Year: 2015
Journal of Atomic and Molecular Sciences, Vol. 6 (2015), Iss. 1 : pp. 52–62
Abstract
Product Polarizations for the exchange reaction $H'+HS$ and its isotopic variants on an accurate $1A'$ potential energy surface have been studied at collision energies of 10 kcal/mol by using the quasi-classical trajectory method (QCT). Product rotational angular momentum distributions $P(θ_r)$ and $P(\phi_r)$ are calculated in the center-of-mass (CM) frame. Moreover, three generalized polarization-dependent differential cross sections (PDDCSs) are also computed. The results demonstrated that the isotopic effect displays sensitive effect on the product vector correlations. The reaction mechanism was discussed based on the properties of stereodynamics and the reactive trajectories.
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Journal Article Details
Publisher Name: Global Science Press
Language: English
DOI: https://doi.org/10.4208/jams.010114.022015a
Journal of Atomic and Molecular Sciences, Vol. 6 (2015), Iss. 1 : pp. 52–62
Published online: 2015-01
AMS Subject Headings: Global Science Press
Copyright: COPYRIGHT: © Global Science Press
Pages: 11
Keywords: stereodynamics Isotopic Effects Quasiclassical Trajectory Exchange Reaction.