Litcius/Paper detail

Chlorine-Induced Dangling Nitrogen-Bridged Dual-Atom Iron Catalyst for Highly Efficient Oxygen Reduction

Fanchao Zhang, Bingxian Chu, Bing Shao, Yu Lu, Hui-Min Yan, Yang-Gang Wang, Xin Xiao, Qiang Xu

2026Journal of the American Chemical Society9 citationsDOI

Abstract

Dual-atom catalysts (DACs) are regarded as promising electrocatalysts owing to their abundant active sites and tunable electronic structures, whereas precisely controlling diatomic-site configurations for optimal performance remains challenging. Herein, we precisely engineer a Cl-induced dangling N-bridged dual-atom Fe catalyst (Fe 2 NC-Cl), where the Cl introduction results in an out-of-plane dangling N-bridge to the di-Fe sites, mitigating the steric hindrance for reactants, and a strategic modulation of the d-band center of Fe sites, optimizing the adsorption–desorption equilibrium of oxygen-containing intermediates, thereby leading to a lower overpotential. The Fe 2 NC-Cl catalyst achieves an exceptional oxygen reduction reaction (ORR) activity, exhibiting a half-wave potential of 0.924 V with minimal potential decay (0.067 μV per cycle). When integrated into quasi-solid-state zinc-air battery, it delivers a remarkable power density of 231 mW cm –2 at 25 °C and maintains 82 mW cm –2 at −40 °C, alongside stable operation for 2400 h (14400 cycles). This work underscores the critical role of synergistic geometric-electronic engineering in breaking the activity-stability trade-off, providing a universal design paradigm for high-performance electrocatalysts.

Topics & Concepts

ChemistryCatalysisSteric effectsReduction (mathematics)Work (physics)Oxygen reduction reactionDangling bondChemical engineeringOxygenNanotechnologyDensity functional theoryPower (physics)Oxygen reductionModulation (music)PhotochemistryReaction conditionsElectronic effectRedoxInorganic chemistryHeterogeneous catalysisPower densityChemical reaction engineeringCombinatorial chemistryElectrocatalysts for Energy ConversionAdvanced battery technologies researchCO2 Reduction Techniques and Catalysts