A trimetallic Au3Ag3Cu6 nanocluster, obtained by Ag doping of Au3Cu9, exhibits enhanced NO3RR-to-NH3 performance, delivering 90.66% Faradaic efficiency at -0.6 V vs. RHE. DFT calculations reveal that Ag incorporation strengthens Au-Ag-Cu electronic synergy, optimizes key intermediate adsorption/conversion, and promotes reaction kinetics.
L. Li, A. Xie, C. Fang, L. xiong, Y. Sun, S. Jin and M. Zhu, Chem. Commun., 2026, Accepted Manuscript , DOI: 10.1039/D6CC01748G
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