MODIFIED VERSION OF THE TRAJECTORY SURFACE LEAKING METHOD FOR DYNAMIC CALCULATIONS ON AUTOIONIZING ATOM DIATOM COLLISION SYSTEMS

被引：11

作者：

VOJTIK, J

PAIDAROVA, I

机构：

[1] J. Heyrovsky Institute of Physical Chemistry and Electrochemistry, Czechoslovak Academy of Sciences

来源：

CHEMICAL PHYSICS | 1991年 / 157卷 / 1-2期

关键词：

D O I：

10.1016/0301-0104(91)87131-E

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：

A modified version of the trajectory surface leaking method for dynamical calculations on autoionizing atom-diatom collision systems is elaborated. The modification is designed so as to account for the most prominent quantum features of the ionization event. Test calculations on He(2 3S)-H-2 are presented. The approach is found to yield an improved picture of the He(2 3S)-H-2 --> [He...H-2+] + e- ionization event, which is consistent with Penning electron spectra measurements. Some implications for future theoretical studies of atom-diatom autoionizing collision systems are outlined.

引用

页码：67 / 74

页数：8

共 28 条

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