| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5390584 | Chemical Physics Letters | 2006 | 5 Pages |
Abstract
Density-functional calculations were done to examine the interface between graphene and a Pt13 or Au13 cluster. Introducing a carbon vacancy into a graphene sheet enhanced the interaction between graphene and the metal clusters. Five- or seven-member rings introduced into the graphene also increased the stability of the interface. The CO and H chemisorption energies on the metal clusters on graphene were calculated to clarify support-dependent reactivity.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Yasuharu Okamoto,