Nonadiabatic effects in molecular adiabatic systems:: Application to linear plus quadratic E⊗e system

被引：47

作者：

Baer, M ^{[1
]}

机构：

[1] Soreq NRC, Dept Phys & Appl Phys, IL-81800 Yavne, Israel

来源：

JOURNAL OF CHEMICAL PHYSICS | 1997年 / 107卷 / 24期

关键词：

D O I：

10.1063/1.474182

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：

In this publication I treat two subjects both connected to electronic nonadiabatic transitions. The first is related to the general single-state Born-Oppenheimer equation. Such an equation was recently derived by Baer and Englman [Chem. Phys. Lett. 265, 105 (1997)]; here it is derived again in a different and more instructive way. The second is related to the "linear plus quadratic Exe system". For this system we derive the adiabatic-diabatic-transformation (ADT) angle [Chem. Phys. Lett. 35, 112 (1975)] and show that it is identical to the phase factor obtained by Zwanziger and Grant. (C) 1997 American Institute of Physics.

引用

页码：10662 / 10666

页数：5

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