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Experimental and DFT studies of flower-like Ni-doped Mo_(2)C on carbon fiber paper:A highly efficient and robust HER electrocatalyst modulated by Ni(NO_(3))_(2)concentration

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Journal of Advanced Ceramics 2022年第8期11卷 1294-1306页

作者： Lei ZHANG Zhihui HU Juntong HUANG Zhi CHEN xibao lia Zhijun FENG Huiyong YANG Saifang HUANG Ruiying LUO School of Materials Science and Engineering Nanchang Hangkong UniversityNanchang 330063China School of Materials Science and Engineering Jiangsu University of Science and TechnologyZhenjiang 212003China Research Institute for Frontier Science Beihang UniversityBeijing 100191China

Developing highly efficient and stable non-precious metal catalysts for water splitting is urgently *** this work,we report a facile one-step molten salt method for the preparation of self-supporting Ni-doped Mo_(2)C on carbon fiber paper(Ni–Mo_(2)CCB/CFP)for hydrogen evolution reaction(HER).The effects of nickel nitrate concentration on the phase composition,morphology,and electrocatalytic HER performance of Ni-doped Mo_(2)C@CFP electrocatalysts was *** the continuous increase of Ni(NO_(3))_(2)concentration,the morphology of Mo_(2)C gradually changes from granular to flower-like,providing larger specific surface area and more active *** nickel(Ni)into the crystal lattice of Mo_(2)C largely reduces the impedance of the electrocatalysts and enhances their electrocatalytic *** as-developed Mo_(2)C–3 M Ni(NO_(3))_(2)/CFP electrocatalyst exhibits high catalytic activity with a small overpotential of 56 mV at a current density of 10 mA·cm^(-2).This catalyst has a fast HER kinetics,as demonstrated by a very small Tafel slope of 27.4 mV·dec^(-1),and persistent long-term stability.A further higher Ni concentration had an adverse effect on the electrocatalytic *** functional theory(DFT)calculations further verified the experimental *** doping could reduce the binding energy of Mo–H,facilitating the desorption of the adsorbed hydrogen(Hads)on the surface,thereby improving the intrinsic catalytic activity of Ni-doped Mo_(2)C-based ***,excessive Ni doping would inhibit the catalytic activity of the *** work not only provides a simple strategy for the facile preparation of non-precious metal electrocatalysts with high catalytic activity,but also unveils the influence mechanism of the Ni doping concentration on the HER performance of the electrocatalysts from the theoretical perspective.

关键词： Mo_(2)C@CFP electrocatalyst nickel(Ni)doping hydrogen evolution reaction(HER) water splitting molten salt method

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