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Obodo Kingsley Onyebuchi (Ph.D)
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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
762020
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
742010
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
632017
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
592017
GGA+ U studies of the early actinide mononitrides and dinitrides
KO Obodo, N Chetty
Journal of nuclear materials 442 (1-3), 235-244, 2013
432013
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
392020
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
372013
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
352020
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
352019
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
312018
Half-Metallic Ferromagnetism in Double Perovskite Ca2CoMoO6 Compound: DFT Calculations
A Djefal, S Amari, KO Obodo, L Beldi, H Bendaoud, RFL Evans, ...
Spin 7 (04), 1750009, 2017
312017
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
282019
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
272022
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
272021
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
272018
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
252019
Thermal Expansion of 3C-SiC Obtained from In-Situ X-ray Diffraction at High Temperature and First-Principal Calculations
NM Sultan, TMB Albarody, HKM Al-Jothery, MA Abdullah, HG Mohammed, ...
Materials 15 (18), 6229, 2022
232022
Modification of the band offset in boronitrene
KO Obodo, RC Andrew, N Chetty
Physical Review B—Condensed Matter and Materials Physics 84 (15), 155308, 2011
232011
First principles-based approaches for catalytic activity on the dehydrogenation of liquid organic hydrogen carriers: a review
DN Gemechu, AM Mohammed, M Redi, D Bessarabov, YS Mekonnen, ...
International Journal of Hydrogen Energy 48 (85), 33186-33206, 2023
222023
Si, P, S and Se surface additives as catalytic activity boosters for dehydrogenation of methylcyclohexane to toluene-A liquid organic hydrogen carrier system: Density …
CNM Ouma, KO Obodo, PM Modisha, D Bessarabov
Materials Chemistry and Physics 279, 125728, 2022
202022
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Articles 1–20