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Peripheral halogen atoms in multi-resonant thermally activated delayed fluorescence emitters: The role of heavy atom on intermolecular interactions and spin orbit coupling

Hector Miranda-Salinas, Jingxiang Wang, Andrew Danos, Tomas Matulaitis, Kleitos Stavrou, Andrew Monkman, Eli Zysman-Colman

Version 1 posted 29 November 2023

385

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Materials Science

Working Paper

Heavy-Atom Effect Promotes Multi-Resonance Thermally Activated Delayed Fluorescence

Tao Hua, Lisi Zhan, Nengquan Li, Zhongyan Huang, Xiaosong Cao, Zhengqi Xiao, Shaolong Gong, Changjiang Zhou, Cheng Zhong, Chuluo Yang

Version 1 posted 18 February 2021

996

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3

Citations

Theoretical and Computational Chemistry

Working Paper

Three-State-Involving Vibronic Resonance Is a Key to Enhancing Reverse Intersystem Crossing Dynamics of Organoboron-Based Ultrapure Blue Emitters

Inkoo Kim, Kwuang Hyun Cho, Soon Ok Jeon, Won-Joon Son, Dongwook Kim, Young Min Rhee, Inkook Jang, Hyeonho Choi, Dae Sin Kim

Version 1 posted 04 June 2020

576

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1

Citations

Materials Chemistry

Working Paper

TADF mechanism in a carbene-copper emitter: Insights from the nuclear ensemble simulations

Laure de Thieulloy, Leonardo Evaristo de Sousa, Piotr de Silva

Version 1 posted 11 June 2024

118

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Materials Chemistry

Working Paper

Promoting Reverse Intersystem Crossing in Thermally Activated Delayed Fluorescence via Heavy-Atom Effect

Katsuyuki Shizu, Ren Yongxia, Hironori Kaji

Version 1 posted 14 July 2022

637

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Materials Chemistry

Working Paper

A Boron, Nitrogen, and Oxygen Doped π-Extended Helical Pure Blue Multiresonant Ther-mally Activated Delayed Fluorescent Emitter for Organic Light Emitting Diodes That Shows Fast kRISC Without the Use of Heavy Atoms

Rangani Wathsala Weerasinghe, Subeesh Madayanad Suresh, David Hall, Tomas Matulaitis, Alexandra Slawin, Stuart Warriner, Yi-Ting Lee, Chin-Yiu Chan, Youichi Tsuchiya, Eli Zysman-Colman, Chihaya Adachi

Version 1 posted 13 February 2024

938

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Physical Chemistry

Working Paper

Extended theoretical modeling of reverse intersystem crossing for thermally activated delayed fluorescence materials

Masaya Hagai, Naoto Inai, Takuma Yasuda, Kazuhiro J. Fujimoto, Takeshi Yanai

Version 1 posted 07 August 2023

506

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Materials Chemistry

Working Paper

Strategic Approach to Pyrazinoquinoxaline Molecular Design for Enhanced Performance

Sunil Madagyal, Pratima Yadav, Prabhakar Chetti, Atul Chaskar

Version 1 posted 29 December 2023

171

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Physical Chemistry

Working Paper

Analysis: A Figure of Merit for Efficiency Roll-off in Thermally Activated Delayed Fluorescent Organic Light-Emitting Diodes

Stefan Diesing, Le Zhang, Eli Zysman-Colman, Ifor Samuel

Version 1 posted 20 June 2023

437

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1

Citations

Theoretical and Computational Chemistry

Working Paper

Computational Investigations of the Detailed Mechanism of Reverse Intersystem Crossing in Inverted Singlet-Triplet Gap Molecules

Danillo Valverde, Cher Tian Ser, Gaetano Ricci, Kjell Jorner, Robert Pollice, Alan Aspuru-Guzik, Yoann Olivier

Version 1 posted 15 March 2024

532

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11 results in Reverse intersystem crossing in Keywords: Reverse intersystem crossing

Peripheral halogen atoms in multi-resonant thermally activated delayed fluorescence emitters: The role of heavy atom on intermolecular interactions and spin orbit coupling

Heavy-Atom Effect Promotes Multi-Resonance Thermally Activated Delayed Fluorescence

Three-State-Involving Vibronic Resonance Is a Key to Enhancing Reverse Intersystem Crossing Dynamics of Organoboron-Based Ultrapure Blue Emitters

TADF mechanism in a carbene-copper emitter: Insights from the nuclear ensemble simulations

Promoting Reverse Intersystem Crossing in Thermally Activated Delayed Fluorescence via Heavy-Atom Effect

A Boron, Nitrogen, and Oxygen Doped π-Extended Helical Pure Blue Multiresonant Ther-mally Activated Delayed Fluorescent Emitter for Organic Light Emitting Diodes That Shows Fast kRISC Without the Use of Heavy Atoms

Extended theoretical modeling of reverse intersystem crossing for thermally activated delayed fluorescence materials

Strategic Approach to Pyrazinoquinoxaline Molecular Design for Enhanced Performance

Analysis: A Figure of Merit for Efficiency Roll-off in Thermally Activated Delayed Fluorescent Organic Light-Emitting Diodes

Computational Investigations of the Detailed Mechanism of Reverse Intersystem Crossing in Inverted Singlet-Triplet Gap Molecules

11 results in Keywords: Reverse intersystem crossing