Density functional theory based modelling on the physical properties of CsInAgAsX6 (X = Cl, Br) double perovskite for green energy applications
Mumtaz Manzoor, M. Jamil, Lakshita Sehgal, Ramesh Sharma, Ahmed Ahmed Ibrahim
Topics & Concepts
Materials sciencePerovskite (structure)Density functional theoryEnergy (signal processing)ThermodynamicsPhysical chemistryEngineering physicsChemical engineeringComputational chemistryQuantum mechanicsPhysicsEngineeringChemistryPerovskite Materials and ApplicationsHeusler alloys: electronic and magnetic propertiesThermal Expansion and Ionic Conductivity