An ab-initio study on the physical properties of double perovskite Cs2AgXBr6 (X=S, Te, Se)
Nabil Al-Aqtash, Anas Y. Al‐Reyahi, Said M. Al Azar, Saber Sâad Essaoud, Mufeed Maghrabi, Ahmad Mufleh, Mohammed Elamin Ketfi, Khadidja Berarma
Topics & Concepts
Materials scienceDensity functional theoryPerovskite (structure)Ab initioBand gapElectronic structureMetalAnisotropyElectronic band structurePoisson's ratioCondensed matter physicsCrystallographyComputational chemistryPoisson distributionOpticsOptoelectronicsMetallurgyChemistryQuantum mechanicsMathematicsStatisticsPhysicsPerovskite Materials and ApplicationsThermal Expansion and Ionic ConductivityHeusler alloys: electronic and magnetic properties