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- W2390167314 abstract "Using the ab initio cluster model,the adsorption of CO on the Pt-Ru alloys surfaces was approximately simulated.The calculated equilibrium geometries and vibrational frequencies were found to be rather in agreement with experimental ones.The Pt-C bond length was slightly longer in the Pt-Pt4-Pt2Ru2CO cluster than that in the Pt-Pt4-Pt4CO,and its adsorption energy 147 kJ/mol was lower than that in Pt-Pt4-Pt4CO,which explained that the Pt-Pt4-Pt2Ru2 cluster was not easily CO poison." @default.
- W2390167314 created "2016-06-24" @default.
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- W2390167314 date "2008-01-01" @default.
- W2390167314 modified "2023-09-30" @default.
- W2390167314 title "Theoretical Study on CO Poisoning of Pt-Ru Catalysts" @default.
- W2390167314 hasPublicationYear "2008" @default.
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