DFT + U based characterization of structural, magnetic, dynamic, elastic and thermodynamic properties of KXF3 (X = Fe or Co) halide perovskites compounds
Saber Sâad Essaoud, A. Bouhemadou, Mohammed Elamin Ketfi, Missoum Radjai, Djamel Allali
Topics & Concepts
HalideCharacterization (materials science)Materials sciencePhysical chemistryChemistryThermodynamicsCrystallographyComputational chemistryInorganic chemistryPhysicsNanotechnologyPerovskite Materials and ApplicationsHeusler alloys: electronic and magnetic propertiesThermal Expansion and Ionic Conductivity