RSC Advances · 2016 · 71 citations · 89 references
Natural SciencesChemistryMaterials ScienceCatalysisMaterials ChemistryNanomaterialsCarbon NanomaterialsCatalyst DesignCatalytic MaterialsGraphene NanomaterialsNanocatalysisOxidation-reduction ReactionsCarbon CatalystsCarbon-based CatalystsCatalytic ActivityCo OxidationGrapheneGraphene CatalystsGraphene-based MaterialsOxidation
The geometric, electronic and catalytic characters of Fe atom embedded graphene (including monovacancy and divacancy) are investigated using the first-principles method, which gives a reference on designing graphene-based catalysts for CO oxidation.
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Generalized Gradient Approximation Made Simple
John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 211.5K citations · Full text
Natural Sciences, Chemistry, Physics +16
A. K. Geǐm, Kostya S. Novoselov · Nature Materials · 2007 · 39.5K citations