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An ab initio investigation on the mechanism of formaldehyde oxidation: A case of heterogeneous catalytic reaction over graphene-like MnO2 monolayer anchored different single atoms (Fe, Co, and Ni)

Materials ScienceAb Initio InvestigationCatalytic ApplicationEngineeringFormaldehyde OxidationHeterogeneous CatalysisGrapheneGraphene-like Mno2 MonolayerSingle-atom CatalystNanoheterogeneous CatalysisCatalysisChemistryCatalytic Process