Fe-embedded Au (111) monolayer as an electrocatalyst for N2 reduction reaction: A first-principles investigation
Ling Fu, Longbin Yan, Long Lin, Kun Xie, Linghao Zhu, Chaozheng He, Zhanying Zhang
Topics & Concepts
MonolayerDensity functional theoryCatalysisElectrocatalystElectrochemistryMoleculeChemistryLimitingMaterials sciencePhysical chemistryInorganic chemistryComputational chemistryNanotechnologyOrganic chemistryElectrodeMechanical engineeringEngineeringAmmonia Synthesis and Nitrogen ReductionNanomaterials for catalytic reactionsAdvanced Photocatalysis Techniques