Combined DFT and MD simulation approach for the study of SO2 and CO2 adsorption on graphite (111) surface in aqueous medium

by M. Khnifira, A. Mahsoune, M.E. Belghiti, L. Khamar, M. Sadiq, M. Abdennouri, N. Barka
Published 2021-01-01

Understanding the adsorption of newly Benzylidene-aniline derivatives as a corrosion inhibitor for carbon steel in hydrochloric acid solution: Experimental, DFT and molecular dynam...

by M.E. Belghiti, S. Bouazama, S. Echihi, A. Mahsoune, A. Elmelouky, A. Dafali, K.M. Emran, B. Hammouti, M. Tabyaoui
Published 2020-01-01

Investigation and comparative study of the quantum molecular descriptors derived from the theoretical modeling and Monte Carlo simulation of two new macromolecular polyepoxide arch...

by R. Hsissou, F. Benhiba, M. Khudhair, M. Berradi, A. Mahsoune, H. Oudda, A. El Harfi, I.B. Obot, A. Zarrouk
Published 2020-01-01

Studies of Inhibition effect “E & Z’’ Configurations of hydrazine Derivatives on Mild Steel Surface in phosphoiric acid

by M.E. Belghiti, M. Mihit, A. Mahsoune, A. Elmelouky, R. Mghaiouini, A. Barhoumi, A. Dafali, M. Bakasse, M.A. El Mhammedi, M. Abdennouri
Published 2019-11-01