Cite this article:
Liu Yu-Fang, Liu Yan-Lei, Liang Bin. Dynamics of reaction of O with H2 and its isotopic variants in different rotational excited statesJ. Chin. Phys. B, 2012, 21(9): 098201.
| Liu Yu-Fang, Liu Yan-Lei, Liang Bin. Dynamics of reaction of O with H2 and its isotopic variants in different rotational excited statesJ. Chin. Phys. B, 2012, 21(9): 098201. |
Dynamics of reaction of O with H2 and its isotopic variants in different rotational excited states
-
Abstract
Scalar properties and vector correlations of the reactions O+H2 →OH+H, O+HD→OH+D, O+DH→OD+H, andO+D2 →OD+D at collision energies of 25 and 34.6 kcal/mole have been studied via quasi-classical-trajectory (QCT)method based on a BMS1 potential energy surface (PES). Generalized polarization-dependent differential cross sectionand the distributions of the dihedral angle at the collision energy of 34.6 kacl/mole are presented. The calculated resultsindicate that both reagent rotational angular momentum and the mass factor have a significant influence on the scalarproperties and vector correlations of the title reactions. -
DownLoad: