Mapping temperature-dependent energy–structure–property relationships for solid solutions of inorganic halide perovskites
Jack Yang
Abstract
We explored how lead/tin mixing affects the finite-temperature stabilities, atomistic and electronic dynamics of inorganic halide perovskites, with the aid of unsupervised machine learning and the recently devised anharmonicity score.
Topics & Concepts
HalideAnharmonicityMaterials scienceTinMixing (physics)Property (philosophy)Chemical physicsSolid solutionEnergy (signal processing)Condensed matter physicsInorganic chemistryMetallurgyPhysicsChemistryQuantum mechanicsPhilosophyEpistemologyPerovskite Materials and ApplicationsMachine Learning in Materials ScienceQuantum Dots Synthesis And Properties