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December 2, 2025Nature Communications35 citationsOpen Access

Site-specific synergy by heteronuclear microenvironment atomic editing for oxygen reduction reaction

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HLHongxue Liu

Key Points

  • Enhanced power density of 282.7 mW cm-2 achieved using atomic editing in catalyst design, leading to improved performance.
  • Notable increase in activity driven by orbital hybridization and optimized interactions in the catalyst structure.
  • Application of a novel microenvironment atomic editing strategy to modify metal sites for better functionality.
  • Calls for innovative approaches in catalyst design to elevate performance benchmarks for clean energy technologies.

Abstract

Although iron-nitrogen-carbon catalysts are appealing for use in the oxygen reduction reaction, achieving high activity and a long lifetime remains a persistent challenge. This necessitates the precise modulation of the active sites' microenvironment. Herein, we present a microenvironment atomic editing strategy for accessing heteronuclear triatomic Fe and Co sites of Fe1Co2N7O1 supported on a nitrogen-doped carbon matrix (Fe1Co2/NC). Its performance is boosted by the orbital hybridization between Fe and Co atoms, which alters the d band centers to push the activity (half-wave potential of 0.94 V in alkaline and 0.88 V in acid conditions) and stability boundaries to a high level. The optimized metal-adsorbate interactions and strengthened metal - N bonding in Fe1Co2N7O1 are responsible for the competitive activity and stability. Furthermore, rechargeable and flexible quasi-solid-state zinc-air batteries using this catalyst achieve high power density (282.7 mW cm-2 and 95.8 mW cm-2) and high operational stability, and are therefore more energy-efficient than commercial catalysts. Our findings underscore the importance of atomic editing for designing low-nuclearity catalysts.

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Cite This Study

Hongxue Liu (2025) studied this question.

synapsesocial.com/papers/692e3d626c9b3ab28c186b70https://doi.org/10.1038/s41467-025-66841-2
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