Atomistic simulation: a unique and powerful computational tool for corrosion inhibition research

IB Obot, K Haruna, TA Saleh - Arabian Journal for Science and …, 2019 - Springer
It is difficult to understand the atomistic information on the interaction at the metal/corrosion
inhibitor interface experimentally which is a key to understanding the mechanism by which …

Glycyrrhiza glabra leaves extract as a green corrosion inhibitor for mild steel in 1 M hydrochloric acid solution: Experimental, molecular dynamics, Monte Carlo and …

E Alibakhshi, M Ramezanzadeh, G Bahlakeh… - Journal of Molecular …, 2018 - Elsevier
The objective of this study is to investigate the inhibition of Glycyrrhiza glabra extract,
commonly known as licorice, as a green source of corrosion inhibitor against mild steel …

Utilizing Lemon Balm extract as an effective green corrosion inhibitor for mild steel in 1M HCl solution: A detailed experimental, molecular dynamics, Monte Carlo and …

N Asadi, M Ramezanzadeh, G Bahlakeh… - Journal of the Taiwan …, 2019 - Elsevier
This study concerns with mild steel corrosion inhibition in 1M HCl solution protected with
different concentrations of Lemon Balm extract. Electrochemical and theoretical approaches …

Potential of Borage flower aqueous extract as an environmentally sustainable corrosion inhibitor for acid corrosion of mild steel: electrochemical and theoretical …

A Dehghani, G Bahlakeh, B Ramezanzadeh… - Journal of Molecular …, 2019 - Elsevier
The presence of numerous active compounds like lactic acid, nicotinic acid, and carotene in
the Borage flower extract (BFE) converted it to a potent source of powerful sustainable …

Use of Rosa canina fruit extract as a green corrosion inhibitor for mild steel in 1 M HCl solution: A complementary experimental, molecular dynamics and quantum …

Z Sanaei, M Ramezanzadeh, G Bahlakeh… - Journal of industrial and …, 2019 - Elsevier
Rosa canina fruit extract was utilized for mild steel corrosion inhibition in 1 M HCl solution.
The inhibition efficiency of inhibitor was studied by electrochemical impedance spectroscopy …

Corrosion inhibition of mild steel in 1 M HCl solution by ethanolic extract of eco-friendly Mangifera indica (mango) leaves: electrochemical, molecular dynamics, Monte …

M Ramezanzadeh, G Bahlakeh, Z Sanaei… - Applied Surface …, 2019 - Elsevier
The mild steel corrosion inhibition in 1 M HCl solution containing Mangifera indica
(mango)(M. indica) leaves extract was examined by electrochemical and surface studies …

Some quinoxalin-6-yl derivatives as corrosion inhibitors for mild steel in hydrochloric acid: experimental and theoretical studies

LO Olasunkanmi, IB Obot, MM Kabanda… - The Journal of …, 2015 - ACS Publications
The inhibition of mild steel corrosion in 1 M HCl by some quinoxalin-6-yl derivatives namely
1-[3-phenyl-5-quinoxalin-6-yl-4, 5-dihydropyrazol-1-yl] butan-1-one (PQDPB), 1-(3-phenyl-5 …

A detailed electrochemical/theoretical exploration of the aqueous Chinese gooseberry fruit shell extract as a green and cheap corrosion inhibitor for mild steel in acidic …

A Dehghani, G Bahlakeh, B Ramezanzadeh - Journal of Molecular Liquids, 2019 - Elsevier
The aqueous extract of Chinese gooseberry fruit shell is a green source of various
biologically active compounds like sucrose, maltose and folate, which are highly soluble in …

Density functional theory and molecular dynamics simulation study on corrosion inhibition performance of mild steel by mercapto-quinoline Schiff base corrosion …

SK Saha, P Ghosh, A Hens, NC Murmu… - Physica E: Low …, 2015 - Elsevier
Corrosion inhibition mechanism of two mercapto-quinoline Schiff bases, eg., 3-
((phenylimino) methyl) quinoline-2-thiol (PMQ) and 3-((5-methylthiazol-2-ylimino) methyl) …

Adsorption and corrosion inhibition effect of Schiff base molecules on the mild steel surface in 1 M HCl medium: a combined experimental and theoretical approach

SK Saha, A Dutta, P Ghosh, D Sukul… - Physical Chemistry …, 2015 - pubs.rsc.org
Corrosion inhibition performance of 2-(2-hydroxybenzylideneamino) phenol (L1), 2-(5-
chloro-2-hydroxybenzylideneamino) phenol (L2) and 2-(2-hydroxy-5-nitrobenzylideneamino …