Molecular-dynamic/DFT-electronic theoretical studies coupled with electrochemical investigations of the carrot pomace extract molecules inhibiting potency toward mild steel corrosion in 1 M HCl solution
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Title
Molecular-dynamic/DFT-electronic theoretical studies coupled with electrochemical investigations of the carrot pomace extract molecules inhibiting potency toward mild steel corrosion in 1 M HCl solution
Authors
Keywords
Carrot pomace extract, Electrochemical investigations, Thermodynamic evaluation, Mild steel, Corrosion, Molecular dynamic, DFT-modeling
Journal
JOURNAL OF MOLECULAR LIQUIDS
Volume 346, Issue -, Pages 118344
Publisher
Elsevier BV
Online
2021-12-18
DOI
10.1016/j.molliq.2021.118344
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