Probing the physical properties of Sr3AsX3 (X = F and Br) perovskite compounds for prospective solar cell applications employing the DFT framework
Ali Algahtani, Amina, Fida Rehman, Maryam Liaqat, Nizomiddin Juraev, Imran Khan, Amnah Mohammed Alsuhaibani, Abdullah Abdullah, Vineet Tirth, Moamen S. Refat, Abid Zaman
Topics & Concepts
Perovskite (structure)Band gapHalideMaterials scienceAb initioStructural stabilityDirect and indirect band gapsSolar cellElectronic structureAnisotropyAb initio quantum chemistry methodsAbsorption (acoustics)ChemistryCrystallographyComputational chemistryOptoelectronicsMoleculeOpticsPhysicsInorganic chemistryComposite materialOrganic chemistryStructural engineeringEngineeringPerovskite Materials and ApplicationsChalcogenide Semiconductor Thin FilmsHeusler alloys: electronic and magnetic properties