Evaluation on adsorption capacity of low organic matter soil for hydrophobic organic pollutant

Y Li, M Wei - Journal of Environmental Chemical Engineering, 2022 - Elsevier
The adsorption capacity of contaminated sites for hydrophobic organic pollutants (HOPs) will
be a vital occurrence parameter. In deep contaminated areas, the content of organic matter …

Clustering of caffeine in water and its adsorption in activated carbon: Molecular simulations and experiments

H Ramézani, I Ellien, Z El Oufir, N Mathieu… - Colloids and Surfaces A …, 2023 - Elsevier
Motivated by the importance of caffeine removal from wastewater, the clustering and
adsorption of caffeine in activated carbon are studied using Molecular Dynamics and Grand …

Structure of diclofenac in an aqueous medium and its adsorption onto carbons: Molecular insights through simulation

A Richard, FA Camara, H Ramézani, N Mathieu… - Colloids and Surfaces A …, 2024 - Elsevier
Diclofenac adsorption in aqueous media was investigated via molecular dynamics (MD),
using protonated and deprotonated forms of diclofenac, optimized using density functional …

[HTML][HTML] Porous biochar for improving the CO2 uptake capacities and kinetics of concrete

M Mesnage, R Omnée, J Colin, H Ramezani… - Cement and Concrete …, 2025 - Elsevier
Carbonation is a natural process in concrete where atmospheric CO 2 diffuses into the pores
of the material and reacts with cement hydrates to form calcium carbonate. Although this …

Understanding the role of pollutant confinement during the thermal regeneration of activated carbons

F Olivier, S Schaefer, K Maiga, M Roulet, I Laidin… - Carbon, 2025 - Elsevier
The thermal regeneration of activated carbons is the most commonly used approach to allow
their reuse. While the process aims to restore the original porosity of the carbon adsorbent …

Computational Analyses of Peganum harmala Alkaloids as Green Corrosion Inhibitors on Fe(110)

H Hamidi, F Shojaei, H Eslami, R Aliabadi, M Pourfath… - Langmuir, 2025 - ACS Publications
One of the successful techniques developed for the inhibition of metal corrosion is the
utilization of phytochemicals from plant extracts as corrosion inhibitors. Theoretical studies …

Unraveling Ofloxacin Behavior in Aqueous Environments: Molecular Dynamics of Colloidal Formation and Surface Adsorption Mechanisms

FA Camara, H Ramézani, N Mathieu… - Langmuir, 2025 - ACS Publications
Ofloxacin, a commonly prescribed antibiotic, raises serious environmental concerns due to
its persistence in aquatic systems. This study offers new insights into the environmental …

[PDF][PDF] Numerical analysis of CO 2 capture in an innovative composite material: cement-activated carbon

F Fayada, H Ramézania, N Mathieua, J Jeongc… - 2023 - researchgate.net
Numerical analysis of CO2 capture in an innovative composite material: cement-activated
carbon Page 1 Numerical analysis of CO 2 capture in an innovative composite material …

[PDF][PDF] Molecular simulation of diclofenac molecule in aqueous medium: Role of pH and diclofenac concentration

A RICHARD, H RAMEZANI, N MATHIEU, S DELPEUX - researchgate.net
Human activities lead to a large panel of different chemicals in wastewater [4]. Some of
these chemicals have negative consequences on the environment. One of them is known as …