An experimental and dual computational study using DFT and MD simulations to better understand the adsorption and corrosion-inhibiting properties of N-(3-(4-Methoxyphenyl) isoxazol-5-yl) methyl saccharin for C38 Steel in acidic medium
Fatima Ennafaa, Anas Chraka, K. Tassaoui, I. Mouamr, M. Damej, Ayoub El Mahmoudi, Khalid Bougrin, H. T. Rahal, Mohammed Benmessaoud
Topics & Concepts
AdsorptionSaccharinDensity functional theoryDual (grammatical number)Computational chemistryMaterials sciencePhysical chemistryChemistryEndocrinologyArtLiteratureMedicineCorrosion Behavior and InhibitionNonlinear Optical Materials ResearchMulticomponent Synthesis of Heterocycles