Vacancy formation in moo 3: Hybrid density functional theory and photoemission experiments SO Akande, A Chroneos, M Vasilopoulou, S Kennou, ... Journal of Materials Chemistry C 4 (40), 9526-9531, 2016 | 30 | 2016 |
Searching for the rate determining step of the H2S reaction on Fe (110) surface SO Akande, ET Bentria, O Bouhali, F El-Mellouhi Applied Surface Science 532, 147470, 2020 | 25 | 2020 |
Anisotropic O vacancy formation and diffusion in LaMnO 3 LY Gan, SO Akande, U Schwingenschlögl Journal of Materials Chemistry A 2 (46), 19733-19737, 2014 | 24 | 2014 |
Elucidating the role of extended surface defects at Fe surfaces on CO adsorption and dissociation A Chakrabarty, ET Bentria, SA Omotayo, O Bouhali, N Mousseau, ... Applied Surface Science 491, 792-798, 2019 | 15 | 2019 |
Capturing the iron carburization mechanisms from the surface to bulk ET Bentria, SO Akande, CS Becquart, N Mousseau, O Bouhali, ... The Journal of Physical Chemistry C 124 (52), 28569-28579, 2020 | 10 | 2020 |
Intrinsic defect processes and O migration in PrBa (Co/Fe) 2 O 5.5 SO Akande, S Boulfrad, U Schwingenschlögl Journal of Materials Chemistry A 4 (9), 3560-3564, 2016 | 10 | 2016 |
Insights on the effect of water content in carburizing gas mixtures on the metal dusting corrosion of iron ET Bentria, SO Akande, A Ramesh, N Laycock, W Hamer, M Normand, ... Applied Surface Science 579, 152138, 2022 | 7 | 2022 |
Defect formation and migration in and : A first-principles study SO Akande, D Çakır Physical Review Materials 7 (5), 053610, 2023 | 6 | 2023 |
First-principles studies of defect behaviour in bismuth germanate SO Akande, O Bouhali Scientific Reports 12 (1), 15728, 2022 | 4 | 2022 |
Controlling surface chemistry of CO reactions on Fe surface by S blocking: a first-principles and microkinetic studies SO Akande, ET Bentria, A Ramesh, N Laycock, O Bouhali, F El-Mellouhi Applied Surface Science 571, 151216, 2022 | 3 | 2022 |
O vacancy formation in (Pr/Gd) BaCo 2 O 5.5 and the role of antisite defects SO Akande, A Chroneos, U Schwingenschlögl Physical Chemistry Chemical Physics 19 (18), 11455-11459, 2017 | 3 | 2017 |
Formation of CaCO3 from calcium sources with different anions in single process of CO2 capture-mineralization DH Moon, A Murnandari, O Salawu, CW Lee, W Lee, YE Kim, KT Park, ... Korean Journal of Chemical Engineering 37, 1709-1716, 2020 | 2 | 2020 |
First-principles investigation of mechanical and thermal properties of (), , and SO Akande, B Samanta, C Sevik, D Çakır Physical Review Applied 20 (4), 044064, 2023 | 1 | 2023 |
Electronic structure and O vacancy formation/migration in La0. 825 (Mg/Ca/Ba) 0.125 CoO3 SO Akande, LY Gan, U Schwingenschlögl Europhysics Letters 114 (2), 26001, 2016 | 1 | 2016 |
First-principles study on the oxidation of MoAlB and Cr2AlB2 D Cakir, B Samanta, SO Akande Bulletin of the American Physical Society, 2024 | | 2024 |
Elucidating the Oxidation Mechanisms in Cr2AlB2 Using Density Functional Theory and Thermodynamic Modeling S Omotayo Akande, B Samanta, U Adhikarige, D Çakır The Journal of Physical Chemistry C 128 (6), 2471-2483, 2024 | | 2024 |
First Principles Studies of Perovskites for Intermediate Temperature Solid Oxide Fuel Cell Cathodes OA Salawu | | 2017 |
Role of Strain Ans Sr-Doping for the Anisotropic Oxygen Diffusion in LaMnO3 O Salawu, L Gan, U Schwingenschlogl Electrochemical Society Meeting Abstracts sofc2015, 65-65, 2015 | | 2015 |
Role of Hole Doping on the Oxygen Vacancy Formation and Migration in LaCoO3 O Salawu, L Gan, U Schwingenschlogl Electrochemical Society Meeting Abstracts sofc2015, 66-66, 2015 | | 2015 |
Anisotropic O vacancy formation and diffusion in LaMnO₃ LY Gan, SO Akande, U Schwingenschlögl | | 2014 |