Atomistic Insights Into the Degradation of Inorganic Halide Perovskite CsPbI<sub>3</sub>: A Reactive Force Field Molecular Dynamics Study
Mike Pols, José Manuel Vicent‐Luna, Ivo A. W. Filot, Adri C. T. van Duin, Shuxia Tao
Abstract
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Topics & Concepts
HalidePerovskite (structure)AnharmonicityChemical physicsMolecular dynamicsLattice (music)Materials sciencePhase (matter)Degradation (telecommunications)DecompositionInstabilityChemistryComputational chemistryInorganic chemistryCrystallographyCondensed matter physicsPhysicsTelecommunicationsMechanicsComputer scienceAcousticsOrganic chemistryPerovskite Materials and ApplicationsChalcogenide Semiconductor Thin FilmsSolid-state spectroscopy and crystallography