Silicene and transition metal based materials: prediction of a two-dimensional piezomagnet NY Dzade, KO Obodo, SK Adjokatse, AC Ashu, E Amankwah, CD Atiso, ...
Journal of Physics: Condensed Matter 22 (37), 375502, 2010
72 2010 Removal of fluoride ions using a polypyrrole magnetic nanocomposite influenced by a rotating magnetic field UO Aigbe, RB Onyancha, KE Ukhurebor, KO Obodo
Rsc Advances 10 (1), 595-609, 2020
65 2020 Controlling the magnetic and optical responses of a MoS 2 monolayer by lanthanide substitutional doping: a first-principles study CNM Ouma, S Singh, KO Obodo, GO Amolo, AH Romero
Physical Chemistry Chemical Physics 19 (37), 25555-25563, 2017
57 2017 Influence of transition metal doping on the electronic and optical properties of ReS 2 and ReSe 2 monolayers KO Obodo, CNM Ouma, JT Obodo, M Braun
Physical Chemistry Chemical Physics 19 (29), 19050-19057, 2017
54 2017 GGA+ U studies of the early actinide mononitrides and dinitrides KO Obodo, N Chetty
Journal of nuclear materials 442 (1-3), 235-244, 2013
42 2013 First principles LDA+ U and GGA+ U study of protactinium and protactinium oxides: dependence on the effective U parameter KO Obodo, N Chetty
Journal of Physics: Condensed Matter 25 (14), 145603, 2013
36 2013 Density functional theory calculation of Ti3C2 MXene monolayer as catalytic support for platinum towards the dehydrogenation of methylcyclohexane KO Obodo, CNM Ouma, PM Modisha, D Bessarabov
Applied Surface Science 529, 147186, 2020
33 2020 First principles study of single and multi-site transition metal dopant ions in MoS2 monolayer KO Obodo, CNM Ouma, JT Obodo, M Braun, D Bessarabov
Computational Condensed Matter 21, e00419, 2019
33 2019 Controlling the electronic and optical properties of HfS 2 mono-layers via lanthanide substitutional doping: a DFT+ U study KO Obodo, G Gebreyesus, CNM Ouma, JT Obodo, SO Ezeonu, DP Rai, ...
RSC advances 10 (27), 15670-15676, 2020
31 2020 Half-Metallic Ferromagnetism in Double Perovskite Ca2 CoMoO6 Compound: DFT Calculations A Djefal, S Amari, KO Obodo, L Beldi, H Bendaoud, RFL Evans, ...
Spin 7 (04), 1750009, 2017
29 2017 Ab initio insights on the effect of embedding lanthanide atoms on nitrogenated holey doped graphene (gC 2 N) CNM Ouma, KO Obodo, M Braun, GO Amolo
Journal of Materials Chemistry C 6 (15), 4015-4022, 2018
27 2018 Influence of Tm, Ho and Er dopants on the properties of Yb activated ZnTiO3 perovskite: A density functional theory insight KO Obodo, LL Noto, SJ Mofokeng, CNM Ouma, M Braun, MS Dhlamini
Materials Research Express 5 (10), 106202, 2018
25 2018 Insights on hydrogen evolution reaction in transition metal doped monolayer TcS2 from density functional theory calculations CNM Ouma, KO Obodo, M Braun, GO Amolo, D Bessarabov
Applied Surface Science 470, 107-113, 2019
24 2019 Modification of the band offset in boronitrene KO Obodo, RC Andrew, N Chetty
Physical Review B 84 (15), 155308, 2011
22 2011 Induced ferromagnetism in bilayer hexagonal Boron Nitride (h-BN) on vacancy defects at B and N sites B Chettri, PK Patra, TV Vu, CQ Nguyen, A Yaya, KO Obodo, NTT Tran, ...
Physica E: Low-dimensional Systems and Nanostructures 126, 114436, 2021
21 2021 First principles evaluation of the OER properties of TM− X (TM= Cr, Mn, Fe, Mo, Ru, W and Os, and X= F and S) doped IrO2 (110) surface KO Obodo, CNM Ouma, D Bessarabov
Electrochimica Acta 403, 139562, 2022
20 2022 Half-metallic and half-semiconductor gaps in Cr-based chalcogenides: DFT+ U calculations H Moulkhalwa, Y Zaoui, KO Obodo, A Belkadi, L Beldi, B Bouhafs
Journal of Superconductivity and Novel Magnetism 32, 635-649, 2019
20 2019 Ferromagnetism in RaBi with Zinc-Blende and Wurtzite Structures: Ab-initio Prediction H Benaissa, S Benatmane, S Amari, KO Obodo, L Beldi, H Bendaoud, ...
Spin 8 (02), 1850008, 2018
19 2018 Low-temperature water electrolysis KO Obodo, CNM Ouma, D Bessarabov
Power to Fuel, 17-50, 2021
18 2021 First-principles study of the electronic structure, magnetism, and phonon dispersions for CaX (X= C, N) compounds L Beldi, H Bendaoud, KO Obodo, B Bouhafs, S Méçabih, B Abbar
Computational Condensed Matter 17, e00336, 2018
18 2018