{"title":"Investigation of hydrogen evolution kinetics of metal-doped MoS2 electrocatalysts by exploring the charge transfer coefficients","authors":"Nayana K , Sunitha A.P.","doi":"10.1016/j.jelechem.2025.119095","DOIUrl":null,"url":null,"abstract":"<div><div>Charge transfer coefficient (α) is an intrinsic activity parameter of hydrogen evolution reaction (HER), as it deals with the fraction of supplied energy used to increase the HER kinetics. This article investigated the HER kinetics of MoS<sub>2</sub>, aluminium (Al-MoS<sub>2</sub>) and tin (Sn-MoS<sub>2</sub>) doped MoS<sub>2</sub> nanostructures by estimating the exact values of α. This article proposes a simple method of the least square curve fitting of the Butler-Volmer equation on the experimentally produced polarization curve of HER to derive α. Since the charge transfer coefficient depends on the current density, in curve fitting, values of α are determined at three different current density regions. The correctness of the estimated α was verified by comparing it with the same derived from Tafel plots of experimental values. Overpotential, Tafel slope, Turnover frequency (TOF), double layer capacitance, electrochemically active surface area (ECSA) and exchange current densities were estimated to confirm the reliability of obtained α values. All electrocatalytic parameters show that Al-MoS<sub>2</sub> has excellent HER activity with overpotential: 249 mV at 10 mA/cm<sup>2</sup>, Tafel slope: 67 mV/Dc, TOF: 0.32 s<sup>−1</sup>, double layer capacitance: 17 mF/cm<sup>2</sup>, ECSA: 425/cm<sup>2</sup> and Exchange current density: 1.38 mA/cm<sup>2</sup>. The estimated value of α for Al-MoS<sub>2</sub> is 0.89 at the current density region −5 mA/cm<sup>2</sup> and − 15 mA/cm<sup>2</sup> which exhibit the excellent electrocatalytic activity of the catalyst. Estimation of the exact value of α will help to understand the exact electrocatalytic mechanism of the catalyst.</div></div>","PeriodicalId":355,"journal":{"name":"Journal of Electroanalytical Chemistry","volume":"986 ","pages":"Article 119095"},"PeriodicalIF":4.1000,"publicationDate":"2025-03-29","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Electroanalytical Chemistry","FirstCategoryId":"92","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S1572665725001699","RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"CHEMISTRY, ANALYTICAL","Score":null,"Total":0}
引用次数: 0
Abstract
Charge transfer coefficient (α) is an intrinsic activity parameter of hydrogen evolution reaction (HER), as it deals with the fraction of supplied energy used to increase the HER kinetics. This article investigated the HER kinetics of MoS2, aluminium (Al-MoS2) and tin (Sn-MoS2) doped MoS2 nanostructures by estimating the exact values of α. This article proposes a simple method of the least square curve fitting of the Butler-Volmer equation on the experimentally produced polarization curve of HER to derive α. Since the charge transfer coefficient depends on the current density, in curve fitting, values of α are determined at three different current density regions. The correctness of the estimated α was verified by comparing it with the same derived from Tafel plots of experimental values. Overpotential, Tafel slope, Turnover frequency (TOF), double layer capacitance, electrochemically active surface area (ECSA) and exchange current densities were estimated to confirm the reliability of obtained α values. All electrocatalytic parameters show that Al-MoS2 has excellent HER activity with overpotential: 249 mV at 10 mA/cm2, Tafel slope: 67 mV/Dc, TOF: 0.32 s−1, double layer capacitance: 17 mF/cm2, ECSA: 425/cm2 and Exchange current density: 1.38 mA/cm2. The estimated value of α for Al-MoS2 is 0.89 at the current density region −5 mA/cm2 and − 15 mA/cm2 which exhibit the excellent electrocatalytic activity of the catalyst. Estimation of the exact value of α will help to understand the exact electrocatalytic mechanism of the catalyst.
期刊介绍:
The Journal of Electroanalytical Chemistry is the foremost international journal devoted to the interdisciplinary subject of electrochemistry in all its aspects, theoretical as well as applied.
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