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Regulating Electronic Structure of Iron Nitride by Tungsten Nitride Nanosheets for Accelerated Overall Water Splitting.

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Two essential characteristics that are required for hybrid electrocatalysts to exhibit higher oxygen and hydrogen evolution reaction (OER and HER, respectively) activity are a favorable electronic configuration and a sufficient… Click to show full abstract

Two essential characteristics that are required for hybrid electrocatalysts to exhibit higher oxygen and hydrogen evolution reaction (OER and HER, respectively) activity are a favorable electronic configuration and a sufficient density of active sites at the interface between the two materials within the hybrid. In the present study, a hybrid electrocatalyst is introduced with a novel architecture consisting of coral-like iron nitride (Fe2 N) arrays and tungsten nitride (W2 N3 ) nanosheets that satisfies these requirements. The resulting W2 N3 /Fe2 N catalyst achieves high OER activity (268.5 mV at 50 mA cm-2 ) and HER activity (85.2 mV at 10 mA cm-2 ) with excellent long-term durability in an alkaline medium. In addition, density functional theory calculations reveal that the individual band centers experience an upshift in the hybrid W2 N3 /Fe2 N structure, thus improving the OER and HER activity. The strategy adopted here thus provides a valuable guide for the fabrication of cost-effective multi-metallic crystalline hybrids for use as multifunctional electrocatalysts.

Keywords: tungsten nitride; structure; nitride nanosheets; iron nitride; activity

Journal Title: Small
Year Published: 2023

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