Structural, electronic, elastic, optical and thermoelectric properties of ASiCl3 (A = Li, Rb and Cs) chloroperovskites: a DFT study
Lakhdar Benahmedi, Besbes Anissa, Djelti Radouan, Najwa Al Bouzieh, Noureddine Amrane
Topics & Concepts
ElectronegativityMaterials scienceThermoelectric effectBand gapDensity functional theoryRefractive indexDirect and indirect band gapsSemiconductorDielectricAttenuation coefficientAbsorption (acoustics)Condensed matter physicsOptoelectronicsComputational chemistryThermodynamicsOpticsComposite materialChemistryOrganic chemistryPhysicsChalcogenide Semiconductor Thin FilmsHeusler alloys: electronic and magnetic propertiesPerovskite Materials and Applications