TIME-DEPENDENT QUANTUM-MECHANICAL STUDY OF INTRAMOLECULAR VIBRATIONAL-ENERGY REDISTRIBUTION IN BENZENE

被引：0

作者：

LUNG, C

WYATT, RE

机构：

[1] UNIV TEXAS,DEPT CHEM & BIOCHEM,AUSTIN,TX 78712

[2] UNIV TEXAS,INST THEORET CHEM,AUSTIN,TX 78712

来源：

JOURNAL OF CHEMICAL PHYSICS | 1993年 / 99卷 / 03期

关键词：

D O I：

暂无

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：

Large scale quantum calculations on relaxation from the CH(v=3) overtone in benzene are reported. Plots of time-dependent local mode stretch and bend energies were used to elucidate the relaxation mechanism. Sequential local mode excitation was observed at early times (t < 0.2 ps). Persistent oscillations were found superimposed upon the steady state bond energies at later times.

引用

页码：2261 / 2264

页数：4

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