一种新型咪唑基缓蚀剂对酸性环境下Q235碳钢的缓蚀效果

IF 3.1 3区 化学 Q3 CHEMISTRY, PHYSICAL
Ye Wan, Ning Jiao, Jiahui Lin
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引用次数: 0

摘要

钢在酸性环境中的腐蚀造成了相当大的经济损失和资源浪费。合成了一种新型咪唑基缓蚀剂,并在1 M盐酸溶液中对其对Q235钢的防腐性能进行了评价。电化学阻抗谱和动态电位极化结果表明,当IM-M的浓度为300 mg/L时,其缓蚀效率可达97.9%以上。密度泛函理论确定了咪唑环上的活性位点和抑制剂的亲水性基团。分子动力学表明活性位点偏好和烷基链疏水性促进了吸附。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Inhibitor efficiency of a novel imidazole-based inhibitor for Q235 carbon steel exposed to acidic environments

Inhibitor efficiency of a novel imidazole-based inhibitor for Q235 carbon steel exposed to acidic environments
Steel corrosion in the acidic environments poses considerable economic losses and waste of resources. A novel imidazole-based inhibitor was synthesized, and its anti-corrosion performance on Q235 steel were evaluated in 1 M HCl solution. The results of electrochemical impedance spectroscopy and dynamic potential polarization showed that the inhibition efficiencies were more than 97.9 % when the concentration of the IM-M was 300 mg/L. Density functional theory identified the active sites sitting on the imidazole rings and hydrophilic groups of the inhibitor. Molecular dynamics revealed adsorption promotion by the active site preference and the alkyl chain hydrophobicity.
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来源期刊
Chemical Physics Letters
Chemical Physics Letters 化学-物理:原子、分子和化学物理
CiteScore
5.70
自引率
3.60%
发文量
798
审稿时长
33 days
期刊介绍: Chemical Physics Letters has an open access mirror journal, Chemical Physics Letters: X, sharing the same aims and scope, editorial team, submission system and rigorous peer review. Chemical Physics Letters publishes brief reports on molecules, interfaces, condensed phases, nanomaterials and nanostructures, polymers, biomolecular systems, and energy conversion and storage. Criteria for publication are quality, urgency and impact. Further, experimental results reported in the journal have direct relevance for theory, and theoretical developments or non-routine computations relate directly to experiment. Manuscripts must satisfy these criteria and should not be minor extensions of previous work.
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