Machine learning approach to map the thermal conductivity of over 2,000 neoteric solvents for green energy storage applications

T Lemaoui, AS Darwish, G Almustafa, A Boublia… - Energy Storage …, 2023 - Elsevier
Interest in green neoteric solvents, such as ionic liquids (ILs) and deep eutectic solvents
(DESs), has increased dramatically in recent years due to their highly tunable properties …

Experimental and detailed DFT/MD simulation of α-aminophosphonates as promising corrosion inhibitor for XC48 carbon steel in HCl environment

O Moumeni, M Mehri, R Kerkour, A Boublia… - Journal of the Taiwan …, 2023 - Elsevier
Background Corrosion is a pervasive issue in several industries, causing safety hazards and
substantial economic losses. α-aminophosphonate substances have recently garnered …

A comparative study of novel synthesized sulfamide compounds: Electrochemical, morphological, XPS, and theoretical investigations on copper corrosion inhibition in …

H Ferkous, A Sedik, A Delimi, R Redjemia… - Journal of Molecular …, 2024 - Elsevier
This study investigates the corrosion inhibition performance of N-phenyl sulfamide (NPS)
and N-phenyl piperazine sulfamide (NPPS) for copper in a solution of 1.0 M hydrochloric …

Comprehensive Investigation of Cu2+ Adsorption from Wastewater Using Olive-Waste-Derived Adsorbents: Experimental and Molecular Insights

N Elboughdiri, H Ferkous, K Rouibah… - International Journal of …, 2024 - mdpi.com
This study investigates the efficacy of adsorbents from locally sourced olive waste—
encompassing olive skins, leaves, and pits, recovered from the initial centrifugation of olives …

An innovative and environmentally friendly approach for resveratrol solubilization and bioaccessibility enhancement by using natural deep eutectic solvents

D Uka, B Blagojević, O Alioui, A Boublia… - Journal of Molecular …, 2023 - Elsevier
The goal of this investigation is the experimental and COSMO-RS theoretical determination
of resveratrol (RSV) solubility in five choline chloride-based and five menthol-based natural …

Synthesis, characterization, and comprehensive computational analysis of aromatic hydrazone compounds: Unveiling quantum parameters, evaluating antioxidant …

YI Touahria, N Chafai, O Moumeni, A Boublia… - Journal of Molecular …, 2024 - Elsevier
This study presents a synergistic approach encompassing experimental synthesis,
computational analysis, and antioxidant activity evaluation of two aromatic hydrazone …

Synergistic shielding of copper from nitric acid corrosion: Unveiling the mechanisms through electrochemical, characterization, and computational insights with 2 …

N Ramdane, Z Marsa, A Delimi, A Sedik… - Inorganic Chemistry …, 2024 - Elsevier
Schiff-base metallic complexes have garnered considerable attention due to their unique
attributes and broad applications across various sectors. Among these, organic Schiff-type …

[HTML][HTML] Rapid and highly efficient removal of aqueous perfluorooctanoic acid using deep eutectic solvents for sustainable water remediation: An integrated …

S Eid, T Lemaoui, AS Darwish, M Abi Jaoude… - Chemical Engineering …, 2024 - Elsevier
This work reports on the first use of deep eutectic solvents (DESs) as an environmentally
sustainable solution for the extractive removal of perfluorooctanoic acid (PFOA), one of the …

Comprehensive study on deep eutectic solvent density based on various EoSs: SRK, PT, VTSRK, sPC-SAFT

H Bagheri, S Ghader, S AbdulAmeer… - Journal of Molecular …, 2024 - Elsevier
In this communication, the capability of a two-parameter cubic equation of state (EoS) ie
Soave-Redlich-Kwong (SRK) EoS to predict the density behavior of deep eutectic solvents …

Mimosa/quince seed mucilage–co-poly (methacrylate) hydrogels for controlled delivery of capecitabine: Simulation studies, characterization and toxicological …

T Yasmin, A Mahmood, RM Sarfraz, U Rehman… - International Journal of …, 2024 - Elsevier
This research focused on developing pH-regulated intelligent networks using quince and
mimosa seed mucilage through aqueous polymerization to sustain Capecitabine release …