Time-dependent wavepacket calculations for reactive scattering and photodissociation

被引:0
作者
Balint-Kurti, GG [1 ]
Brown, A [1 ]
机构
[1] Univ Bristol, Sch Chem, Bristol BS8 1TS, Avon, England
来源
THEORY OF CHEMICAL REACTION DYNAMICS | 2004年 / 145卷
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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
The theory of time-dependent wavepacket calculations of reactive scattering and photodissociation is briefly reviewed and some illustrative results presented. Particular attention will be paid to the theory of differential scattering cross sections, arising from both types of process, and to the symmetry of angular dependent scattering in a photodissociation process. Electronically non-adiabatic processes will be discussed and illustrations from the reactive scattering of O(D-1) + H-2 and from the photodissociation of HF are presented.
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页码:149 / 185
页数:37
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