Machine Learning-Driven Precise Design of Stable OLED Materials: Predicting and Enhancing Multi-State C-N Bond Dissociation Energies
Yiming Shi, Haochen Shi, Haichang Wang, Chun‐Jung Chen, Yaoyao Li, Bo Qiao, Zhiqin Liang, Suling Zhao, Deyu Hang, Zheng Xu, Dandan Song
Topics & Concepts
OLEDDissociation (chemistry)Bond-dissociation energyState (computer science)Materials scienceChemistryComputational chemistryComputer scienceNanotechnologyPhysical chemistryAlgorithmLayer (electronics)Organic Light-Emitting Diodes ResearchOrganic Electronics and PhotovoltaicsMachine Learning in Materials Science