Unraveling Dynamic Disorder in Metal Halide Perovskite Quantum Dots: Atomistic Insights Into Structure–Carrier Coupling From Ab Initio and Nonadiabatic Simulations
Metal–halide perovskite quantum dots (PQDs) have emerged as highly dynamic nanoscale semiconductors whose optoelectronic properties are governed by a complex interplay of lattice fluctuations, electronic excitation processes, and surface‐mediated interactions. This review provides a comprehensive atomistic perspectiv...