Transition-metal-free boron doped SbN monolayer for N2 adsorption and reduction to NH3: A first-principles study
Dachang Chen, Zhiwen Chen, Lixin Chen, Yi Li, Song Xiao, Beibei Xiao
Topics & Concepts
MonolayerAdsorptionTransition metalChemistryOrbital hybridisationCatalysisAtom (system on chip)BoronMetalElectrochemistryDensity functional theoryAtomic orbitalInorganic chemistryPhysical chemistryComputational chemistryMoleculeMolecular orbitalElectrodeOrganic chemistryMolecular orbital theoryBiochemistryEmbedded systemQuantum mechanicsElectronPhysicsComputer scienceAmmonia Synthesis and Nitrogen ReductionHydrogen Storage and MaterialsAdvanced Photocatalysis Techniques