VIBRATIONAL EFFECTS IN THE ASSOCIATIVE DESORPTION OF H-2

被引:27
作者
DARLING, GR [1 ]
HOLLOWAY, S [1 ]
机构
[1] UNIV LIVERPOOL,DEPT CHEM,LIVERPOOL L69 3BX,ENGLAND
关键词
D O I
10.1016/0039-6028(92)90940-8
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
Experimental observations and a theory of vibrational excitation in associative desorption are examined. Time-dependent quantum calculations on a barrierless potential demonstrate the importance of contributions from excited vibrational states of the adsorbed H atoms. In addition, their inclusion is a necessary condition for time reversal symmetry (microscopic reversibility) to hold. Attempts to simulate the experimental results with model forms of the sticking function indicate that there is no unique route between data and potential energy surfaces.
引用
收藏
页码:L305 / L310
页数:6
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