Electronic and optical properties of Mg3XN (X = P, As, Sb, Bi) antiperovskites: The GW/BSE approach
Ezekiel Oyeniyi
Topics & Concepts
Band gapDensity functional theoryDirect and indirect band gapsMaterials scienceChemistrySpin–orbit interactionCondensed matter physicsOptoelectronicsPhysicsComputational chemistryThermal Expansion and Ionic ConductivityPerovskite Materials and ApplicationsHeusler alloys: electronic and magnetic properties