中四苯基卟啉衍生物在酸性溶液中对低碳钢缓蚀的实验与理论研究

IF 2.9 Q2 ELECTROCHEMISTRY Journal of Electrochemical Science and Engineering Pub Date : 2022-09-06 DOI:10.5599/jese.1400
M. Meraghni, T. Lanez, E. Lanez, L. Bechki, Ali Kennoufa
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引用次数: 0

摘要

通过动电位极化实验和量子化学计算,研究了中四苯基卟啉(TPPH2)、中四苯基甲基卟啉TPPH2(p-Me)和中四苯基卟啉(TAcPPH2)对XC52低碳钢在加气0.5 M硫酸水溶液中的缓蚀作用。动电位极化结果表明,随着抑制剂浓度的增加,3种化合物的缓蚀效率均呈混合型,以阳极反应为主。所有化合物的吸附均遵循Langmuir吸附等温线,吸附自由能适中。采用DFT/B3LYP方法进行量子化学计算,证实了中四苯基卟啉与低碳钢表面之间存在强结合。通过测量金属/溶液界面处的零电荷电位(PZC)来确定抑制机理。
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Experimental and theoretical study on corrosion inhibition of mild steel by meso-tetraphenyl-porphyrin derivatives in acid solution
The inhibition effect of meso-tetraphenyl-porphyrin (TPPH2), meso-tetra4-methophenyl-porphyrin TPPH2(p-Me), and meso-tetra4-actophenyl-porphyrin (TAcPPH2) on the corrosion of XC52 mild steel in aerated 0.5 M aqueous sulfuric acid solution was studied by potentiodynamic polarization experiments and quantum chemical calculations. Results from potentiodynamic polarization showed that inhibition efficiency of three compounds increased upon increasing of the inhibitor concentration and they are acting as mixed type inhibitors, having dominant anodic reactions. Adsorption of all compounds follows the Langmuir adsorption isotherm with moderate values of free energy of adsorption. Quantum chemical calculation using DFT/B3LYP method confirmed a strong bond between meso-tetraphenyl-porphyrins and mild steel surface. The inhibition mechanism was also determined by the potential of zero charge (PZC) measurement at the metal/solution interface.
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来源期刊
CiteScore
3.60
自引率
27.30%
发文量
90
审稿时长
6 weeks
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