Ultrafast spin-flip exciton conversion and narrowband sky-blue luminescence in a fused polycyclic selenaborin emitter

Thermally activated delayed fluorescence (TADF) materials with high photoluminescence quantum yields and fast reverse intersystem crossing (RISC) capabilities are highly desirable for applications in high-efficiency organic light-emitting diodes. Herein, we report the synthesis as well as structural...

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Main Authors: Sudhir K. Keshri, Guanting Liu, Takuma Yasuda
Format: Article
Language:English
Published: Frontiers Media S.A. 2024-03-01
Series:Frontiers in Chemistry
Subjects:
Online Access:https://www.frontiersin.org/articles/10.3389/fchem.2024.1375552/full
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author Sudhir K. Keshri
Guanting Liu
Takuma Yasuda
Takuma Yasuda
author_facet Sudhir K. Keshri
Guanting Liu
Takuma Yasuda
Takuma Yasuda
author_sort Sudhir K. Keshri
collection DOAJ
description Thermally activated delayed fluorescence (TADF) materials with high photoluminescence quantum yields and fast reverse intersystem crossing (RISC) capabilities are highly desirable for applications in high-efficiency organic light-emitting diodes. Herein, we report the synthesis as well as structural and photophysical properties of 5,9-diselena-13b-boranaphtho[3,2,1-de]anthracene (SeBSe) as a narrowband-emissive TADF material. The incorporation of two selenium atoms into the boron-fused pentacyclic π-core results in a small singlet–triplet energy gap (ΔEST) and thereby significant TADF properties. Moreover, theoretical calculations revealed a noticeable spin-orbit coupling enhancement between the singlet and triplet manifolds in SeBSe by virtue of the heavy-atom effect of selenium atoms. Consequently, SeBSe allows ultrafast spin-flip RISC with the rate constant surpassing 108 s−1, which far exceeds the corresponding fluorescence radiative decay rate (∼106 s−1), enabling an ideal singlet–triplet superimposed excited state.
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spelling doaj.art-34b4ab6b28be4fbf9c1a380b1cbdb3b32024-03-25T04:37:54ZengFrontiers Media S.A.Frontiers in Chemistry2296-26462024-03-011210.3389/fchem.2024.13755521375552Ultrafast spin-flip exciton conversion and narrowband sky-blue luminescence in a fused polycyclic selenaborin emitterSudhir K. Keshri0Guanting Liu1Takuma Yasuda2Takuma Yasuda3Institute for Advanced Study, Kyushu University, Fukuoka, JapanInstitute for Advanced Study, Kyushu University, Fukuoka, JapanInstitute for Advanced Study, Kyushu University, Fukuoka, JapanDepartment of Applied Chemistry, Kyushu University, Fukuoka, JapanThermally activated delayed fluorescence (TADF) materials with high photoluminescence quantum yields and fast reverse intersystem crossing (RISC) capabilities are highly desirable for applications in high-efficiency organic light-emitting diodes. Herein, we report the synthesis as well as structural and photophysical properties of 5,9-diselena-13b-boranaphtho[3,2,1-de]anthracene (SeBSe) as a narrowband-emissive TADF material. The incorporation of two selenium atoms into the boron-fused pentacyclic π-core results in a small singlet–triplet energy gap (ΔEST) and thereby significant TADF properties. Moreover, theoretical calculations revealed a noticeable spin-orbit coupling enhancement between the singlet and triplet manifolds in SeBSe by virtue of the heavy-atom effect of selenium atoms. Consequently, SeBSe allows ultrafast spin-flip RISC with the rate constant surpassing 108 s−1, which far exceeds the corresponding fluorescence radiative decay rate (∼106 s−1), enabling an ideal singlet–triplet superimposed excited state.https://www.frontiersin.org/articles/10.3389/fchem.2024.1375552/fullthermally activated delayed fluorescencenarrowband emissionselenaborinspinorbit couplingheavy atom effecthelicity
spellingShingle Sudhir K. Keshri
Guanting Liu
Takuma Yasuda
Takuma Yasuda
Ultrafast spin-flip exciton conversion and narrowband sky-blue luminescence in a fused polycyclic selenaborin emitter
Frontiers in Chemistry
thermally activated delayed fluorescence
narrowband emission
selenaborin
spinorbit coupling
heavy atom effect
helicity
title Ultrafast spin-flip exciton conversion and narrowband sky-blue luminescence in a fused polycyclic selenaborin emitter
title_full Ultrafast spin-flip exciton conversion and narrowband sky-blue luminescence in a fused polycyclic selenaborin emitter
title_fullStr Ultrafast spin-flip exciton conversion and narrowband sky-blue luminescence in a fused polycyclic selenaborin emitter
title_full_unstemmed Ultrafast spin-flip exciton conversion and narrowband sky-blue luminescence in a fused polycyclic selenaborin emitter
title_short Ultrafast spin-flip exciton conversion and narrowband sky-blue luminescence in a fused polycyclic selenaborin emitter
title_sort ultrafast spin flip exciton conversion and narrowband sky blue luminescence in a fused polycyclic selenaborin emitter
topic thermally activated delayed fluorescence
narrowband emission
selenaborin
spinorbit coupling
heavy atom effect
helicity
url https://www.frontiersin.org/articles/10.3389/fchem.2024.1375552/full
work_keys_str_mv AT sudhirkkeshri ultrafastspinflipexcitonconversionandnarrowbandskyblueluminescenceinafusedpolycyclicselenaborinemitter
AT guantingliu ultrafastspinflipexcitonconversionandnarrowbandskyblueluminescenceinafusedpolycyclicselenaborinemitter
AT takumayasuda ultrafastspinflipexcitonconversionandnarrowbandskyblueluminescenceinafusedpolycyclicselenaborinemitter
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