Maeda Yutaka, Suzuki Yasuhiro, Konno Yui, Zhao Pei, Kikuchi Nobuhiro, Yamada Michio, Mitsuishi Masaya, Dao Anh T N, Kasai Hitoshi, Ehara Masahiro
Department of Chemistry, Tokyo Gakugei University, Tokyo, 184-8501, Japan.
Research Center for Computational Science, Institute for Molecular Science, Okazaki, 444-8585, Japan.
Commun Chem. 2023 Jul 31;6(1):159. doi: 10.1038/s42004-023-00950-1.
Chemical functionalisation of semiconducting single-walled carbon nanotubes (SWNTs) can tune their local band gaps to induce near-infrared (NIR) photoluminescence (PL). However, tuning the PL to telecommunication wavelengths (>1300 nm) remains challenging. The selective emergence of NIR PL at the longest emission wavelength of 1320 nm was successfully achieved in (6,5) SWNTs via cyclic perfluoroalkylation. Chiral separation of the functionalised SWNTs showed that this functionalisation was also effective in SWNTs with five different chiral angles. The local band gap modulation mechanism was also studied using density functional theory calculations, which suggested the effects of the addenda and addition positions on the emergence of the longest-wavelength PL. These findings increase our understanding of the functionalised SWNT structure and methods for controlling the local band gap, which will contribute to the development and application of NIR light-emitting materials with widely extended emission and excitation wavelengths.
半导体单壁碳纳米管(SWNTs)的化学功能化可以调节其局部带隙,以诱导近红外(NIR)光致发光(PL)。然而,将PL调节到电信波长(>1300 nm)仍然具有挑战性。通过环状全氟烷基化,在(6,5)SWNTs中成功实现了在最长发射波长1320 nm处选择性出现近红外PL。功能化SWNTs的手性分离表明,这种功能化在具有五个不同手性角的SWNTs中也有效。还使用密度泛函理论计算研究了局部带隙调制机制,这表明添加剂和添加位置对最长波长PL出现的影响。这些发现增进了我们对功能化SWNT结构以及控制局部带隙方法的理解,这将有助于开发和应用具有广泛扩展发射和激发波长的近红外发光材料。