Effect of Alkyl Chain Length of Quaternary Ammonium Surfactant Corrosion Inhibitor on Fe (110) in Acetic Acid Media via Computer Simulation

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Effect of Alkyl Chain Length of Quaternary Ammonium Surfactant Corrosion Inhibitor on Fe (110) in Acetic Acid Media via Computer Simulation

Density functional theory (DFT) and molecular dynamics (MD) simulations were employed to investigate the inhibition mechanism of cationic quaternary ammonium surfactant corrosion inhibitors (CIs) with varying chain lengths in 1.0 M HCl and 500 ppm acetic acid on Fe (110) surfaces. DFT calculations d...

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التفاصيل البيبلوغرافية
الحاوية / القاعدة:	CHEMENGINEERING
المؤلفون الرئيسيون:	Numin, Mohd Sofi; Jumbri, Khairulazhar; Eng, Kee Kok; Hassan, Almila; Borhan, Noorazlenawati; Daud, Nik M. Radi Nik M.; Nor, A. Azmi M.; Suhor, Firdaus; Dzulkifli, Nur Nadia
التنسيق:	مقال
اللغة:	English
منشور في:	MDPI 2025
الموضوعات:	Engineering
الوصول للمادة أونلاين:	https://www-webofscience-com.uitm.idm.oclc.org/wos/woscc/full-record/WOS:001429670900001

مواد مشابهة

Effect of Alkyl Chain Length of Quaternary Ammonium Surfactant Corrosion Inhibitor on Fe (110) in Acetic Acid Media via Computer Simulation
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