中国物理B ›› 2025, Vol. 34 ›› Issue (6): 66204-066204.doi: 10.1088/1674-1056/adc193

所属专题: SPECIAL TOPIC — Structures and properties of materials under high pressure

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Structural regulation and optical behavior of zero-dimensional Cu(I)-based organometallic halides under pressure

Runnan Ye(叶润楠)1,†, Jingtian Wang(王敬天)2,†, Jiayi Yang(杨佳毅)2,†, Xuchen Wang(王旭晨)1, Junce Lei(雷钧策)1, Wenya Zhao(赵文雅)2, Yufan Meng(孟雨凡)2, Guanjun Xiao(肖冠军)2,‡, and Bo Zou(邹勃)2   

  1. 1 College of Physics, Jilin University, Changchun 130012, China;
    2 State Key Laboratory of High Pressure and Superhard Materials, College of Physics, Jilin University, Changchun 130012, China
  • 收稿日期:2025-02-23 修回日期:2025-03-12 接受日期:2025-03-18 出版日期:2025-05-16 发布日期:2025-06-05
  • 通讯作者: Guanjun Xiao E-mail:xguanjun@jlu.edu.cn
  • 基金资助:
    Project supported by the National Key R&D Program of China (Grant No. 2023YFA1406200), the National Natural Science Foundation of China (Grant Nos. 12174144 and 12474009), and the Graduate Innovation Fund of Jilin University (Grant No. 2024CX201).

Structural regulation and optical behavior of zero-dimensional Cu(I)-based organometallic halides under pressure

Runnan Ye(叶润楠)1,†, Jingtian Wang(王敬天)2,†, Jiayi Yang(杨佳毅)2,†, Xuchen Wang(王旭晨)1, Junce Lei(雷钧策)1, Wenya Zhao(赵文雅)2, Yufan Meng(孟雨凡)2, Guanjun Xiao(肖冠军)2,‡, and Bo Zou(邹勃)2   

  1. 1 College of Physics, Jilin University, Changchun 130012, China;
    2 State Key Laboratory of High Pressure and Superhard Materials, College of Physics, Jilin University, Changchun 130012, China
  • Received:2025-02-23 Revised:2025-03-12 Accepted:2025-03-18 Online:2025-05-16 Published:2025-06-05
  • Contact: Guanjun Xiao E-mail:xguanjun@jlu.edu.cn
  • Supported by:
    Project supported by the National Key R&D Program of China (Grant No. 2023YFA1406200), the National Natural Science Foundation of China (Grant Nos. 12174144 and 12474009), and the Graduate Innovation Fund of Jilin University (Grant No. 2024CX201).

摘要: Low-dimensional hybrid metal halides exhibit broadband emission and high photoluminescence quantum yield (PLQY), making them promising candidates for the next-generation luminescent materials in lighting applications. Here, the emission intensity of (C$_{12}$H$_{24}$O$_{6}$)$_{2}$Na$_{2}$(H$_{2}$O)$_{3}$Cu$_{4}$I$_{6}$ was strengthened between 9.3 GPa and 17.2 GPa, accompanied by the redshift of emission wavelength. The photoluminescence (PL) of Cu(I)-based organometallic halides originates from multiple emission states, which are a metal-to-ligand charge transfer or a halide-to-ligand charge transfer (MLCT/HLCT) excited state and a cluster-centered (CC) excited state. MLCT/HLCT-related emission wavelength redshifts while CC-related emission wavelength remains unchanged, indicating that the rearrangement of different emission states plays a critical role in the changes of luminescence wavelength. This study not only deepens the understanding of the influence of high pressure on (C$_{12}$H$_{24}$O$_{6}$)$_{2}$Na$_{2}$(H$_{2}$O)$_{3}$Cu$_{4}$I$_{6}$, but also provides valuable insights into the structure-property relationship of zero-dimensional Cu(I)-based organometallic halides.

关键词: low-dimensional Cu-based halides, high pressure, redshift, rearrangement

Abstract: Low-dimensional hybrid metal halides exhibit broadband emission and high photoluminescence quantum yield (PLQY), making them promising candidates for the next-generation luminescent materials in lighting applications. Here, the emission intensity of (C$_{12}$H$_{24}$O$_{6}$)$_{2}$Na$_{2}$(H$_{2}$O)$_{3}$Cu$_{4}$I$_{6}$ was strengthened between 9.3 GPa and 17.2 GPa, accompanied by the redshift of emission wavelength. The photoluminescence (PL) of Cu(I)-based organometallic halides originates from multiple emission states, which are a metal-to-ligand charge transfer or a halide-to-ligand charge transfer (MLCT/HLCT) excited state and a cluster-centered (CC) excited state. MLCT/HLCT-related emission wavelength redshifts while CC-related emission wavelength remains unchanged, indicating that the rearrangement of different emission states plays a critical role in the changes of luminescence wavelength. This study not only deepens the understanding of the influence of high pressure on (C$_{12}$H$_{24}$O$_{6}$)$_{2}$Na$_{2}$(H$_{2}$O)$_{3}$Cu$_{4}$I$_{6}$, but also provides valuable insights into the structure-property relationship of zero-dimensional Cu(I)-based organometallic halides.

Key words: low-dimensional Cu-based halides, high pressure, redshift, rearrangement

中图分类号:  (High-pressure effects in solids and liquids)

  • 62.50.-p