The Adsorption of CO on the Stepped Pt{211} Surface: A Comparison of Theory and Experiment

被引：0
|
作者：
S.C. Creighan
R.J. Mukerji
A.S. Bolina
D.W. Lewis
W.A. Brown
机构：
[1] University College London,Department of Chemistry
来源：
Catalysis Letters | 2003年 / 88卷
关键词：
Pt{211}; CO adsorption; density function theory;
D O I：
暂无
中图分类号：
学科分类号：
摘要：
Experimental measurements and DFT calculations reveal that, as expected, CO adsorbs most strongly at the step edge of Pt{211}, with similar adsorption energies for bridged and atop CO on the step. Terrace sites are significantly less stable. In the light of our results, we attempt to provide explanations for previous disagreement between experiment and theory.
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页码：39 / 45
页数：6
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