THE ROLE OF REACTANT ROTATION AND ROTATIONAL ALIGNMENT IN THE DISSOCIATIVE CHEMISORPTION OF HYDROGEN ON NI(100)

被引：20

作者：

BEAUREGARD, JN ^{[1
]}

MAYNE, HR ^{[1
]}

机构：

[1] UNIV NEW HAMPSHIRE, DEPT CHEM, DURHAM, NH 03824 USA

来源：

CHEMICAL PHYSICS LETTERS | 1993年 / 205卷 / 06期

关键词：

D O I：

10.1016/0009-2614(93)80006-B

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 have carried out classical trajectory calculations on the dissociative chemisorption of H-2(0, j) on Ni(100). Above threshold, the results are found to be in good agreement with a recent mixed quantum-classical treatment. We find that rotational effects in direct chemisorption reactions can be explained by the same concepts which have been employed in gas phase reactions.

引用

页码：515 / 520

页数：6

共 47 条

[1]

[Anonymous], 1981, CHEM 2 DIMENSIONS SU

[2] A SEARCH FOR VIBRATIONAL CONTRIBUTIONS TO THE ACTIVATED ADSORPTION OF H-2 ON COPPER [J].