Non-adiabatic molecular dynamics study of excited states in thermally stimulated delayed phosphorescent gold( <scp>iii</scp> ) complexes

Pyrazine-based gold( iii ) complexes demonstrate an emission mechanism involving higher triplet states that violates Kasha's rule.

Authors

Yün Peng (ORCID: https://orcid.org/0000-0001-6358-2333)
Shizheng Wen (ORCID: https://orcid.org/0000-0003-3578-1612)
Chou‐Hsun Yang (ORCID: https://orcid.org/0000-0002-8088-7072)
Xiao Zheng (ORCID: https://orcid.org/0009-0007-3330-6654)
Chi Yung Yam

Institutions

University of Science and Technology of China (CN)
Fudan University (CN)
Beijing Computational Science Research Center (CN)
Huaiyin Normal University (CN)
Institute of Chemistry, Academia Sinica (TW)
Quantum Technologies (Sweden) (SE)

Publication Details

Journal: Journal of Materials Chemistry C
Published: 2025-08-30
DOI: https://doi.org/10.1039/d5tc01840d
Primary Topic: Organic Light-Emitting Diodes Research
Type: article
Field-Weighted Citation Impact: 0.00

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article

Non-adiabatic molecular dynamics study of excited states in thermally stimulated delayed phosphorescent gold( iii ) complexes

Yün Peng, Shizheng Wen, Chou‐Hsun Yang, Xiao Zheng et al.

Aug 30, 2025

Journal of Materials Chemistry C

Organic Light-Emitting Diodes Research

article

Non-adiabatic molecular dynamics study of excited states in thermally stimulated delayed phosphorescent gold( iii ) complexes

Yün Peng, Shizheng Wen, Chou‐Hsun Yang, Xiao Zheng, Chi Yung Yam

August 30, 2025article en

Abstract

Pyrazine-based gold( iii ) complexes demonstrate an emission mechanism involving higher triplet states that violates Kasha's rule.

Journal of Materials Chemistry CVol. 14(2)

University of Science and Technology of China (CN), Fudan University (CN), Beijing Computational Science Research Center (CN), Huaiyin Normal University (CN), Institute of Chemistry, Academia Sinica (TW), Quantum Technologies (Sweden) (SE)

Openalex Percentile: Top 78%

Organic Light-Emitting Diodes Research

DOI Source OpenAlex

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Non-adiabatic molecular dynamics study of excited states in thermally stimulated delayed phosphorescent gold( <scp>iii</scp> ) complexes — Yün Peng, Shizheng Wen, et al. · Journal of Materials Chemistry C (2025) | TGRS Research Map | TGRS