Theoretical perspective for substitution effect on luminescent properties of through space charge transfer-based thermally activated delayed fluorescence molecules
Haipei Zou, Huanling Liu, Qingfang Mu, Kai Zhang, Yuzhi Song, Lili Lin, Yuanyuan Xu, Chuan‐Kui Wang, Jianzhong Fan
Topics & Concepts
Density functional theoryExcited stateMoleculeIntramolecular forceLuminescenceChemical physicsTime-dependent density functional theorySinglet stateIntermolecular forcePolarizabilityPolarizable continuum modelComputational chemistryChemistryMaterials scienceAtomic physicsSolvationStereochemistryPhysicsOrganic chemistryOptoelectronicsOrganic Light-Emitting Diodes ResearchLuminescence and Fluorescent MaterialsPerovskite Materials and Applications