CEPA calculations on open-shell molecules. II. Singlet-triplet energy splitting in ?2 configurations of diatomic molecules

1981 ◽  
Vol 59 (5) ◽  
pp. 501-515 ◽  
Author(s):  
Volker Staemmler ◽  
Ralph Jaquet
Keyword(s):  
Diatomic Molecules ◽  
Open Shell ◽  
Energy Splitting ◽  
Triplet Energy

Controlling the exciton lifetime of blue thermally activated delayed fluorescence emitters using a heteroatom-containing pyridoindole donor moiety

2017 ◽  
Vol 4 (4) ◽  
pp. 619-624 ◽  
Author(s):  
Gyeong Heon Kim ◽  
Raju Lampande ◽  
Joon Beom Im ◽  
Jung Min Lee ◽  
Ju Young Lee ◽  
...  
Keyword(s):  
Molecular Design ◽  
Delayed Fluorescence ◽  
Energy Splitting ◽  
Triplet Energy ◽  
High Quantum Efficiency ◽  
Thermally Activated Delayed Fluorescence ◽  
Thermally Activated ◽  
Exciton Lifetime ◽  
Low Efficiency ◽  
Donor Moiety

We demonstrate a promising molecular design approach to achieve short exciton lifetime, small singlet and triplet energy splitting and high photoluminescence quantum yield in thermally activated delayed fluorescence emitters for high quantum efficiency and low efficiency roll-off characteristics in OLEDs.

Forcing dimethylacridine crooking to improve the efficiency of orange-red thermally activated delayed fluorescent emitters

2020 ◽  
Vol 8 (30) ◽  
pp. 10416-10421
Author(s):  
Feng-Yan Hao ◽  
Yi-Zhong Shi ◽  
Kai Wang ◽  
Xiao-Chun Fan ◽  
Lin Wu ◽  
...  
Keyword(s):  
Quantum Yield ◽  
Steric Hindrance ◽  
Fluorescence Quantum Yield ◽  
Energy Splitting ◽  
Triplet Energy ◽  
Thermally Activated ◽  
High Fluorescence ◽  
Planar Geometries ◽  
High Fluorescence Quantum Yield

By crooking conventional donor segments via suitable steric hindrance, nearly planar geometries, a small singlet–triplet energy splitting and a high fluorescence quantum yield can be realized simultaneously.

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