2024-01 | Green-synthetized β-amino-α-carbethoxy ethyl acrylates as corrosion inhibitors for mild steel in acid media: Experimental performance evaluation and atomic/molecular-level modeling | 하산 르가즈 |
2021-11 | Hemilability in neutral RuCl2(eta(1-PO)-O-boolean AND)(2)((NN)-N-boolean AND) complexes: Physicochemical, trans/cis-isomerization, thermal and A DFT/TD-DFT | 하산 르가즈 |
2021-10 | Hydrazone-based green corrosion inhibitors for API grade carbon steel in HCl: Insights from electrochemical, XPS, and computational studies | 하산 르가즈 |
2021-01 | Insights into methyl orange adsorption behavior on a cadmium zeolitic-imidazolate framework Cd-ZIF-8: A joint experimental and theoretical study | 하산 르가즈 |
2023-04-18 | Insights into the Corrosion Inhibition Performance of Isonicotinohydrazide Derivatives for N80 Steel in 15% HCl Medium: An Experimental and Molecular Level Characterization | 하산 르가즈 |
2023-03-16 | Insights into the Corrosion Inhibition Performance of Three 2-Isoxazoline-γ-Lactones for Carbon Steel in Acidic Medium: Linking Molecular and Experimental-Level Information with Microscopic-Scale Modeling | 하산 르가즈 |
2023-12 | Interactions and Mechanisms of Sulfonium Salts with Metal Interfaces: An In-Depth Computational Exploration of COSMO-RS Profiles, Quantum Chemistry and Molecular Dynamics on Iron, Copper, and Aluminum | 하산 르가즈 |
2023-11 | Interfacial phenomena and surface protection of N80-carbon steel in acidic environments using thiazolidinediones: An experimental and computational analysis | 하산 르가즈 |
2023-08 | Investigating the Biological Activities of Moroccan Cannabis Sativa L Seed Extracts: Antimicrobial, Anti-inflammatory, and Antioxidant Effects with Molecular Docking Analysis | 하산 르가즈 |
2023-12 | Investigating the effects of polypropylene-TiO2 loading on the performance of polysulfone/polyetherimide ultrafiltration membranes for azo dye removal: Experimental and molecular dynamics simulation | 하산 르가즈 |
2024-01 | Mechanistic insights and therapeutic implications of novel pyrazoline derivatives on antioxidant and enzymatic inhibitory activities | 하산 르가즈 |
2023-11 | Molecular insights into the corrosion inhibition mechanism of omeprazole and tinidazole: a theoretical investigation | 하산 르가즈 |
2021-09 | Molecular modelling of compounds used for corrosion inhibition studies: a review | 하산 르가즈 |
2023-12 | Multi-technique investigation on the surface interaction of diatomaceous earth with organic phase change material: Experimental and molecular dynamics aspects | 하산 르가즈 |
2023-03-21 | Multifunctional Cross-Linked Shrimp Waste-Derived Chitosan/MgAl-LDH Composite for Removal of As(V) from Wastewater and Antibacterial Activity | 하산 르가즈 |
2022-11 | Multilayer perceptron neural network-based QSAR models for the assessment and prediction of corrosion inhibition performances of ionic liquids | 하산 르가즈 |
2022-07 | New low-cost tubular ceramic microfiltration membrane based on natural sand for tangential urban wastewater treatment | 하산 르가즈 |
2023-07 | On the Development of an Intelligent Poly(aniline-co-o-toluidine)/Fe3O4/Alkyd Coating for Corrosion Protection in Carbon Steel | 하산 르가즈 |
2022-08 | Peanut shell from agricultural wastes as a sustainable filler for polyamide biocomposites fabrication | 하산 르가즈 |
2023-02 | Performance and interaction mechanism of a new highly efficient benzimidazole-based epoxy resin for corrosion inhibition of carbon steel in HCl: A study based on experimental and first-principles DFTB simulations | 하산 르가즈 |
2023-02-27 | Performance evaluation and assessment of the corrosion inhibition mechanism of carbon steel in HCl medium by a new hydrazone compound: Insights from experimental, DFT and first-principles DFT simulations | 하산 르가즈 |
2021-02 | Phenol adsorption mechanism on the zinc oxide surface: Experimental, cluster DFT calculations, and molecular dynamics simulations | 하산 르가즈 |
2021-09 | Polysulfone/Polyetherimide Ultrafiltration composite membranes constructed on a three-component Nylon-fiberglass-Nylon support for azo dyes removal: Experimental and molecular dynamics simulations | 하산 르가즈 |
2022-09 | Predicting protection capacities of pyrimidine-based corrosion inhibitors for mild steel/HCl interface using linear and nonlinear QSPR models | 하산 르가즈 |
2022-10 | Shellfish waste-derived mesoporous chitosan for impressive removal of arsenic(V) from aqueous solutions: A combined experimental and computational approach | 하산 르가즈 |
2021-09 | Spectroscopic Insight into Tetrahedrally Distorted Square Planar Copper(II) Complex: XRD/HSA, Physicochemical, DFT, and Thermal Investigations | 하산 르가즈 |
2022-12 | Superior Long-Term Corrosion Inhibition of N80 Steel by New Eco- friendly Hydrazone-Based Compounds in a Simulated Oil Well Acidizing Environment: Establishing the Mechanism at the Molecular Level | 하산 르가즈 |
2022-04 | Synthesis of novel hybrid quinoxaline containing triazole and acetamide moieties by azide-alkyne click chemistry: Experimental and theoretical characterization | 하산 르가즈 |
2022-11 | Synthesis, experimental and theoretical characterization of a new copolymer bearing pyrrole and anthracene units | 하산 르가즈 |
2021-05 | Synthesis, structural analysis and corrosion inhibition application of a new indazole derivative on mild steel surface in acidic media complemented with DFT and MD studies | 하산 르가즈 |