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Ni/WC-Mo2C ternary-interface electrocatalyst for bidirectional optimization of HER and OER

  • Bao Liu
  • , Yi Li
  • , Pengcheng Ding
  • , Dan Li
  • , Jiwei Li
  • , Xuanwei Zhao
  • , Jia Zu
  • , Maoyu Wang
  • , Ye Sun*
  • , Miao Yu*
  • *Corresponding author for this work
  • University of Electronic Science and Technology of China
  • School of Chemistry and Chemical Engineering, Harbin Institute of Technology
  • Harbin Institute of Technology
  • CAS - Shanghai Advanced Research Institute

Research output: Contribution to journalArticlepeer-review

Abstract

Developing efficient bifunctional electrocatalysts for water splitting remains challenging due to the antagonistic demands of oxygen and hydrogen evolution reactions (OER/HER). Herein, we present a ternary heterointerface non-precious catalyst, Ni/WC-Mo2C, for bidirectional HER and OER optimization. Combining in situ characterization and theoretical calculations, we demonstrate how this design overcomes conventional Schottky junction limitations: (i) The band gradient of the WC-Mo2C semiconductor heterojunction synergizes with metallic Ni's electron-donating properties to construct an “electron staircase” channel to enhance charge transfer while increasing active electron density and lowering the D-band center; and (ii) ternary interface-induced lattice strain buffering and localized electron redistribution stabilize high-valent Ni species and optimize intermediate adsorption/desorption energetics. This synergy resolves the OER-HER electronic conflict, endowing the catalyst with ultralow overpotentials of merely 26 mV for HER and 153 mV for OER at a current density of 10 mA cm −2 in 1.0 M KOH electrolyte. The assembled electrolyzer delivers a high current density of 1000 mA cm−2 at a low cell voltage of 1.73 V and sustains stable overall water splitting operation for an extended duration of 1200 h, outperforming noble-metal benchmarks (Pt/C||RuO2). This work establishes a new paradigm for non-precious bifunctional electrocatalyst design through multicomponent heterointerface engineering.

Original languageEnglish
Article number126514
JournalApplied Catalysis B: Environmental
Volume387
DOIs
StatePublished - 15 Jun 2026
Externally publishedYes

UN SDGs

This output contributes to the following UN Sustainable Development Goals (SDGs)

  1. SDG 7 - Affordable and Clean Energy
    SDG 7 Affordable and Clean Energy

Keywords

  • Bifunctional electrocatalyst
  • HER
  • In situ Raman spectra
  • OER
  • Schottky Junctions

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