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首页> 外文期刊>Journal of Molecular Liquids >Anticorrosion properties of 5,5 '-dithiobis-(2-nitrobenzoic acid) and sodium sulfite compounds for aluminum alloy 2024-T3 in saline solution: Electrochemical, characterization and theoretical investigations
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Anticorrosion properties of 5,5 '-dithiobis-(2-nitrobenzoic acid) and sodium sulfite compounds for aluminum alloy 2024-T3 in saline solution: Electrochemical, characterization and theoretical investigations

机译:5,5'-二硝基苯乙酸 - (2-硝基苯甲酸)的防腐性和盐水溶液中的铝合金2024-T3亚硫酸钠化合物:电化学,表征和理论研究

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摘要

The corrosion inhibition of aluminum alloy 2024-T3 by two organic compounds, 5,5'-dithiobis-(2-nitrobenzoic acid) (ER) and sodium sulfite (SUL), in 3.5% NaCl is investigated at various temperatures using electrochemical techniques, such as impedance spectroscopy (EIS) and potentiodynamic polarization. The polarization curves indicate that the inhibitors tested acted as cathodic inhibitors. The inhibition efficiency (IE %) increased with increasing inhibitor concentration to 93% at 10-2 M ER and 98% at 5.10-3 M of SUL. Moreover, adsorption of the compound on the surface of aluminum in 3.5% NaCl follows the Langmuir isotherm model. Data obtained from EIS studies are analyzed to model the interface of the metal/solution through appropriate equivalent circuit models. We study the temperature effect on the corrosion behavior of the aluminum alloy in 3.5% NaCl with and without the inhibitors. The adsorption free energy and activation parameters of the aluminum dissolution reaction in the presence of ER and SUL are determined. The results of SEM-EDS analyses support the adsorption inhibition mechanism. DFT using B3LYP/6-311G (d,p) is also performed in order to determine the correlation between the corrosion inhibition properties of the examined derivatives and their molecular structures. The adsorption of the compounds is confirmed by MD simulations. The experimental results support the theoretical outcomes. (C) 2021 Elsevier B.V. All rights reserved.
机译:采用阻抗谱(EIS)和动电位极化等电化学技术,在不同温度下研究了5,5'-二硫代二(2-硝基苯甲酸)(ER)和亚硫酸钠(SUL)两种有机化合物在3.5%NaCl中对2024-T3铝合金的缓蚀作用。极化曲线表明,所测试的缓蚀剂起到了阴极缓蚀剂的作用。抑制效率(IE%)随着抑制剂浓度的增加而增加,在10-2 M ER时为93%,在5.10-3 M SUL时为98%。此外,在3.5%NaCl中,化合物在铝表面的吸附遵循Langmuir等温模型。通过适当的等效电路模型,对EIS研究获得的数据进行分析,以模拟金属/溶液的界面。我们研究了温度对铝合金在3.5%NaCl中有无缓蚀剂的腐蚀行为的影响。测定了ER和SUL存在下铝溶解反应的吸附自由能和活化参数。SEM-EDS分析结果支持吸附抑制机理。还使用B3LYP/6-311G(d,p)进行DFT,以确定所研究衍生物的缓蚀性能与其分子结构之间的相关性。分子动力学模拟证实了化合物的吸附。实验结果支持理论结果。(c)2021爱思唯尔B.V.保留所有权利。

著录项

  • 来源
    《Journal of Molecular Liquids》 |2021年第1期|共17页
  • 作者单位

    Ibn Tofail Univ Fac Sci Adv Mat &

    Proc Engn POB 133 Kenitra 14000 Morocco;

    Ibn Tofail Univ Fac Sci Adv Mat &

    Proc Engn POB 133 Kenitra 14000 Morocco;

    Ibn Tofail Univ Fac Sci Adv Mat &

    Proc Engn POB 133 Kenitra 14000 Morocco;

    Ibn Tofail Univ Fac Sci Lab Organ Inorgan Chem Electrochem &

    Environm POB 133 Kenitra 14000 Morocco;

    Univ Sidi Mohamed Ben Abdellah Fac Sci Lab Organometall Mol Mat &

    Environm BP 1796 Fes Morocco;

    Ibn Tofail Univ Fac Sci Adv Mat &

    Proc Engn POB 133 Kenitra 14000 Morocco;

    Tongren Univ Sch Mat &

    Chem Engn Tongren 554300 Peoples R China;

    Ibn Tofail Univ Fac Sci Adv Mat &

    Proc Engn POB 133 Kenitra 14000 Morocco;

  • 收录信息
  • 原文格式 PDF
  • 正文语种 eng
  • 中图分类 理论物理学;
  • 关键词

    Corrosion inhibition; Aluminum alloy 2024-T3; 3.5 NaCl; EIS; Polarization; DFT/MD;

    机译:腐蚀抑制;铝合金2024-T3;3.5%NaCl;EIS;极化;DFT / MD;

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