Passivation of surface defects in FAPbI3 perovskite by methimazole molecule: A first-principles investigation
Meng Wei, Liping Cheng, Baoen Xu, Xiaoyan Li, Lingpeng Meng
Topics & Concepts
PassivationDangling bondPerovskite (structure)FormamidiniumMaterials scienceBand gapChemical physicsTriiodideMoleculeGrain boundaryPerovskite solar cellAdsorptionDensity functional theorySolar cellNanotechnologyInorganic chemistryChemistryComputational chemistryOptoelectronicsCrystallographyPhysical chemistryLayer (electronics)SiliconMetallurgyDye-sensitized solar cellMicrostructureOrganic chemistryElectrodeElectrolytePerovskite Materials and ApplicationsChalcogenide Semiconductor Thin FilmsQuantum Dots Synthesis And Properties