Exploring Rb2YCuCl6 and Cs2YCuCl6 double perovskites: Structural, electronic, optical, elastic, and thermoelectric properties via density functional theory
Amjad Ali Khan, Muhammad Saeed, Aijaz Rasool Chaudhry, Muhammad Awais Jehangir, Muhammad Ibrar, G. Murtaza
Topics & Concepts
Density functional theoryThermoelectric effectCondensed matter physicsMaterials scienceThermoelectric materialsChemistryPhysicsThermodynamicsComputational chemistryPerovskite Materials and ApplicationsHeusler alloys: electronic and magnetic propertiesAdvanced Thermoelectric Materials and Devices