CO oxidation on rutile-supported Au nanoparticles

被引:357
作者
Remediakis, IN [1 ]
Lopez, N
Norskov, JK
机构
[1] Tech Univ Denmark, Dept Phys, Ctr Atom Scale Mat Phys, DK-2800 Lyngby, Denmark
[2] Univ Barcelona, Dept Quim Fis, E-08028 Barcelona, Spain
关键词
density functional calculations; gold; heterogeneous catalysis; nanostructures; titanium oxide;
D O I
10.1002/anie.200461699
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
What makes inert gold active? The answer lies in controlling the structure of Au particles at the nanoscale: Either many interface sites or many low-coordinate Au atoms need to be present in the particles. This principle is demonstrated by modeling the oxidation of CO on a rutile (TiO 2)-supported Au nanocluster, the transition state of which does not involve the titania support (see picture: Au yellow, Ti light gray, C dark gray, O red). (Figure Presented) © 2005 Wiley-VCH Verlag GmbH S. Co. KGaA.
引用
收藏
页码:1824 / 1826
页数:3
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