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CO2 reduction mechanism on the Nb2CO2 MXene surface: Effect of nonmetal and metal modification

Yuwen Cheng, Xiaojian Xu, Yongtao Li, Yumin Zhang, Yan Song

2021Computational Materials Science39 citationsDOI

Topics & Concepts

NonmetalOverpotentialCatalysisRedoxDensity functional theoryElectrochemistryGibbs free energyMaterials scienceReaction mechanismMetalChemistryInorganic chemistryComputational chemistryPhysical chemistryOrganic chemistryThermodynamicsElectrodePhysicsMXene and MAX Phase MaterialsCO2 Reduction Techniques and CatalystsElectrocatalysts for Energy Conversion
CO2 reduction mechanism on the Nb2CO2 MXene surface: Effect of nonmetal and metal modification | Litcius