Semi-classical S matrix theory of reactive and non-reactive atom-molecule collisions

被引:12
作者
Bowman, J. M. [1 ]
Kuppermann, Aron [1 ]
机构
[1] CALTECH, Arthur Amos Noyes Lab Chem Phys, Pasadena, CA 91109 USA
关键词
D O I
10.1016/0301-0104(73)80002-3
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Expressions for the transition probabilities in collinear collisions of an atom with a diatomic molecule in the uniform. primitive, and classical semi-classical approximations of W.H. Miller arc rederived from a new integral representation of a semi-classical S matrix. This derivation treats reactive and non-reactive collisions in a unit-led manner and gives additional insight into the nature of the semi-classical approximation. The derivation and resulting expressions are given in terms of a general internal diatom coordinate which can be chosen for computational convenience. The new integral expression is compared with ones given previously.
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页码:158 / 170
页数:13
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