Journal Article PUBDB-2024-06932

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Engineering multiple nano-twinned high entropy alloy electrocatalysts toward efficient water electrolysis

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2025
Elsevier Amsterdam

Applied catalysis / B 363, 124791 () [10.1016/j.apcatb.2024.124791]
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Abstract: Inducing defects in high entropy alloys (HEAs) has been recognized as a promising approach for tuning surface energetics and catalytic activities. However, the comprehensive understanding and facile synthetic methods for defect-rich HEAs remain challenging. Herein, we present an interstitial-atom engineering strategy that involves interstitial atom doping to synthesize B-doped FeCoNiCuMoB HEA films containing abundant multiple nano-twin boundaries. The resulting fivefold-twinned FeCoNiCuMoB catalyst exhibits exceptional performance in alkaline hydrogen evolution reaction (HER, 26 mV at −10 mA cm−2) and oxygen evolution reaction (OER, 201 mV at 10 mA cm−2). Notably, the two-electrode electrolyzer composed of the FeCoNiCuMoB film electrodes achieved the 10 mA cm−2 at an ultralow cell voltage (1.48 V) for water electrolysis, simultaneously maintaining long-term durability. Through in-situ Raman spectroscopy, X-ray absorption spectroscopy (XAS), electrochemical analyses, and density functional theory (DFT) calculations, we elucidate that the unique twin boundaries play a crucial role in tailoring surficial electronic structures. Moreover, election-rich B atoms display optimized atomic configurations, synergistically contributing to a thermodynamically favourable HER/OER pathway. This work provides a platform via interstitial-atom engineering for designing exceptional HEA catalysts, integrating planar defects and electronic effects, to enhance the efficiencies in water electrolysis applications.

Classification:

Contributing Institute(s):
  1. DOOR-User (DOOR ; HAS-User)
  2. Helmholtz-Zentrum Hereon (Hereon)
Research Program(s):
  1. 6G3 - PETRA III (DESY) (POF4-6G3) (POF4-6G3)
  2. NOMATEN - Centre of Excellence in Multifunctional Materials for Industrial and Medical Applications (857470) (857470)
Experiment(s):
  1. PETRA Beamline P03 (PETRA III)

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 Record created 2024-11-21, last modified 2026-03-24


Published on 2024-11-06. Available in OpenAccess from 2025-11-06.:
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