Morphology of platinum clusters on graphite at different loadings

被引:28
作者
Wu, GW [1 ]
Chan, KY [1 ]
机构
[1] UNIV HONG KONG,DEPT CHEM,HONG KONG,HONG KONG
关键词
clusters; computer simulations; graphite; many body and quasi-particle theories; molecular dynamics; physical adsorption; platinum; surface structure; morphology; roughness; and topography;
D O I
10.1016/0039-6028(96)00694-2
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
Molecular dynamics simulations of platinum atoms on a graphite surface have been performed with different coverages of platinum. The Sutton-Chen many body potential was used for the Pt-Pt interaction whereas a Steele potential with an energy minima representing adsorption sites was used to represent the carbon surface. The results show that platinum clusters can form on the graphite surface. The cluster size distribution shifts to larger clusters with increasing Pt loadings. The clusters at moderate loadings have a hcp close packed structure but, at very high loading, subdomains and a mixture of crystallinities are observed in a single cluster. The exposed surface area of the clusters at different loadings has also been calculated.
引用
收藏
页码:38 / 52
页数:15
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