B-doping on the electronic structure and photocatalytic properties of g-C3N4/Janus PtSSe heterojunctions: A first-principles study
Jianlin He, Guili Liu, Chunwei Zhang, Guoying Zhang
Topics & Concepts
HeterojunctionFermi levelMaterials scienceBand gapDopingDensity functional theoryElectronic band structureCondensed matter physicsPhotocatalysisElectronic structureWork functionSchottky barrierElectronOptoelectronicsNanotechnologyChemistryPhysicsComputational chemistryLayer (electronics)CatalysisBiochemistryQuantum mechanicsDiodeAdvanced Photocatalysis TechniquesPerovskite Materials and Applications2D Materials and Applications