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PreprintCC BYChemRxiv

A Single-Li+ and Electron Mixed Conductor via Intrinsic Ion-Carrier Implantation in a Metal–Organic Framework

  1. 1School of Chemistry and Materials Science
  2. 2University of Science and Technology of China
  3. 3State Key Laboratory of Precision and Intelligent Chemistry

Abstract

We report a crystalline metal–organic framework (MOF) that enables efficient Li+ and electron conduction, where a triphenylene ligand functionalized with a propylsulfonate group is designed and utilized to introduce mobile Li+ ions while forming extended conjugation for electron transport. The resulting MOF exhibits a mixed conduction behavior in the solid state with a Li+ conductivity of up to 1.10 mS cm−1 and an electronic conductivity of 15.81 mS cm−1 at room temperature, together with a Li+ transference number close to 1.0. Mechanistic studies reveal that the conformationally dynamic propylsulfonate groups facilitate Li+ transport with low energy barriers in a manner resembling wobbling paddle wheels, and the rigid, conjugated scaffold promotes electronic conduction through in-plane π–d orbital coupling and interlayer interactions. This work establishes an effective bottom-up route for constructing crystalline, porous mixed Li+-electron conductors, offering a new platform for solid-state electrochemical devices requiring synchronized ion and electron transport.

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BibTeX
@misc{yang2026singleli,
  title = {{A Single-Li+ and Electron Mixed Conductor via Intrinsic Ion-Carrier Implantation in a Metal–Organic Framework}},
  author = {Chao Yang and Pengjia Qi and Liangjian Su and Jianbin Zhou and Zheng Meng},
  howpublished = {ChemRxiv},
  year = {2026},
  month = oct,
  doi = {10.26434/chemrxiv.15010698/v1},
  url = {https://chemrxiv.org/doi/full/10.26434/chemrxiv.15010698/v1},
  note = {CC BY},
}
RIS
TY  - UNPB
TI  - A Single-Li+ and Electron Mixed Conductor via Intrinsic Ion-Carrier Implantation in a Metal–Organic Framework
AU  - Chao Yang
AU  - Pengjia Qi
AU  - Liangjian Su
AU  - Jianbin Zhou
AU  - Zheng Meng
PY  - 2026
DA  - 2026/10/20
PB  - ChemRxiv
DO  - 10.26434/chemrxiv.15010698/v1
UR  - https://chemrxiv.org/doi/full/10.26434/chemrxiv.15010698/v1
AB  - We report a crystalline metal–organic framework (MOF) that enables efficient Li+ and electron conduction, where a triphenylene ligand functionalized with a propylsulfonate group is designed and utilized to introduce mobile Li+ ions while forming extended conjugation for electron transport. The resulting MOF exhibits a mixed conduction behavior in the solid state with a Li+ conductivity of up to 1.10 mS cm−1 and an electronic conductivity of 15.81 mS cm−1 at room temperature, together with a Li+ transference number close to 1.0. Mechanistic studies reveal that the conformationally dynamic propylsulfonate groups facilitate Li+ transport with low energy barriers in a manner resembling wobbling paddle wheels, and the rigid, conjugated scaffold promotes electronic conduction through in-plane π–d orbital coupling and interlayer interactions. This work establishes an effective bottom-up route for constructing crystalline, porous mixed Li+-electron conductors, offering a new platform for solid-state electrochemical devices requiring synchronized ion and electron transport.
ER  -