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Journal of Adhesion Science and Technology Volume 33, 2019 - Issue 9
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Original Articles

Exploring deep insights into the interaction mechanism of a quinazoline derivative with mild steel in HCl: electrochemical, DFT, and molecular dynamic simulation studies

Abdelkarim ChaouikiLaboratory of Applied Chemistry and Environment, ENSA, University Ibn Zohr, Agadir, Morocco; ;Laboratory separation processes, Faculty of Science, University Ibn Tofail, Kenitra, Morocco; View further author information
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Hassane LgazDepartment of Crop Science, College of Sanghur Life Science, Konkuk University, Seoul, South Korea; View further author information
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Saman ZehraCorrosion Research Laboratory, Department of Applied Chemistry, Faculty of Engineering and Technology, Aligarh Muslim University, Aligarh, India; View further author information
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Rachid SalghiLaboratory of Applied Chemistry and Environment, ENSA, University Ibn Zohr, Agadir, Morocco; View further author information
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Ill-Min ChungDepartment of Crop Science, College of Sanghur Life Science, Konkuk University, Seoul, South Korea; Correspondence[email protected]
View further author information
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Yasmina El AoufirMaterials, Nanotechnology and Environment Laboratory, Faculty of Sciences, Mohammed V University, Rabat, Morocco; View further author information
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K. Subrahmanya BhatDepartment of Chemistry, Manipal Institute of Technology, Manipal Academy of Higher Education, Manipal, Karnataka, India; ORCID Iconhttp://orcid.org/0000-0002-7948-8621View further author information
ORCID Icon,
Ismat H. AliDepartment of Chemistry, College of Science, King Khalid University, Abha, Kingdom of Saudi Arabia; View further author information
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Santosh L. GaonkarDepartment of Chemistry, Manipal Institute of Technology, Manipal Academy of Higher Education, Manipal, Karnataka, India; View further author information
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Mohammad I. KhanChemical Engineering Department, College of Engineering, King Khalid University, Abha, Kingdom of Saudi ArabiaORCID Iconhttp://orcid.org/0000-0003-2921-1314View further author information
ORCID Icon &
Hassan OuddaLaboratory separation processes, Faculty of Science, University Ibn Tofail, Kenitra, Morocco; View further author information
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Pages 921-944 | Received 21 Jun 2018, Accepted 28 Nov 2018, Published online: 23 Feb 2019

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Manilal Murmu, Sourav Kr. Saha, Lei Guo, Naresh Chandra Murmu & Priyabrata Banerjee. (2023) Intrinsic electronic property and adsorption of organic molecules on specific iron surface: an ab initio DFT and DFTB study. Journal of Adhesion Science and Technology 37:12, pages 1837-1855.
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Xia Liu, Xuemei Pan, Meiheng Lu, Yue Sun, Zhengbin Wang & Yugui Zheng. (2021) Nicotinic acid derivatives as corrosion inhibitors for mild steel in hydrochloric acid solutions: an experimental and computational chemistry study. Journal of Adhesion Science and Technology 35:1, pages 63-80.
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Maryam Chafiq, Abdelkarim Chaouiki, Hassane Lgaz, Rachid Salghi, Santosh L. Gaonkar, K. Subrahmanya Bhat, Riadh Marzouki, Ismat H. Ali, Mohammad I. Khan, Hiroki Shimizu & Ill-Min Chung. (2020) Synthesis and corrosion inhibition evaluation of a new schiff base hydrazone for mild steel corrosion in HCl medium: electrochemical, DFT, and molecular dynamics simulations studies. Journal of Adhesion Science and Technology 34:12, pages 1283-1314.
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Articles from other publishers (29)

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Ismat H. Ali, Mohammad I. Khan, Alhafez M. Alraih, Mohammed K. Almesfer, Abubakr Elkhaleefa, Saif M. Dmour & Mohammad Rehan. (2021) Adsorption and Corrosion Inhibition Behaviour of Oil Extracted from Moringa peregrina leaves for Carbon Steel in Acidic Media: Experimental and Computational Studies. International Journal of Electrochemical Science 16:8, pages 210842.
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M. Damej, S. Kaya, B. EL Ibrahimi, H-S. Lee, A. Molhi, G. Serdaroğlu, M. Benmessaoud, I.H. Ali, S. EL Hajjaji & H. Lgaz. (2021) The corrosion inhibition and adsorption behavior of mercaptobenzimidazole and bis-mercaptobenzimidazole on carbon steel in 1.0 M HCl: Experimental and computational insights. Surfaces and Interfaces 24, pages 101095.
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Mohammad Ebrahim Haji Naghi Tehrani, Pantea Ghahremani, Mohammad Ramezanzadeh, Ghasem Bahlakeh & Bahram Ramezanzadeh. (2021) Theoretical and experimental assessment of a green corrosion inhibitor extracted from Malva sylvestris. Journal of Environmental Chemical Engineering 9:3, pages 105256.
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D. K. Lavanya, V. Priya Frank, D. P. Vijaya & Supriya Bangera. (2021) Inhibition Effect of Thiourea Derivative for Mild Steel Corrosion in Acid Medium: Experimental and Theoretical Studies. Journal of Bio- and Tribo-Corrosion 7:2.
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Maryam Chafiq, Abdelkarim Chaouiki, Mustafa R. Al-Hadeethi, Rachid Salghi, Ali Ismat H.Mohamed Shaaban K.Ill-Min Chung. (2021) A joint experimental and theoretical investigation of the corrosion inhibition behavior and mechanism of hydrazone derivatives for mild steel in HCl solution. Colloids and Surfaces A: Physicochemical and Engineering Aspects 610, pages 125744.
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Abdo M. Al‐Fakih, Helmi M. Al‐Maqtari, Madzlan Aziz, Joazaizulfazli Jamalis & Khadijah M. Emran. (2020) Effect of substituents on the inhibitive properties of newly synthesized 5‐benzoyl‐4‐methyl‐1,3,4,5‐tetrahydro‐2 H ‐1,5‐benzodiazepin‐2‐one derivatives against mild steel corrosion in an acidic medium . Materials and Corrosion 71:12, pages 2070-2082.
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Mumtaz A. Quraishi, Dheeraj S. Chauhan & Viswanathan S. Saji. 2020. Heterocyclic Organic Corrosion Inhibitors. Heterocyclic Organic Corrosion Inhibitors 87 131 .

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