Insight on structural, electronic and thermoelectric properties of perovskite AgBaCl3 by an Ab-initio for solar cell and renewable energy
Arti Saxena, Aparna Dixit, Debidatta Behera, Jisha Annie Abraham, Ramesh Sharma, Sanat Kumar Mukherjee
Topics & Concepts
WIEN2kThermoelectric effectMaterials sciencePerovskite (structure)Band gapAb initioRefractive indexSemiconductorElectronic structureElectronic band structureDirect and indirect band gapsDensity functional theoryDielectricCondensed matter physicsOptoelectronicsComputational chemistryChemistryThermodynamicsLocal-density approximationCrystallographyPhysicsOrganic chemistryPerovskite Materials and ApplicationsChalcogenide Semiconductor Thin FilmsAdvanced Thermoelectric Materials and Devices