DFT exploration of elastic, optoelectronic, and thermoelectric properties of stable and eco-friendly double perovskites Cs2YAuX6 (X=Cl, Br) for green energy applications
Ahmad Ayyaz, G. Murtaza, Maha Naeem, Ahmad Usman, Shahid M. Ramay, M. Irfan, Hafiz Muhammad Irfan
Topics & Concepts
Thermoelectric effectMaterials scienceOptoelectronicsFigure of meritBand gapThermoelectric materialsPhotovoltaic systemElectronic band structureThermal conductivityConduction bandThermal conductionCondensed matter physicsComposite materialThermodynamicsElectronPhysicsBiologyEcologyQuantum mechanicsPerovskite Materials and ApplicationsHeusler alloys: electronic and magnetic propertiesThermal Expansion and Ionic Conductivity