CASTEP study for mapping phase stability, and optical parameters of halide perovskite CsSiBr3 for photovoltaic and solar cell applications
Hina Arif, Muhammad Bilal Tahir, Badriah S. Almutairi, Iqra Khalid, Muhammad Sagir, H. Elhosiny Ali, Hussein Alrobei, Meshal Alzaid
Topics & Concepts
CASTEPBand gapPerovskite (structure)Lattice constantDensity functional theorySolar cellMaterials scienceSupercellPerovskite solar cellPhotovoltaic systemHalideDirect and indirect band gapsElectronic band structureOptoelectronicsComputational chemistryCondensed matter physicsChemistryCrystallographyOpticsInorganic chemistryComputer sciencePhysicsDiffractionElectrical engineeringRadarTelecommunicationsEngineeringPerovskite Materials and ApplicationsChalcogenide Semiconductor Thin FilmsSolid-state spectroscopy and crystallography