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- W2041384787 abstract "We have used a first principles pseudopotential method to investigate the catalytic oxidation of CO on the Pd doped Ag(1 1 1) surface. The nudged elastic band method was applied to find the minimum energy path for the oxidation process and to give an explanation why the alloy surface is a better catalyst for this reaction than the corresponding elemental surfaces. The electronic structure is analyzed at the initial, transition and final states of CO oxidation on pure Pd and Ag(1 1 1) surfaces and on the Pd doped Ag(1 1 1) surface." @default.
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- W2041384787 date "2004-09-01" @default.
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- W2041384787 title "Effect of the electronic structure on CO oxidation on Pd doped Ag(111)" @default.
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- W2041384787 doi "https://doi.org/10.1016/j.susc.2004.06.053" @default.
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