Exploring the structural, phononic, electronic, magnetic, optical, and thermoelectric properties of Pb-free vanadium-based double perovskites using the first-principles approach for optoelectronic and thermoelectric applications
Syed Zuhair Abbas Shah, Shanawer Niaz, Tabassum Nasir, Shahid M. Ramay
Topics & Concepts
Thermoelectric effectMaterials scienceCondensed matter physicsPhononFigure of meritDensity functional theoryThermoelectric materialsOptoelectronicsSeebeck coefficientElectronic band structurePhysicsThermodynamicsChemistryComputational chemistryPerovskite Materials and ApplicationsAdvanced Thermoelectric Materials and DevicesHeusler alloys: electronic and magnetic properties