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Engineering surface functional groups of MXenes for advanced catalysis and energy technology
Wenkang Xu1, Haoran Wang1, Xiaoyan An1
1School of Chemistry and Chemical Engineering, South China University of Technology, Guangzhou 510641, China. yuhao@scut.edu.cn.
Nanoscale Horizons
|June 16, 2026
Summary
Surface functionalization of MXenes (2D transition metal carbides, nitrides, and carbonitrides) is key to enhancing their catalytic and energy storage applications. Tailoring these surface groups (Tx) optimizes material properties for improved performance.
Area of Science:
- Materials Science
- Surface Chemistry
- Nanotechnology
Background:
- MXenes are 2D transition metal carbides, nitrides, and carbonitrides with unique properties like conductivity and tunable surface groups (Tx).
- Surface functional groups (Tx) significantly influence MXenes' structural, electronic, mechanical, and chemical characteristics.
- MXenes are promising for catalysis and energy storage due to their tunable surface chemistry.
Purpose of the Study:
- To systematically review advances in surface Tx engineering of MXenes.
- To elucidate the mechanisms linking Tx customization to property evolution and performance.
- To highlight the role of Tx tunability in MXenes for catalysis and energy technologies.
Main Methods:
- Review of recent literature on MXene surface Tx engineering strategies.
- Analysis of structure-property-performance relationships in MXenes.
- Discussion of mechanistic roles of distinct Tx in various applications.
Main Results:
- Tx engineering, via synthesis control or post-treatment, precisely modulates MXene properties like conductivity and stability.
- Tailored MXene properties enhance electrocatalysis (e.g., H2 evolution, CO2 reduction) and energy storage (batteries, supercapacitors).
- Specific Tx groups critically influence intermediate adsorption, charge transfer, ion accessibility, and redox activity.
Conclusions:
- Surface Tx engineering is a powerful strategy for optimizing MXenes in catalysis and energy storage.
- Understanding Tx-property-performance links is crucial for rational MXene design.
- Future research should focus on advanced surface engineering for novel MXene applications.

