期刊
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
卷 14, 期 20, 页码 7448-7455出版社
ROYAL SOC CHEMISTRY
DOI: 10.1039/c2cp40565b
关键词
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资金
- European Union through Marie Curie Initial Training Network ELCAT [214936-2, 2008-2012]
Surface segregation effects on polycrystalline Au-Cu alloys (Au0.80Cu0.20, Au0.85Cu0.15 and Au0.90Cu0.10) were studied at room temperature by angle resolved XPS (ARXPS) and density functional theory (DFT) before and after exposure to O-2. Au surface enrichment was found as predicted from calculations showing that this process is energetically favourable, with a segregation energy for Au in a Cu matrix of -0.37 eV atom(-1). Surface enrichment with Cu was observed after exposure to O-2 due to its dissociative adsorption, in agreement with DFT calculations that predicted an energy gain of -1.80 eV atom(-1) for the transfer of Cu atoms to a surface containing adsorbed oxygen atoms, thus leading to an inversion in surface population.
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