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Review Article | Open Access

MXene-based single-atom catalysts: Synergistic interfaces and rational design for CO2 electrocatalytic reduction

Xuelei Yan1,2Yuwei Wang1Yang Cai1Hafiz Muhammad Adeel Sharif1Linxiao Hou1Chenghong Hu1Zhixuan Zhao1Changping Li1 ( )
Research Center for Eco-Environmental Engineering, Dongguan University of Technology, Dongguan 523808, China
School of Human Settlements and Civil Engineering, Xi'an Jiaotong University, Xi'an 710049, China
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An erratum to this article is available online at:

Abstract

The electrochemical CO2 reduction reaction (CO2RR) represents a pivotal strategy for climate change mitigation and carbon neutrality by converting CO2 into value-added chemicals under mild conditions. MXene-based single-atom catalysts (SACs) have emerged as promising systems for CO2RR, synergistically integrating MXene’s tunable two-dimensional (2D) architecture with atomic dispersion of active sites to achieve exceptional activity, selectivity, and stability. Thus, a timely review of the recent advances is necessary to inspire further research. This review systematically summarizes the anchoring mechanisms of single atoms on MXene substrates, focusing on the principal products generated by MXene-based single-atom catalysts in CO2 reduction reactions and the critical factors governing product selectivity. This review outlines the main strategies for optimizing MXene to enhance the performance of MXene-based SACs. Finally, conclusions and perspectives about MXene-based SACs for CO2RR are presented. This review underscores the potential of MXene-based SACs and provides a roadmap for their future development, aiming to bridge the gap between fundamental research and industrial application in CO2RR technologies.

Graphical Abstract

This review systematically examines the anchoring mechanisms of single atoms on MXene substrates, principal CO2 reduction reaction (CO2RR) products, and key factors of MXene-based single-atom catalysts (SACs) affecting product selectivity. It further outlines optimization strategies for MXene SAC performance and concludes with perspectives bridging fundamental research and industrial CO2RR applications.

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Nano Research
Article number: 94907748

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Cite this article:
Yan X, Wang Y, Cai Y, et al. MXene-based single-atom catalysts: Synergistic interfaces and rational design for CO2 electrocatalytic reduction. Nano Research, 2025, 18(12): 94907748. https://doi.org/10.26599/NR.2025.94907748
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Received: 28 April 2025
Revised: 11 June 2025
Accepted: 30 June 2025
Published: 03 December 2025
© The Author(s), corrected publication 2026. Published by Tsinghua University Press.

This is an open access article under the terms of the Creative Commons Attribution 4.0 International License (CC BY 4.0, https://creativecommons.org/licenses/by/4.0/).