Cited by 190Electrocatalysts for Energy ConversionCO2 Reduction Techniques and CatalystsMetalloenzymes and iron-sulfur proteins

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In Situ Phase Transformation on Nickel-Based Selenides for Enhanced Hydrogen Evolution Reaction in Alkaline Medium

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Zhai, Lingling, Benedict Lo, Tsz Woon, Xu, Zheng-Long, Potter, Jonathan, Mo, Jiaying, Guo, Xuyun, Tang, Chiu Chung, Edman Tsang, Shik Chi, Lau, Shu Ping·2020·ACS Energy Letters

DOI 10.1021/acsenergylett.0c01385

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Abstract

Identification of the active species in electrocatalysts toward hydrogen evolution reaction (HER) is of great significance for the development of the catalytic industry; however, it is still the subject of considerable controversy. Herein, we applied operando synchrotron X-ray powder diffraction (SXRD) in the NiSe 2 electrocatalyst system, and an in situ phase transformation from cubic NiSe 2 to hexagonal NiSe was revealed. The NiSe phase showed an enhanced catalytic activity. Operando Raman spectroscopy verified the decomposition of NiSe 2 during HER. Theoretical calculations suggested that the charge transfers from the Se site to Ni site during this evolution process, leading to an increased conductivity and a shifting up of d -band center, which is attributed to the enhanced activity. The generated NiSe phase acts as the “real” active species. Our work unravels the underlying phase transition of the electrocatalyst on reductive conditions in alkaline medium and highlights the significance of identifying the intrinsic active sites under realistic reaction conditions.

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Authors: Zhai, L., Benedict Lo, T. W., Xu, Z.-L., Potter, J., Mo, J., Guo, X., Tang, C. C., Edman Tsang, S. C., & Lau, S. P.
Affiliations: Department of Applied Physics, The Hong Kong Polytechnic University, Hung Hom, Hong Kong, China
State Key Laboratory of Chemical Biology and Drug Discovery, Department of Applied Biology and Chemical Technology, The Hong Kong Polytechnic University, Hung Hom, Hong Kong, China
Hong Kong Polytechnic University (HK)
Diamond Light Source (GB)
University of Oxford (GB)
The Wolfson Catalysis Centre, Department of Chemistry, University of Oxford, Oxford OX1 3QR, U.K.
Corresponding author: Lau, Shu Ping
ORCID: Xu, Zheng-Long
Mo, Jiaying
Guo, Xuyun
Tang, Chiu Chung
Lau, Shu Ping
Venue: ACS Energy Letters
Publisher: American Chemical Society (ACS)
Published: 2020-07-01
Volume: 5
Issue: 8
Pages: 2483-2491
ISSN: 2380-8195 (ISSN-L)
DOI: 10.1021/acsenergylett.0c01385
OpenAlex: W3039024650
Cited by: 188
References: 44
Citations by year: 2026: 19 · 2025: 21 · 2024: 30 · 2023: 38 · 2022: 46 · 2021: 32 · 2020: 2
FWCI: 5.83
Type: journal article
Language: en
Open access: green
hdl.handle.net
Licence: doi.org/10.15223/policy-029 (stm-asf)
doi.org/10.15223/policy-037 (stm-asf)
doi.org/10.15223/policy-045 (stm-asf)
Locations: ACS Energy Letters (publishedVersion)
PolyU Institutional Research Archive (Hong Kong Polytechnic University) (submittedVersion)
Funders: Research Grants Council, University Grants Committee (PolyU 253009/18P)
Diamond Light Source (NT23230)
Hong Kong Polytechnic University (1-ZVGH)
Topics: Physical Sciences › Energy › Renewable Energy, Sustainability and the Environment › Electrocatalysts for Energy Conversion
Physical Sciences › Energy › Renewable Energy, Sustainability and the Environment › CO2 Reduction Techniques and Catalysts
Life Sciences › Biochemistry, Genetics and Molecular Biology › Biochemistry › Metalloenzymes and iron-sulfur proteins
Keywords: hydrogen evolution reaction, nickel selenide, NiSe2, NiSe, in situ phase transformation, electrocatalysts, alkaline solution, active site, operando Raman spectroscopy, charge transfer, d-band center, cubic-to-hexagonal phase transition

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In Situ Phase Transformation on Nickel-Based Selenides for Enhanced Hydrogen Evolution Reaction in Alkaline Medium

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