Data-Driven and Quantum-Chemical Insights into Emergence of Multiresonance Effect in Thermally Activated Delayed Fluorescence Emitters
Multiresonance thermally activated delayed fluorescence (MR-TADF) emitters enable narrow-bandwidth emission and high efficiency in organic light-emitting diodes; however, the fundamental origin of the multiresonance effect remains incompletely understood. Herein, a fine-tuned Uni-Mol model trained on reported MR-TADF...