通过吸附可可(可可)皮提取物在钢表面的缓蚀:实验和DFT结果

Apriska Prameswari, D. Dahlan, Y. Yetri, Imelda
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引用次数: 0

摘要

钢表面涂层采用浸泡法在可可(可可)皮提取物抑制剂中浸泡24、72、120和168小时。采用HCl进行腐蚀处理,浸泡时间分别为48、96和144小时。失重法腐蚀试验效果最好,腐蚀速率最低,为0.2972 mg。在缓蚀剂中浸泡时间最长的钢样品,缓蚀效率为74.7128%。光学显微镜和扫描电镜图像表明,在缓蚀剂中浸泡时间越长,钢的表面形貌越好(即孔洞和裂纹越少)。XRD衍射图中出现的四个尖峰表明,腐蚀速率最低的样品由于钢表面与缓蚀剂的反应产生了铁和C的结晶相。采用密度泛函理论(DFT)方法进行的量子化学分析也产生了相当高的抑制效率,接近实验结果的80.2098%。
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A Corrosion Inhibition through the Adsorption of Cacao (Theobroma cacao) Peels Extract on Steel Surfaces: Experimental and DFT Results
Steel surface coating has been carried out using the immersion method in an inhibitor of cacao (Theobroma cacao) peel extract for 24, 72, 120, and 168 hours. The corrosion treatment was performed using HCl with different immersion time of 48, 96, and 144 hours after coating process with the inhibitor. Corrosion testing with the weight loss method gave the best results with the lowest corrosion rate of 0.2972 mg.cm2/hour and inhibition efficiency of 74.7128% for steel samples with the longest immersion time in inhibitor. Optical microscopy and SEM images indicated that the longer the immersion time in the inhibitor, the better (i.e., fewer holes and cracks) the surface morphology of the steel. The appearance of four sharp peaks in the XRD diffractogram indicated that the samples with the lowest corrosion rate produced Fe and C crystalline phases due to the reaction between the steel surface and the inhibitor. A quantum chemical analysis using the DFT (Density Functional Theory) method also produced a fairly high inhibition efficiency and was close to the experimental results of 80.2098%.
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