2003
DOI: 10.5012/jkcs.2003.47.3.191
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Theoretical Study of the Isotope Effect for the Reaction Cl+HD at the High Energy Using Pairwise Energy Model

Abstract: The pairwise energy model (PEM) assumes that the cross section for the reaction cross section for the reaction A+BC→AB+C, where B and C are isotopes of hydrogen, depends on only the pairwise relative energy ES between A and B. Until now, the PEM has been used to interpret theoretically the isotope effect for the reactions such as O(3 P)+HD and Ar + +(H2, D2, and HD). In this paper we carry out extensive quasiclassical trajectory calculations for the three possible reactions Cl+H2 and HD and show that the PEM w… Show more

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