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Clarification of RISC mechanism in TADF molecules and the development of advanced ones

Research Project

Project/Area Number 23KF0263
Research Category

Grant-in-Aid for JSPS Fellows

Allocation TypeMulti-year Fund
Section外国
Review Section Basic Section 35030:Organic functional materials-related
Research InstitutionKyushu University

Principal Investigator

安達 千波矢  九州大学, 工学研究院, 教授 (30283245)

Co-Investigator(Kenkyū-buntansha) KIM HYUNG SUK  九州大学, 工学研究院, 外国人特別研究員
Project Period (FY) 2023-11-15 – 2025-03-31
Project Status Discontinued (Fiscal Year 2024)
Budget Amount *help
¥2,000,000 (Direct Cost: ¥2,000,000)
Fiscal Year 2025: ¥300,000 (Direct Cost: ¥300,000)
Fiscal Year 2024: ¥900,000 (Direct Cost: ¥900,000)
Fiscal Year 2023: ¥800,000 (Direct Cost: ¥800,000)
KeywordsCharge-transfer / TADF / COMPASS model / Spin-flip / Machine learning / QSPR / Multi-resonance TADF / Spin-flip process / IPN-derivative / OLED / RISC / COMPASS / Spin-orbit coupling
Outline of Research at the Start

We will propose a comprehensive TADF model that incorporates a four-level electronic structure to fully account for the observed experimental responses in our study. This model will take into consideration the spin-flip process facilitated by an intermediate, high-lying T state. It will be constructed based on the principles of universal exciton dynamics using time-dependent population rate equations. This approach will provide us with a better understanding of the underlying spin-flip mechanisms.

Outline of Annual Research Achievements

Through the JSPS Postdoctoral Fellowships program, I collaborated with Professor Chihaya Adachi at Kyushu University, leading to the publication of 6 SCIE papers in 2024 to 2025. Among these, the research most closely aligned with the objectives of the JSPS program was published in Nat. Commun. In recognition of its significance, we were invited to contribute to the Behind the Paper section of Nature Publishing Group’s Research Communities, where we provided insights into our findings. As of September/October 2024, this highly cited work ranked in the top 1% of the Physics field based on citation thresholds for its publication year. Additionally, in 2025, we harnessed machine learning to design high-performance organic light-emitting materials, culminating in a publication in Sci. Adv..

Report

(2 results)
  • 2024 Annual Research Report
  • 2023 Research-status Report
  • Research Products

    (10 results)

All 2024 2023 Other

All Int'l Joint Research (3 results) Journal Article (4 results) (of which Int'l Joint Research: 4 results,  Peer Reviewed: 4 results,  Open Access: 2 results) Presentation (3 results) (of which Int'l Joint Research: 2 results)

  • [Int'l Joint Research] KAIST/Gyeongsang National University(韓国)

    • Related Report
      2024 Annual Research Report
  • [Int'l Joint Research] CNRS/Sorbonne University(フランス)

    • Related Report
      2024 Annual Research Report
  • [Int'l Joint Research] 韓国科学技術院 (KAIST)(韓国)

    • Related Report
      2023 Research-status Report
  • [Journal Article] Advancing efficiency in deep-blue OLEDs: Exploring a machine learning-driven multiresonance TADF molecular design2024

    • Author(s)
      Hyung Suk Kim, Hyung Jin Cheon, Sang Hoon Lee, Junho Kim、Seunghyup Yoo, Yun-Hi Kim, Chihaya Adachi
    • Journal Title

      Science Advances

      Volume: 11 Issue: 4 Pages: 141835-141835

    • DOI

      10.1126/sciadv.adr1326

    • Related Report
      2024 Annual Research Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Naphthalene Diimide-Based Hydrogen-Bonded Organic Framework for High Electrical Conductivity and Ammonia Sensor Applications2024

    • Author(s)
      Kentaro Imaoka, Hyung Suk Kim, Yusei Yamamoto, Satoshi Fukutomi, Lise-Marie Chamoreau, Liyuan Qu, Hiroaki Iguchi, Youichi Tsuchiya, Toshikazu Ono, Fabrice Mathevet, Chihaya Adachi
    • Journal Title

      Advanced Functional Materials

      Volume: 34 Issue: 49 Pages: 2409299-2409299

    • DOI

      10.1002/adfm.202409299

    • Related Report
      2024 Annual Research Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Visualization of multiple-resonance-induced frontier molecular orbitals in a single multiple-resonance thermally activated delayed fluorescence molecule2024

    • Author(s)
      Jaehyun Bae, Miyabi Imai-Imada*, Hyung Suk Kim, Minhui Lee, Hiroshi Imada, Youichi Tsuchiya, Takuji Hatakeyama*, Chihaya Adachi* and Yousoo Kim*
    • Journal Title

      ACS Nano

      Volume: 18 Issue: 27 Pages: 17987-17995

    • DOI

      10.1021/acsnano.4c04813

    • Related Report
      2024 Annual Research Report
    • Peer Reviewed / Open Access / Int'l Joint Research
  • [Journal Article] Understanding of complex spin up-conversion processes in charge-transfer-typeorganic molecules2024

    • Author(s)
      Hyung Suk Kim; Sang Hoon Lee; Seunghyup Yoo; Chihaya Adachi
    • Journal Title

      Nature Communications

      Volume: 15 Issue: 1 Pages: 2267-2267

    • DOI

      10.1038/s41467-024-46406-5

    • Related Report
      2023 Research-status Report
    • Peer Reviewed / Open Access / Int'l Joint Research
  • [Presentation] Complex Spin-Flip Processes i Charge-Transfer-Type Organic Molecules2024

    • Author(s)
      Kim HyunSuk
    • Organizer
      有機EL討論会第38回例会
    • Related Report
      2024 Annual Research Report
  • [Presentation] Insight into Spin-Flip Processes at High-lying Triplet State for Charge-Transfer Molecule2023

    • Author(s)
      Hyung Suk Kim; Sang Hoon Lee; Seunghyup Yoo; Chihaya Adachi
    • Organizer
      KJF International Conference on Organic Materials for Electronic and Photonics 2023
    • Related Report
      2023 Research-status Report
    • Int'l Joint Research
  • [Presentation] Comprehensive Understading of Spin-Flip Processes in Charge-Trasnfer Molecule2023

    • Author(s)
      Hyung Suk Kim; Sang Hoon Lee; Seunghyup Yoo; Chihaya Adachi
    • Organizer
      The 23rd International Meeting on Information Display (IMID)
    • Related Report
      2023 Research-status Report
    • Int'l Joint Research

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Published: 2023-11-17   Modified: 2025-12-26  

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