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Interface Engineering-Induced 1T-MoS2/NiS Heterostructure for Efficient Hydrogen Evolution Reaction

Helei Wei, Aidong Tan, Wenbo Liu, Jinhua Piao, Kai Wan, Zhenxing Liang, Zhipeng Xiang, Zhiyong Fu

2022Catalysts25 citationsDOIOpen Access PDF

Abstract

Metal phase molybdenum disulfide (1T-MoS2) is considered a promising electrocatalyst for the hydrogen evolution reaction (HER). In this work, an interface engineering-induced strategy is reported to prepare a 1T-MoS2/NiS heterostructure. The 1T-MoS2/NiS heterostructure exhibits an enhanced HER activity compared with that of the 1T-MoS2 in 1.0 M KOH. It achieves an overpotential of 0.12 V at a current density of 10 mA cm−2 with a Tafel slope of 69 mV dec−1. The density functional theory (DFT) calculations reveal that the interface engineering-induced 1T-MoS2/NiS heterostructure exhibits regulated electronic states of the S sites in 1T-MoS2, thus promoting the HER activity. This work demonstrates that tuning the electronic structure through interface engineering to enhance the intrinsic activity of electrocatalysts is a feasible strategy.

Topics & Concepts

Tafel equationOverpotentialHeterojunctionMolybdenum disulfideDensity functional theoryMaterials scienceElectrocatalystInterface (matter)Electronic structureMetalNanotechnologyOptoelectronicsChemistryElectrochemistryComputational chemistryPhysical chemistryComposite materialMetallurgyElectrodeCapillary numberCapillary actionElectrocatalysts for Energy ConversionAdvanced Photocatalysis TechniquesChalcogenide Semiconductor Thin Films