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Multiscale computational modeling of phytochemicals for iron corrosion inhibition: bridging DFT, SCC-DFTB, and molecular dynamics for eco-friendly solutions
Investigating environmentally benign corrosion inhibitors is crucial for addressing the
widespread issue of material deterioration. This research conducts a detailed computational …
widespread issue of material deterioration. This research conducts a detailed computational …
Design, synthesis, and evaluation of a pyrazole-based corrosion inhibitor: a computational and experimental study
By employing a synergistic blend of experimental and theoretical methodologies, we
investigated the corrosion inhibition efficacy of a synthesized pyrazole derivative (BM-01) in …
investigated the corrosion inhibition efficacy of a synthesized pyrazole derivative (BM-01) in …
Exploring the synthesis and application of a pyrazole derivative in corrosion protection: Theoretical modeling and experimental investigations
This research investigates the inhibitory performance of BM-02, a synthesized pyrazole
derivative (R)-5-(4-methoxyphenyl)-1, 3-diphenyl-4, 5-dihydro-1H-pyrazole, against the …
derivative (R)-5-(4-methoxyphenyl)-1, 3-diphenyl-4, 5-dihydro-1H-pyrazole, against the …
Corrosion Inhibition Effect of Quinoxaline Derivative on Carbon Steel in Hydrochloric Acid: Experimental and Theoretical Investigations
The inhibitory effect of ethyl 2-(2-oxo-3-phenylquinoxalin-1 (2H)-yl) acetate (PQXA) on the
corrosion of carbon steel (CS35) in a 1 M HCl electrolyte was investigated using weight loss …
corrosion of carbon steel (CS35) in a 1 M HCl electrolyte was investigated using weight loss …
Corrosion resistance of two newly synthesized 8-quinolinol-benzimidazoles on carbon steel: an experimental and theoretical investigation
The newly designed 8-quinolinol-benzimidazoles, 5-(5-nitrobenzimidazol-2-yl) 8-quinolinol
(NBLQ) and 5-(5-methylbenzimidazol-2-yl) 8-quinolinol (MBLQ), were explored for the …
(NBLQ) and 5-(5-methylbenzimidazol-2-yl) 8-quinolinol (MBLQ), were explored for the …
To investigate the anticorrosive properties of Ageratina adenophora extract as a green inhibitor for SS-410 in hydrochloric acid solution: Experimental and …
Metal oxidation is a significant concern for our metal structures, leading to substantial
financial losses annually. It is important to address this issue effectively. In this research …
financial losses annually. It is important to address this issue effectively. In this research …
Theoretical and experimental research of the ability of quinolin-8-ol compound derivative to inhibit C-steel corrosion in a molar hydrochloric acid environment
In this work, the effectiveness of 5-((2-(4-nitrophenyl)-4, 5-diphenyl-1H-imidazol-1-yl) methyl)
quinoline-8-ol (NDIQ) as a corrosion inhibitor for carbon-steel (C/steel) of 1.0 M hydrochloric …
quinoline-8-ol (NDIQ) as a corrosion inhibitor for carbon-steel (C/steel) of 1.0 M hydrochloric …
[HTML][HTML] Chemical composition, biological activities, and anti-corrosion performance of Moroccan essential oil Thymus vulgaris from the Oued Amlil region, Taza
N Chahboun, A Barrahi, L Koursaoui, S Mortada… - International Journal of …, 2024 - Elsevier
The study investigated the antibacterial, antioxidant, antidiabetic, ADMET (absorption-
distribution-metabolism-excretion-toxicity) properties, and anticorrosion of essential oil …
distribution-metabolism-excretion-toxicity) properties, and anticorrosion of essential oil …
The inhibitory effect of certain imidazole derivatives grafted on 8-hydroxyqinoline on carbon steel corrosion in acidic medium: experimental and computational …
A Elbarki, Z Amrani, T Laabaissi… - INTERNATIONAL …, 2023 - avesis.atauni.edu.tr
In this work, we scrutinized two imidazole derivatives grafted on 8-hydroxyqinoline, namely 5
((2-(4-hydroxyphenyl)-4, 5-diphenyl-1H-imidazol-1-yl) methyl) quinolin-8-ol (HDIQ) and 5 ((2 …
((2-(4-hydroxyphenyl)-4, 5-diphenyl-1H-imidazol-1-yl) methyl) quinolin-8-ol (HDIQ) and 5 ((2 …