I. Arukalam, I. O. Madu, N. T. Ijomah, C. Ewulonu, G. N. Onyeagoro
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引用次数: 32
摘要
采用失重测量、EIS、极化和量子化学计算等方法研究了乙基羟乙基纤维素在1.0 M H2SO4溶液中对低碳钢的缓蚀作用与添加剂浓度的关系。结果表明,肠出血性大肠杆菌对酸性介质中的腐蚀反应有抑制作用,且抑制效果随肠出血性大肠杆菌浓度的增加而增加。在碘离子存在时,由于协同作用,抑制效率进一步提高。阻抗结果表明,EHEC吸附在腐蚀金属表面。吸附遵循改进的Langmuir等温线,吸附自由能的负值非常高。极化数据表明,缓蚀剂为混合型,对阴极部分反应的影响较大。利用密度泛函理论,从理论上分析了EHEC分子的前沿分子轨道HOMO(最高占据分子轨道)和LUMO(最低未占据分子轨道)以及局部反应性,在分子水平上解释了EHEC分子的吸附特性。理论预测与实验结果吻合较好。
Acid Corrosion Inhibition and Adsorption Behaviour of Ethyl Hydroxyethyl Cellulose on Mild Steel Corrosion
The corrosion inhibition of mild steel in 1.0 M H2SO4 solution by ethyl hydroxyethyl cellulose has been studied in relation to the concentration of the additive using weight loss measurement, EIS, polarization, and quantum chemical calculation techniques. The results indicate that EHEC inhibited corrosion reaction in the acid medium and inhibition efficiency increased with EHEC concentration. Further increase in inhibition efficiency is observed in the presence of iodide ions, due to synergistic effect. Impedance results reveal that EHEC is adsorbed on the corroding metal surface. Adsorption followed a modified Langmuir isotherm, with very high negative values of the free energy of adsorption . The polarization data indicate that the inhibitor was of mixed type, with predominant effect on the cathodic partial reaction. The frontier molecular orbitals, HOMO (the highest occupied molecular orbital) and LUMO (the lowest unoccupied molecular orbital) as well as local reactivity of the EHEC molecule, were analyzed theoretically using the density functional theory to explain the adsorption characteristics at a molecular level. The theoretical predictions showed good agreement with experimental results.