Bio-Based Corrosion Inhibition of Carbon Steel Using Ammi visnaga L. Essential Oil in Acidic Mediums: Experimental Analysis and Molecular Modeling DOI Open Access
Aouatife Zaher, Hassane Lgaz,

Asmaa Boukhraz

et al.

Coatings, Journal Year: 2024, Volume and Issue: 14(12), P. 1556 - 1556

Published: Dec. 12, 2024

Bio-based corrosion inhibitor formulations are incredibly promising for mitigating corrosion, offering an environmentally sustainable approach while providing effective protection against material degradation. This study explores the inhibition potential of Ammi visnaga essential oil (AVEO) on carbon steel (CS) in a 1 mol/L hydrochloric acid (HCl) medium, combining electrochemical impedance spectroscopy (EIS), potentiodynamic polarization (PDP), linear resistance (LPR), weight loss (WL) analysis, density functional theory (DFT), density-functional tight-binding (DFTB) modeling, and molecular dynamics (MD) simulation. The AVEO was extracted through hydrodistillation, its chemical profile characterized to identify key active compounds. EIS PDP results revealed that effectively inhibited formation protective layer surface, exhibiting efficiencies up 84% at 3 g/L, with mixed-type action. Nyquist plots displayed increased concentration, indicating enhanced surface coverage reduction sites. WL studies further supported these findings, showing decreased rates proportional temperature variation showed performance higher temperatures. Scanning electron microscope (SEM) analysis CS upon addition HCl medium. DFTB modeling MD simulations were employed evaluate interaction between major constituents insight into adsorption behavior electronic contributions molecule–metal interface. combined experimental theoretical findings indicate holds promise as natural, eco-friendly inhibitor, implications metal acidic environments.

Language: Английский

Rheological and Anticorrosion Study of Piper chaba Extract and Coating for Mild Steel in 2M H2SO4 DOI
Vibha Joshi, Vishwajeet Bachhar, Prayas Singh

et al.

Colloids and Surfaces A Physicochemical and Engineering Aspects, Journal Year: 2024, Volume and Issue: unknown, P. 135989 - 135989

Published: Dec. 1, 2024

Language: Английский

Citations

2
Design, synthesis, in-vitro, in-silico, DFT and POM studies of a novel family of sulfonamides as potent anti-triple-negative breast cancer agents DOI

Nassima Saghdani,

Abdelmoula El Abbouchi, Nabil El Brahmi

et al.

Computational Biology and Chemistry, Journal Year: 2024, Volume and Issue: 113, P. 108214 - 108214

Published: Sept. 19, 2024

Language: Английский

Citations

1
Aromatic Metal Corrosion Inhibitors DOI Creative Commons

Jessica Roscher,

Dan Liu, Xuan Xie

et al.

Corrosion and Materials Degradation, Journal Year: 2024, Volume and Issue: 5(4), P. 513 - 560

Published: Oct. 31, 2024

Molecular inhibitors added to the corrosive medium attacking metallic materials are a well-established way of combating corrosion. The inhibitive action proceeds via adsorption inhibitor on surface be protected. Aromatic building blocks in play major role its protective action, and further details like substituents, heteroatoms, molecular geometry contribute. An overview focused aromatic is provided, aiming at identification particularly promising their mode action. Directions for research development pointed out conclusion.

Language: Английский

Citations

1
Insights into the corrosion inhibition performance of essential oil of Teucrium luteum subsp. flavovirens for carbon steel in 1.0 M HCl medium: experimental and theoretical evaluations DOI

Omar Ou-Ani,

Abdeslam Ansari,

Lahcen Oucheikh

et al.

Journal of Dispersion Science and Technology, Journal Year: 2024, Volume and Issue: unknown, P. 1 - 17

Published: Nov. 7, 2024

The objective of this research work was to assess Teucrium luteum subsp. flavovirens essential oil (EOTL), for the first time, as novel and eco-friendly corrosion inhibitor carbon steel (CS) in 1.0 M HCl medium. Electrochemical impedance spectroscopy (EIS), potentiodynamic polarization (PDP) surface analysis were employed effectiveness EOTL. findings indicate that EOTL reduces CS hydrochloric acid offered an inhibition efficiency (IE) 91% at a dosage 2.00 g/L 298 K. PDP data showed behaved mixed-type inhibitor. effect immersion time temperature on performance also studied. It found IE increased only up 24 h decreased with prolonged time. In addition, diminished increasing temperature. molecules adsorbed following Langmuir adsorption isotherm, energy ranging from −16 −27 kJ/mol, indication physico-chemical mechanisms. SEM/EDX results provide evidence presence protective film CS. Theoretical studies using DFT, Monte Carlo simulations, molecular dynamics simulations mean square displacement conducted given insight into contributions four main components This not introduces sustainable alternative conventional inhibitors but provides robust understanding underlying mechanisms, hence contributing advancement science.

Language: Английский

Citations

1
Bio-Based Corrosion Inhibition of Carbon Steel Using Ammi visnaga L. Essential Oil in Acidic Mediums: Experimental Analysis and Molecular Modeling DOI Open Access
Aouatife Zaher, Hassane Lgaz,

Asmaa Boukhraz

et al.

Coatings, Journal Year: 2024, Volume and Issue: 14(12), P. 1556 - 1556

Published: Dec. 12, 2024

Bio-based corrosion inhibitor formulations are incredibly promising for mitigating corrosion, offering an environmentally sustainable approach while providing effective protection against material degradation. This study explores the inhibition potential of Ammi visnaga essential oil (AVEO) on carbon steel (CS) in a 1 mol/L hydrochloric acid (HCl) medium, combining electrochemical impedance spectroscopy (EIS), potentiodynamic polarization (PDP), linear resistance (LPR), weight loss (WL) analysis, density functional theory (DFT), density-functional tight-binding (DFTB) modeling, and molecular dynamics (MD) simulation. The AVEO was extracted through hydrodistillation, its chemical profile characterized to identify key active compounds. EIS PDP results revealed that effectively inhibited formation protective layer surface, exhibiting efficiencies up 84% at 3 g/L, with mixed-type action. Nyquist plots displayed increased concentration, indicating enhanced surface coverage reduction sites. WL studies further supported these findings, showing decreased rates proportional temperature variation showed performance higher temperatures. Scanning electron microscope (SEM) analysis CS upon addition HCl medium. DFTB modeling MD simulations were employed evaluate interaction between major constituents insight into adsorption behavior electronic contributions molecule–metal interface. combined experimental theoretical findings indicate holds promise as natural, eco-friendly inhibitor, implications metal acidic environments.

Language: Английский

Citations

1