First-principles calculations to investigate structural, optoelectronic and thermoelectric properties of Sn-based halide perovskites: CsSnCl3 and CH3NH3SnCl3
Y. Selmani, H. Labrim, L. Bahmad
Topics & Concepts
Materials scienceSeebeck coefficientFigure of meritThermoelectric effectElectronic structureBand gapPerovskite (structure)HalideElectronic band structureThermoelectric materialsOptoelectronicsDensity functional theoryDirect and indirect band gapsCondensed matter physicsAbsorption (acoustics)Thermal conductivityComputational chemistryInorganic chemistryCrystallographyThermodynamicsChemistryComposite materialPhysicsPerovskite Materials and ApplicationsChalcogenide Semiconductor Thin FilmsAdvanced Thermoelectric Materials and Devices