Theoretical investigation of structural, electronic and optical properties of Sc-doped SnO2
Nabil Beloufa, Youcef Cherchab, S. Louhibi-Fasla, Salah Daoud, Hamza Rekab-Djabri, A. Chahed
Topics & Concepts
WIEN2kDensity functional theoryDopingBand gapFermi levelMaterials scienceCondensed matter physicsTransmittanceSemiconductorDirect and indirect band gapsAbsorption edgeOptoelectronicsDensity of statesElectronic band structurePlane waveElectronic structureLocal-density approximationChemistryComputational chemistryOpticsPhysicsElectronQuantum mechanicsGas Sensing Nanomaterials and SensorsZnO doping and propertiesTransition Metal Oxide Nanomaterials