Design of molecular M N C dual-atom catalysts for nitrogen reduction starting from surface state analysis
Yuefeng Zhang, Zixun Yu, Fangxin She, Wei Li, Zhiyuan Zeng, Hao Li
Topics & Concepts
Pourbaix diagramCatalysisChemistryGibbs free energyDensity functional theoryElectrochemistryNitrogenCarbon fibersTransition metalPhysical chemistryHydrogenInorganic chemistryComputational chemistryThermodynamicsMaterials scienceOrganic chemistryElectrodeComposite numberPhysicsComposite materialAmmonia Synthesis and Nitrogen ReductionElectrocatalysts for Energy ConversionCatalytic Processes in Materials Science