Epoxy pre-polymers as new and effective materials for corrosion inhibition of carbon steel in acidic medium: Computational and experimental studies O Dagdag, Z Safi, R Hsissou, H Erramli, M El Bouchti, N Wazzan, L Guo, ... Scientific reports 9 (1), 11715, 2019 | 120 | 2019 |
Synthesis and anticorrosive properties of epoxy polymer for CS in [1 M] HCl solution: Electrochemical, AFM, DFT and MD simulations R Hsissou, S Abbout, Z Safi, F Benhiba, N Wazzan, L Guo, K Nouneh, ... Construction and Building Materials 270, 121454, 2021 | 117 | 2021 |
DFT calculations of thiosemicarbazide, arylisothiocynates, and 1-aryl-2, 5-dithiohydrazodicarbonamides as corrosion inhibitors of copper in an aqueous chloride solution NA Wazzan Journal of Industrial and Engineering Chemistry 26, 291-308, 2015 | 112 | 2015 |
Theoretical modeling and molecular level insights into the corrosion inhibition activity of 2-amino-1, 3, 4-thiadiazole and its 5-alkyl derivatives NA Wazzan, IB Obot, S Kaya Journal of Molecular Liquids 221, 579-602, 2016 | 100 | 2016 |
Epoxy resins and their zinc composites as novel anti-corrosive materials for copper in 3% sodium chloride solution: Experimental and computational studies O Dagdag, R Hsissou, A El Harfi, Z Safi, A Berisha, C Verma, EE Ebenso, ... Journal of Molecular Liquids 315, 113757, 2020 | 92 | 2020 |
Rheological, electrochemical, surface, DFT and molecular dynamics simulation studies on the anticorrosive properties of new epoxy monomer compound for steel in 1 M HCl solution O Dagdag, A El Harfi, O Cherkaoui, Z Safi, N Wazzan, L Guo, ED Akpan, ... RSC advances 9 (8), 4454-4462, 2019 | 87 | 2019 |
Highly durable macromolecular epoxy resin as anticorrosive coating material for carbon steel in 3% NaCl: Computational supported experimental studies O Dagdag, A Berisha, Z Safi, S Dagdag, M Berrani, S Jodeh, C Verma, ... Journal of Applied Polymer Science 137 (34), 49003, 2020 | 84 | 2020 |
Highly functionalized epoxy macromolecule as an anti-corrosive material for carbon steel: Computational (DFT, MDS), surface (SEM-EDS) and electrochemical (OCP, PDP, EIS) studies O Dagdag, Z Safi, N Wazzan, H Erramli, L Guo, AM Mkadmh, C Verma, ... Journal of Molecular Liquids 302, 112535, 2020 | 76 | 2020 |
DFT calculations for corrosion inhibition of ferrous alloys by pyrazolopyrimidine derivatives NA Wazzan, FM Mahgoub Open Journal of Physical Chemistry 2014, 2014 | 70 | 2014 |
Cis-trans isomerisation of azobenzenes studied by laser-coupled NMR spectroscopy and DFT calculations NA Wazzan, PR Richardson, AC Jones Photochemical & Photobiological Sciences 9 (7), 968-974, 2010 | 66 | 2010 |
Performance of two new epoxy resins as potential corrosion inhibitors for carbon steel in 1MHCl medium: Combining experimental and computational approaches N El-Aouni, R Hsissou, Z Safi, S Abbout, F Benhiba, J El Azzaoui, ... Colloids and Surfaces A: Physicochemical and Engineering Aspects 626, 127066, 2021 | 63 | 2021 |
Anticorrosive properties of Hexa (3-methoxy propan-1, 2-diol) cyclotri-phosphazene compound for carbon steel in 3% NaCl medium: gravimetric, electrochemical, DFT and Monte … O Dagdag, A El Harfi, M El Gouri, Z Safi, RTT Jalgham, N Wazzan, ... Heliyon 5 (3), 2019 | 63 | 2019 |
Can short-and middle-range hybrids describe the hyperpolarizabilities of long-range charge-transfer compounds? AJ Garza, NA Wazzan, AM Asiri, GE Scuseria The Journal of Physical Chemistry A 118 (50), 11787-11796, 2014 | 62 | 2014 |
Theoretical and experimental investigation of two alkyl carboxylates as corrosion inhibitors for steel in acidic medium IB Obot, IB Onyeachu, N Wazzan, AH Al-Amri Journal of Molecular Liquids 279, 190-207, 2019 | 60 | 2019 |
Theoretical study of triphenylamine-based organic dyes with mono-, di-, and tri-anchoring groups for dye-sensitized solar cells N Wazzan, A Irfan Organic Electronics 63, 328-342, 2018 | 59 | 2018 |
Cinnamoum tamala leaves extract highly efficient corrosion bio-inhibitor for low carbon steel: Applying computational and experimental studies D Prasad, O Dagdag, Z Safi, N Wazzan, L Guo Journal of Molecular Liquids 347, 118218, 2022 | 58 | 2022 |
Anticorrosive property of heterocyclic based epoxy resins on carbon steel corrosion in acidic medium: Electrochemical, surface morphology, DFT and Monte Carlo simulation studies O Dagdag, Z Safi, H Erramli, N Wazzan, IB Obot, ED Akpan, C Verma, ... Journal of Molecular Liquids 287, 110977, 2019 | 58 | 2019 |
DFT and TD–DFT calculations of the electronic structures and photophysical properties of newly designed pyrene-core arylamine derivatives as hole-transporting materials for … N Wazzan, RM El-Shishtawy, A Irfan Theoretical Chemistry Accounts 137, 1-15, 2018 | 57 | 2018 |
Adsorption and anticorrosive behavior of aromatic epoxy monomers on carbon steel corrosion in acidic solution: computational studies and sustained experimental studies O Dagdag, Z Safi, H Erramli, O Cherkaoui, N Wazzan, L Guo, C Verma, ... RSC advances 9 (26), 14782-14796, 2019 | 56 | 2019 |
A computational study of the nonlinear optical properties of carbazole derivatives: theory refines experiment AJ Garza, OI Osman, NA Wazzan, SB Khan, AM Asiri, GE Scuseria Theoretical Chemistry Accounts 133, 1-8, 2014 | 51 | 2014 |