H. Bourzi

发表

Experimental and theoretical investigations of benzoic acid derivatives as corrosion inhibitors for AISI 316 stainless steel in hydrochloric acid medium: DFT and Monte Carlo simulations on the Fe (110) surface

R. Oukhrib, M. Hamdani, R. A. Akbour, 2020, RSC advances.

In silico investigations of alginate biopolymer on the Fe (110), Cu (111), Al (111) and Sn (001) surfaces in acidic media: Quantum chemical and molecular mechanic calculations

B. El Ibrahimi, R. Oukhrib, S. El Issami, 2020 .

DFT, Monte Carlo and molecular dynamics simulations for the prediction of corrosion inhibition efficiency of novel pyrazolylnucleosides on Cu(111) surface in acidic media

C. Len, R. Oukhrib, S. El Issami, 2021, Scientific Reports.

Computational study of some triazole derivatives (un- and protonated forms) and their copper complexes in corrosion inhibition process

R. Oukhrib, L. Bazzi, A. Jmiai, 2016 .

Understanding imidazole derivatives effect as a corrosion inhibitor for brass in nitric acid: A combined experimental and theoretical assessments

S. El Issami, A. Jmiai, M. Rguiti, 2022, Corrosion Engineering, Science and Technology.

Electrochemical, thermodynamic and molecular dynamics studies of some benzoic acid derivatives on the corrosion inhibition of 316 stainless steel in HCl solutions

R. Oukhrib, M. Hamdani, R. A. Akbour, 2021 .

Carissa macrocarpa extract (ECM) as a new efficient and ecologically friendly corrosion inhibitor for copper in nitric acid: Experimental and theoretical approach

R. Oukhrib, A. Jmiai, S. E. Issami, 2023, Journal of the Taiwan Institute of Chemical Engineers.

Computational and experimental studies of the inhibitory effect of imidazole derivatives for the corrosion of copper in an acid medium

H. Zejli, R. Oukhrib, S. El Issami, 2021, Journal of Molecular Liquids.

Quantum chemical calculations and corrosion inhibition efficiency of biopolymer “chitosan” on copper surface in 3%NaCl

A. Jmiai, R. Oukhrib, L. Bazzi, 2016 .

Furfural Analogs as Sustainable Corrosion Inhibitors—Predictive Efficiency Using DFT and Monte Carlo Simulations on the Cu(111), Fe(110), Al(111) and Sn(111) Surfaces in Acid Media

C. Len, B. El Ibrahimi, R. Oukhrib, 2020, Sustainability.

Understanding of anti-corrosive behavior of some tetrazole derivatives in acidic medium: Adsorption on Cu (111) surface using quantum chemical calculations and Monte Carlo simulations

R. Oukhrib, M. Hilali, B. Ibrahimi, 2020 .

Density functional theory study of the selective oxidation of 5-Hydroxymethylfurfural (HMF) to 5-Hydroxymethyl-2-furancarboxylic acid (HMFCA) on the Silver oxide surface (001)

C. Len, R. Oukhrib, Christian A. Celaya, 2022, Molecular Catalysis.

Unveiling the mechanism, selectivity, solvent and temperature effects on the [3 + 2] cycloaddition reaction of N-methyl-C-(2-furyl) nitrone with maleimide derivatives from the molecular electron density theory perspective

H. Zejli, S. El Issami, M. Hochlaf, 2023, Theoretical Chemistry Accounts.