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First-principles screening of Pt doped Ti2CNL (N = O, S and Se, L = F, Cl, Br and I) as high-performance catalysts for ORR/OER

Materials ScienceInorganic ChemistryCatalytic MaterialEngineeringHigh-performance CatalystsSingle-atom CatalystCatalysisChemistryCatalyst PreparationFirst-principles Screening