Subsurface effects in the dissociation of H-2 on Pd(111)

被引：6
|
作者：
Munn, NS [1 ]
Clary, DC [1 ]
机构：
[1] UNIV LONDON UNIV COLL,DEPT CHEM,LONDON WC1H 0AJ,ENGLAND
来源：
CHEMICAL PHYSICS LETTERS | 1997年 / 266卷 / 5-6期
基金：
英国工程与自然科学研究理事会;
关键词：
D O I：
10.1016/S0009-2614(97)00036-5
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：
Using a time-independent quantum mechanical method based on hyperspherical coordinates and a reduced-dimensionality approximation, we carry out a study of H-2 dissociation to subsurface states of Pd(111). Particular attention is paid to the effect of rotation on the dissociation probability, and the existence of 'mixed' states spanning surface and subsurface is discussed.
引用
收藏
页码：437 / 442
页数：6
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