Screening and prediction of metal-doped α-borophene monolayer for nitric oxide elimination
Yi Xiao, Chen Shen, Weibin Zhang
Topics & Concepts
CatalysisBoropheneMonolayerMetalSelectivityDensity functional theoryDopingOxideNitric oxideGibbs free energyChemistryMaterials scienceInorganic chemistryCombinatorial chemistryNanotechnologyComputational chemistryPhysicsOrganic chemistryOptoelectronicsQuantum mechanicsAmmonia Synthesis and Nitrogen ReductionCatalytic Processes in Materials ScienceElectrocatalysts for Energy Conversion