Energetic, electronic and optical properties of lanthanide doped TiO2: An ab initio LDA+ U study WM Mulwa, CNM Ouma, MO Onani, FB Dejene
Journal of Solid State Chemistry 237, 129-137, 2016
50 2016 DFT study of cubic, tetragonal and trigonal structures of KGeCl3 perovskites for photovoltaic applications MM Namisi, RJ Musembi, WM Mulwa, BO Aduda
Computational Condensed Matter 34, e00772, 2023
37 2023 Effect of Cu2+ doping on the structural, electronic and optical properties of ZnAl2O4: A combined experimental and DFT+ U study WM Mulwa, BF Dejene, MO Onani, CNM Ouma
Journal of Luminescence 184, 7-16, 2017
33 2017 Elastic, anisotropic, lattice dynamics and electronic properties of XNiM and XNi2M (X= Ti, Zr, Hf; M= Sn, Ge, Si): DFT comparison study E Tindibale, WM Mulwa, BI Adetunji
Physica B: Condensed Matter 665, 415029, 2023
6 2023 Investigation of magnetic properties of FeMnP1-xAx (A= In, Se and Sn, where x= 0.33) by use of GGA functionals O Vincent, WM Mulwa, MSK Kirui
Physica B: Condensed Matter 613, 412777, 2021
5 2021 First-principles calculations to investigate the elastic, electronic, dynamical, and optical properties of cubic ZrCoAs half-Heusler semiconductor for photovoltaic applications L Allan, RE Mapasha, WM Mulwa, JM Mwabora, RJ Musembi
Results in Materials 22, 100558, 2024
4 2024 Density functional theory: advances in applications HH Abdallah, MA Palafox, YS Choong, S Chowdhury, FB Dejene, N Dhar, ...
Walter de Gruyter GmbH & Co KG, 2018
4 * 2018 An ab-initio study of P-type ZrCoY (Y Sb and Bi) half–Heusler semiconductors L Allan, WM Mulwa, JM Mwabora, RJ Musembi, RE Mapasha
Heliyon 9 (8), 2023
3 2023 Structural and electronic studies of Tio 2, Cr: Tio 2 And Nb: Tio 2 using Density Functional Theory WM Mulwa
Moi University, 2012
3 2012 Elastic anisotropy, mechanical, lattice dynamics, and electronic properties of MPdZ (M= Hf, Zr, Ti; Z= Sn, Ge, Si). DFT study E Tindibale, WM Mulwa, BI Adetunji
Computational Condensed Matter 39, e00904, 2024
2 2024 First principle study of ATiO L Allan, WM Mulwa, RE Mapasha, JM Mwabora, RJ Musembi
Journal of Molecular Modeling 30 (2), 32, 2024
2 2024 First Principles Study of the Structural, Mechanical, Electronic, and Lattice Dynamical Properties of the Half-Heusler Alloys ZrCoY (Y= Sb, Bi) L Allan, WM Mulwa, RJ Musembi, BO Aduda
arXiv preprint arXiv:2204.03759, 2022
2 2022 Structural, Electronic and Mechanical Properties of Re Doped FeMnP0. 67A0. 33 (A= Ga and Ge): A DFT Study GK Chirchir, MWMB IA
International Journal of Physics 10 (1), 70-78, 2022
2 2022 Synthesis, characterization and spectroscopic properties of Cu2+ :ZnO, Ce3+ :ZnO, and Cu2+ , Ce3+ :ZnO WM Mulwa
Applied Physics A 126 (7), 546, 2020
2 2020 WITHDRAWN: Experimental and DFT+ U studies of the structural, electronic and optical properties of Cu doped ZnAl2O4 WM Mulwa, MO Onani, BF Dejene, CNM Ouma
Journal of Computational Science, 2016
2 2016 Lecturers’ and students’ perceptions on the influence of texting language on students’ academic writing in English at Egerton University, Kenya M Chepkemoi
Egerton University, 2023
1 2023 Elastic, Anisotropic, Lattice Dynamics and Electronic Properties of XNiM and XNi2M (X= Ti, Zr, Hf; M= Sn, Ge, Si): DFT Comparison Study E Tindibale, WM Mulwa, BI Adetunji
Available at SSRN 4230020, 2022
1 2022 A DFT Investigation of RE (Ce, Dy, Eu) Doped Monolayer ZnO for Potential Application in Dye Sensitized Solar Cells Application IM Kahura, K Sharon, WM Mulwa
Nanoscience and Nanotechnology 13 (2), 17-27, 2024
2024 Energy Band-gap Engineering for ZnO as a Photoanode of Dye Sensitized Solar Cells; An ab initio Study IM Kahura, K Sharon, WM Mulwa
American Journal of Materials Science 14 (2), 31-44, 2024
2024 An ab-initio study of P-type ZrCoY (Y [dbnd] Sb and Bi) half–Heusler semiconductors L Allan, WM Mulwa, JM Mwabora, RJ Musembi, RE Mapasha
Elsevier, 2023
2023 