Borophene−supported single transition metal atoms as potential oxygen evolution/reduction electrocatalysts: a density functional theory study
Xuewen Xu, Ruihao Si, Dong Yao, Lanlan Li, Minghui Zhang, Xiaoyi Wu, Jun Zhang, Kun Fu, Yue Guo, Yanyan He
Topics & Concepts
Density functional theoryTransition metalOxygen evolutionBoropheneBifunctionalCatalysisChemistryMetalAtom (system on chip)Materials sciencePhysical chemistryComputational chemistryElectrodeElectrochemistryOrganic chemistryComputer scienceEmbedded systemBiochemistryElectrocatalysts for Energy ConversionFuel Cells and Related MaterialsAdvanced battery technologies research