Pressure-induced band gap engineering and enhanced optoelectronic properties of non-toxic Ca-based perovskite CsCaCl3: Insights from density functional theory
Z. Jellil, H. Ez‐Zahraouy
Topics & Concepts
Band gapHydrostatic pressurePerovskite (structure)Materials scienceDirect and indirect band gapsDensity functional theoryOptoelectronicsLattice constantElectronic band structureHalideChemistryCondensed matter physicsThermodynamicsOpticsDiffractionComputational chemistryCrystallographyInorganic chemistryPhysicsPerovskite Materials and ApplicationsHeusler alloys: electronic and magnetic propertiesChalcogenide Semiconductor Thin Films