A Sterically Hindered Asymmetric D-A-D' Thermally Activated Delayed Fluorescence Emitter for Highly-Efficient Non-doped Organic Light-Emitting Diodes

Thermally activated delayed fluorescence (TADF) materials have opened a new chapter for high-efficiency and low-cost organic light-emitting diodes (OLEDs). Herein, we describe a novel and effective design strategy for TADF emitters which includes introducing a carbazole donor unit at the ortho-position, at which the donor and acceptor groups are spatially in close proximity to guarantee the existence of intramolecular electrostatic attraction and through-space charge transfer, leading to reduced structural vibrations, suppressed non-radiative decay and rapid radiative decay to avoid excited state energy loss. As a result, a green TADF emitter (2Cz-DPS) showing high solid-state photoluminescence quantum efficiency (91.9%) and excellent OLED performance was produced. Theoretical simulations reveal that the non-adiabatic coupling accelerates the reverse intersystem crossing of 2Cz-DPS, resulting in a state-of-the-art non-doped OLED with an extremely high external quantum efficiency of 28.7%.