ROTATIONAL STATE DISTRIBUTIONS FOLLOWING THE PHOTODISSOCIATION OF CL-CN - COMPARISON OF CLASSICAL AND QUANTUM-MECHANICAL CALCULATIONS

被引：25

作者：

SCHINKE, R ^{[1
]}

机构：

[1] UNIV COLORADO,NBS,JOINT INST LAB ASTROPHYS,BOULDER,CO 80302

来源：

JOURNAL OF CHEMICAL PHYSICS | 1990年 / 92卷 / 04期

关键词：

D O I：

10.1063/1.457982

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：

We report exact quantum mechanical close-coupling calculations for the photodissociation of Cl-CN using the ab initio potential of Waite and Dunlap. We find that the simple classical calculations of Barts and Halpern based on the rotational reflection principle agree very nicely with the exact rotational state distributions. Furthermore, it is shown that the impulsive model fails severely to account for the high degree of rotational excitation in the photodissociation of Cl-CN. © 1990 American Institute of Physics.

引用

页码：2397 / 2400

页数：4

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