Insight into structural stability, electronic, optical and thermoelectric properties of the inverse perovskite Na3SCl compound from first-principles study
Jisha Annie Abraham, Ramesh Sharma, Vipul Srivastava, Azmi Ibrahim
Topics & Concepts
Seebeck coefficientThermoelectric effectMaterials scienceBand gapElectronic band structureCondensed matter physicsOptical conductivityPerovskite (structure)Figure of meritDensity functional theoryElectronic structureChemistryOptoelectronicsThermodynamicsPhysicsComputational chemistryCrystallographyPerovskite Materials and ApplicationsThermal Expansion and Ionic ConductivityHeusler alloys: electronic and magnetic properties