Role of transition metal d-orbitals in single-atom catalysts for nitric oxide electroreduction to ammonia
Ling‐Yan Kong, Xiongyi Liang, Maohuai Wang, Chi‐Man Lawrence Wu
Topics & Concepts
CatalysisTransition metalChemistryMonolayerDensity functional theoryOxideAtomic orbitalGibbs free energyElectrochemistryAtom (system on chip)Inorganic chemistryComputational chemistryPhysical chemistryThermodynamicsPhysicsBiochemistryElectronOrganic chemistryEmbedded systemElectrodeQuantum mechanicsComputer scienceAmmonia Synthesis and Nitrogen ReductionAdvanced Photocatalysis TechniquesCatalytic Processes in Materials Science