A STUDY OF HOCO RESONANCES IN THE OH+CO-]CO2+H REACTION

被引：60
|
作者：
HERNANDEZ, MI
CLARY, DC
机构：
[1] Department of Chemistry, University of Cambridge, Cambridge CB2 1EW, Lensfield Road
来源：
JOURNAL OF CHEMICAL PHYSICS | 1994年 / 101卷 / 04期
关键词：
D O I：
10.1063/1.467593
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：
Quasibound states of the HOCO intermediate in the reaction OH+CO-->H+CO2 are studied by means of the stabilization method. A reduced-dimensionality model is used. The calculated resonance positions and lifetimes agree well with previous quantum scattering calculations. Most of the quasibound states can be assigned approximately to a vibrational excitation in the higher frequency OH vibration and different progressions in the HO-CO stretching mode. Some interesting mode-specific effects in the dynamics of the unimolecular decay are predicted.
引用
收藏
页码：2779 / 2784
页数：6
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