RESONANCE STATE APPROACH TO QUANTUM TRANSITION-STATE THEORY

被引：20
|
作者：
ZHAO, MS
RICE, SA
机构：
[1] UNIV CHICAGO, DEPT CHEM, CHICAGO, IL 60637 USA
[2] UNIV CHICAGO, JAMES FRANCK INST, CHICAGO, IL 60637 USA
来源：
JOURNAL OF PHYSICAL CHEMISTRY | 1994年 / 98卷 / 13期
关键词：
D O I：
10.1021/j100064a028
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 show, within the framework of the reaction coordinate representation of the dynamics of a chemical reaction, that application of a complex scaling transformation to the reaction coordinate leads naturally to the identification of transition states as scattering resonances. Our analysis also leads to the definition of a resonance width operator, whose expectation values are the lifetimes of the scattering resonances.
引用
收藏
页码：3444 / 3449
页数：6
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