Tuning the Electronic Structure of the CoP/Ni₂P Nanostructure by Nitrogen Doping for an Efficient Hydrogen Evolution...

As one of the most sustainable, efficient, and cleanest ways for hydrogen production, electrochemical water splitting relies heavily on cost-efficient and stable electrocatalysts. Herein, a self-supported and nitrogen-doped hybrid CoP/Ni₂P was synthesized through a simple two-step hydrothermal process followed by low-temperature phosphorization and nitridation (N-CoP/Ni₂P@NF). Both experimental and density functional theory calculation results suggest that nitrogen doping can tune the electrical structure of the CoP/Ni₂P heterostructure and thus optimize the free energy of adsorbed H on the surface of N-CoP/Ni₂P@NF and accelerate the electronic transport activity. The prepared N-CoP/Ni₂P@NF exhibits excellent electrocatalytic hydrogen evolution reaction (HER) performance, which merely requires an overpotential of -46 mV at -10 mA cm^-2 and shows a negligible decay after a long durability test for 72 h in alkaline (1.0 M KOH) media. Consequently, this work supplies a novel strategy with great potential for designing transition metal phosphate-based catalysts with high HER performance.