carried out. From the detailed comparison of the values obtained on the most popular potential energy surfaces proposed in the literature an evaluation of the suitability of these surfaces for modeling the reactive process is made.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Ernesto Garcia, Amaia Saracibar, Leire Zuazo, Antonio Laganà ,