DFT insights on the opto-electronic and thermoelectric properties of double perovskites K2AgSbX6 (X = Cl, Br) via halides substitutions for solar cell applications
Muhammad Waqas Iqbal, Mumtaz Manzoor, Soumaya Gouadria, Mazia Asghar, Maiza Zainab, Naveed Noor Ahamd, Sikander Aftab, Ramesh Sharma, Tausif Zahid
Topics & Concepts
Seebeck coefficientThermoelectric effectMaterials scienceDensity functional theoryDirect and indirect band gapsShear modulusCondensed matter physicsSolar cellBand gapThermal conductivityBulk modulusElectronic band structureElectronic structureThermodynamicsChemistryOptoelectronicsComputational chemistryPhysicsComposite materialPerovskite Materials and ApplicationsHeusler alloys: electronic and magnetic propertiesChalcogenide Semiconductor Thin Films