COMPUTATIONAL STUDY OF THE EFFECT OF THE INTERACTION POTENTIAL FOR INELASTIC ATOM-MOLECULE ROTATIONAL SCATTERING

被引:2
作者
DAVIES, DW
TILL, SJ
机构
[1] Department of Chemistry, University of Birmingham, Birmingham
关键词
D O I
10.1016/0010-4655(79)90070-5
中图分类号
TP39 [计算机的应用];
学科分类号
081203 ; 0835 ;
摘要
Approximate coupled channel scattering calculations are performed for model systems comprising a closed-shell atom colliding with rigid rotor diatomic homo- and hetero-nuclear molecules. Differential and total cross-sections for rotational scattering with several different interaction potentials are given for p-H2 and MuH + He, at a fixed total collision energy, and for LiF + Ar with a fixed emperical potential but varying collision energy. Conclusions are drawn concerning the effect on the cross-sections of the variations made. © 1979.
引用
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页码:81 / 84
页数:4
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