Adsorption of AuxCuy (x + y = 1, 2, 3) nanoclusters on the anatase TiO2(101) surface and their catalytic activity: a density functional theory study
Author:
Affiliation:
1. Faculty of Materials Science and Engineering
2. Kunming University of Science and Technology
3. Kunming 650093
4. P. R. China
Abstract
The adsorption of AuxCuy (x + y = 1, 2, 3) nanoclusters on the anatase TiO2(101) surface were studied in detail using density functional theory. The introduction of Cu atoms in Au clusters not only significantly reduces the cost, but also changes the catalytic process of Au/TiO2, which may be helpful to some catalytic reactions.
Funder
National Natural Science Foundation of China
Publisher
Royal Society of Chemistry (RSC)
Subject
Catalysis
Link
http://pubs.rsc.org/en/content/articlepdf/2017/CY/C7CY01650F
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