Exploitation of a new green inhibitor against mild steel corrosion in HCl: Experimental, DFT and MD simulation approach

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作者
Berrissoul, A. [1 ]
Ouarhach, A. [2 ]
Benhiba, F. [3 ,4 ]
Romane, A. [2 ]
Guenbour, A. [4 ]
Outada, H. [5 ]
Dafali, A. [1 ]
Zarrouk, A. [4 ]
机构
[1] Mohamed the First University, Faculty of Sciences Oujda, Chemistry Department, Oujda, Morocco
[2] Cadi Ayad University, Faculty of Sciences Semlalia, Chemistry Department, Marrakesh, Morocco
[3] Laboratory of Advanced Materials and Process Engineering, Faculty of Sciences, Ibn Tofail University, BP 242, Kenitra,14000, Morocco
[4] Laboratory of Materials, Nanotechnology and Environment, Faculty of Sciences, Mohammed V University in Rabat, P.O. Box. 1014, Rabat, Morocco
[5] University Mohammed Premier, Operational Research and Applied Statistics Team (ROSA), Oujda,60046, Morocco
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摘要
Density functional theory
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