Browsing Research Output by Author "a65f7b07-3060-46a0-876e-e1bd7e0243f7"
Now showing items 1-5 of 5
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Antioxidant Properties of Kanakugiol Revealed Through the Hydrogen Atom Transfer, Electron Transfer and M2+ (M2+=Cu(II) or Co(II) Ion) Coordination Ability Mechanisms. A DFT Study In Vacuo and in Solution
Tsiepe, Jafta Tshepiso; Kabanda, Mwombeki Mwadham; Serobatse, Kemoabetswe Rakgadi Nototi (Springer Verlag, 2015)DFT studies on the conformational and antioxidant properties of kanakugiol were performed to investigate factors that contribute to its conformational preferences and to elucidate its antioxidant properties and mechanisms. ... -
Experimental and theoretical studies of the adsorption and corrosion inhibition of 6-phenylpyridazine-3(2H)-thione on Carbon Steel in 2.0 M H3PO4 solution
Salghi, R.; Zarrouk, A.; Hammouti, B.; Benchat, N.; Zarrok, H.; Ebenso, Eno Effiong; Kabanda, Mwombeki Mwadham; Benali, O. (ESG, 2014)The corrosion inhibition efficiency of 6-phenylpyridazine-3(2H)-thione (PPT) for carbon steel in 2.0 M H?PO? has been studied using weight loss, polarization, electrochemical impedance spectroscopy and SEM techniques. The ... -
Experimental, quantum chemical and Monte Carlo simulation studies on the corrosion inhibition of some alkyl imidazolium ionic liquids containing tetrafluoroborate anion on mild steel in acidic medium
Yesudass, Sasikumar; Adekunle, Abolanle; Olasunkanmi, Lukman Olawale; Bahadur, Indra; Ramaganthan, Baskar; Kabanda, Mwombeki Mwadham; Obot, I. B.; Ebenso, Eno Effiong (Elsevier Science Bv, 2015)The inhibition of mild steel corrosion in 1 M HCl solution by some imidazolium-based ionic liquids (ILs), namely 1-ethyl-3-methylimidazolium tetrafluoroborate [EMIM]?[BF?]?, 1-butyl-2,3-dimethylimidazolium tetrafluoroborate ... -
MP2, DFT and DFT–D study of the dimers of diazanaphthalenes: a comparative study of their structures, stabilisation and binding energies
Kabanda, Mwombeki Mwadham; Ebenso, Eno Effiong (Taylor & Francis, 2014)Diazanaphthalenes (DAPs) are a broad class of N-heteroaromatic compounds with several technological and biological applications. Some of these applications are attributed to the ability of DAP molecules to form associated ... -
Some Quinoxalin-6-yl derivatives as corrosion inhibitors for mild steel in hydrochloric acid: experimental and theoretical studies
Olasunkanmi, Lukman O.; Obot, Ime B.; Kabanda, Mwadham M.; Ebenso, Eno E. (Amer Chemical Soc, 2015)The inhibition of mild steel corrosion in 1 M HCl by some quinoxalin-6-yl derivatives namely 1-[3-phenyl-5-quinoxalin-6-yl-4,5-dihydropyrazol-1-yl]butan-1-one (PQDPB), 1-(3-phenyl-5-(quinoxalin-6-yl)-4,5-dihydro-1H-pyraz ...