Structural, optoelectronic and thermoelectric properties of the new perovskites LiMCl3 (M = Pb or Sn): a DFT study
Y. Selmani, H. Labrim, L. Bahmad
Topics & Concepts
Thermoelectric effectMaterials scienceDensity functional theorySemiconductorStructural stabilityDirect and indirect band gapsBand gapElectronic band structureThermoelectric materialsElectronic structureCondensed matter physicsOptoelectronicsThermodynamicsComputational chemistryChemistryPhysicsStructural engineeringEngineeringPerovskite Materials and ApplicationsHeusler alloys: electronic and magnetic propertiesChalcogenide Semiconductor Thin Films