A DFT study of oxygen reduction reaction mechanism over O-doped graphene-supported Pt4, Pt3Fe and Pt3V alloy catalysts
作者： Nian Jin , Jinyu Han , Hua Wang , Xinli Zhu , Qingfeng Ge
DOI: 10.1016/J.IJHYDENE.2015.02.101
关键词: Catalysis 、 Context (language use) 、 Graphene 、 Crystallography 、 Photochemistry 、 Redox 、 Bimetallic strip 、 Reactivity (chemistry) 、 Density functional theory 、 Nanomaterial-based catalyst 、 Chemistry
摘要: … In the present study, we employed DFT calculations to optimize the structure of the Pt 4 and Pt 3 M (M = Fe, V) clusters supported on the O-doped graphene (OG). We note that this OG …
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