Theoretical prediction of corrosion inhibition by ionic liquid derivatives: a DFT and molecular dynamics approach DOI Creative Commons

Aymane Omari Alaoui,

Walid Elfalleh, B. Hammouti

et al.

RSC Advances, Journal Year: 2025, Volume and Issue: 15(16), P. 12645 - 12652

Published: Jan. 1, 2025

Ionic liquids have attracted significant attention, particularly as corrosion inhibitors owing to their outstanding properties, including low vapor pressure, high thermal and chemical stability, can be tailored for specific applications.

Language: Английский

Study on the Corrosion Inhibition of E24 Steel in Acidic Medium by 1,4-benzoxazine Derivatives: An Approach Combining Chemistry, Electrochemistry, and Theoretical Modeling DOI

Saliha Loughmari,

Hassan Haddouchy,

Abdelkarim Ait Mansour

et al.

Journal of Molecular Structure, Journal Year: 2025, Volume and Issue: unknown, P. 141545 - 141545

Published: Jan. 1, 2025

Language: Английский

Citations

1
Synthesis, characterization, theoretical, and evaluation of eco-friendly phenytoin-based corrosion inhibitors for mild steel DOI
Walid Ettahiri, Abderrazzak El Moutaouakil Ala Allah,

Jamila Lazrak

et al.

Colloids and Surfaces A Physicochemical and Engineering Aspects, Journal Year: 2024, Volume and Issue: unknown, P. 135816 - 135816

Published: Nov. 1, 2024

Language: Английский

Citations

6
Novel Thiohydantoin Derivatives: Design, Synthesis, Spectroscopic Characterization, Crystal Structure, SAR, DFT, Molecular Docking, Pharmacological and Toxicological activities DOI
Abderrazzak El Moutaouakil Ala Allah,

Salma Mortada,

Burak Tüzün

et al.

Journal of Molecular Structure, Journal Year: 2025, Volume and Issue: 1335, P. 141995 - 141995

Published: March 8, 2025

Language: Английский

Citations

0
A comparative density functional theory (DFT) and molecular dynamics study on Natamycin and Cefmetazole as effective corrosion inhibitor for mild steel: Electronic properties and adsorption behavior DOI
F. E. Abeng, Abhinay Thakur, Valentine Chikaodili Anadebe

et al.

Computational and Theoretical Chemistry, Journal Year: 2025, Volume and Issue: unknown, P. 115200 - 115200

Published: March 1, 2025

Language: Английский

Citations

0
Synthesis, Surface Characterization, Theoretical and Experimental Insights of New Eugenol Derivatives as Corrosion Inhibitors for E24 Steel in 1 M HCl Solution DOI

Hassan Haddouchy,

Saliha Loughmari,

Abdelkarim Ait Mansour

et al.

Colloids and Surfaces A Physicochemical and Engineering Aspects, Journal Year: 2025, Volume and Issue: unknown, P. 136865 - 136865

Published: April 1, 2025

Language: Английский

Citations

0
Theoretical prediction of corrosion inhibition by ionic liquid derivatives: a DFT and molecular dynamics approach DOI Creative Commons

Aymane Omari Alaoui,

Walid Elfalleh, B. Hammouti

et al.

RSC Advances, Journal Year: 2025, Volume and Issue: 15(16), P. 12645 - 12652

Published: Jan. 1, 2025

Ionic liquids have attracted significant attention, particularly as corrosion inhibitors owing to their outstanding properties, including low vapor pressure, high thermal and chemical stability, can be tailored for specific applications.

Language: Английский

Citations

0