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Atom superposition and electron delocalization molecular orbital (ASED-MO) calculations with cluster models of stepped and rough (111) Pt and Pt-Sn alloy surfaces support a picture wherein the easily-oxidized CO(ads), that is present at high coverges and has an oxidation onset potential 0.4-0.5 V (H 2 ) lower than the main, hard-to-oxidize CO(ads) peak, goes by a mechanism wherein a H ...
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