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• W2316401291 endingPage "026801" @default.
• W2316401291 startingPage "026801" @default.
• W2316401291 abstract "To investigate the effects of chlorine on the Au/ceria catalysts, the adsorption of gold or chlorine and their coadsorpiton on the stoichiometric and partially reduced CeO2 (111) surfaces are studied from the first principles. It is found that the adsorption of Au is significantly enhanced by the chlorine preadsorption on the stoichiometric CeO2 (111) surface; while on the partially reduced CeO2 (111) surface, the preadsorbed chlorine inhabits the oxygen vacancy (which is the preferred adsorption site for gold), leading to a CeOCl phase and the dramatical weakening of the Au adsorption. Therefore, chlorine on the CeO2 (111) surface can affect the Au adsorption thus the activity of the Au/CeO2 catalyst." @default.
• W2316401291 created "2016-06-24" @default.
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• W2316401291 date "2015-02-01" @default.
• W2316401291 modified "2023-10-17" @default.
• W2316401291 title "Coadsorption of gold with chlorine on CeO ₂ (111) surfaces: A first principles study" @default.
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• W2316401291 doi "https://doi.org/10.1088/1674-1056/24/2/026801" @default.
• W2316401291 hasPublicationYear "2015" @default.
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