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Retraction notice to "Vibrational, electronic, spectroscopic properties, and NBO analysis of p-xylene, 3,6-difluoro-p-xylene, 3,6-dichloro-p-xylene and 3,6-dibromo-pxylene: DFT study" [Heliyon 6 (2020) e05783] 撤稿通知:"Vibrational, electronic, spectroscopic properties, and NBO analysis of p-xylene, 3,6-difluoro-p-xylene, 3,6-dichloro-p-xylene and 3,6-dibromo-pxylene: DFT study" [Heliyon 6 (2020) e05783] Emmanuel A. Bisong; Hitler Louis; Tomsmith O. Unimuke; Joseph O. Odey; Emmanuel I. Ubana; Moses M. Edim; Fidelis Timothy Tizhe; John A. Agwupuye; Patrick M. Utsu 分享 收藏
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Surface engineering of non-platinum-based electrocatalysts for sustainable hydrogen production: Encapsulation, doping, and decoration approach Unimuke, Tomsmith O.; Mbonu, Idongesit J.; Louis, Hitler; Mathias, Gideon E.; Hossain, Ismail; Ikenyirimba, Onyinye J.; Nwobodo, Ikechukwu C.; Adeyinka, Adedapo S. 分享 收藏
Molecular modeling of Si60 fullerene and Nb-doped Si60 fullerene nanomaterials for SO2, NO2 and CO2 gas sensing Agwamba, Ernest C.; Eba, Maxwell-Borjor A.; Alshdoukhi, Ibtehaj F.; Shawabkeh, Ali; Hossain, Ismail; Ikenyirimba, Onyinye J.; Mathias, Gideon E.; Unimuke, Tomsmith O.; Adeyinka, Adedapo S.; Louis, Hitler 分享 收藏
Assessing the Performance of Transition Metals (M = Hf, Ti, and Zr) Decorated Silicon Carbide Nanotubes (M@SiCNTs) for Hydrogen Storage Applications: Insights from Theoretical Calculations Chukwu, Udochukwu G.; Unimuke, Tomsmith O.; Trabelsi, Youssef; Ogbodo, Sopuruchukwu E.; Shawabkeh, Ali; Agwamba, Ernest C.; Gber, Terkumbur E.; Adeyinka, Adedapo S.; Louis, Hitler 分享 收藏
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Modeling of photofunctional transition metals (Mn, Re, Ir) complexes towards the effective detection of uric acid (UA) as biomarker for kidney dysfunction Effeti, Iris I.; Majoumo-Mbe, Felicite; Louis, Hitler; Nfor, Emmanuel N.; Akongwi, Mirabelle; Unimuke, Tomsmith O.; Pembere, Anthony M. S.; Offiong, Offiong E. 分享 收藏
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Single metal-doped silicon (Si59X; X = Nb, Mo, Y, Zr) nanostructured as nanosensors for N-Nitrosodimethylamine (NDMA) pollutant: Intuition from computational study Agwamba, Ernest C.; Mathias, Gideon E.; Louis, Hitler; Ikenyirimba, Onyinye J.; Unimuke, Tomsmith O.; Ahuekwe, Eze F.; Benjamin, Innocent; Dike, Humphrey N.; Maxwell, Kube T.; Adeyinka, Adedapo S. 分享 收藏
Molecular Simulation of the Interaction of Diclofenac with Halogen (F, Cl, Br)-Encapsulated Ga12As12 Nanoclusters Nwobodo, Ikechukwu C.; Louis, Hitler; Unimuke, Tomsmith O.; Ikenyirimba, Onyinye J.; Iloanya, Anthony C.; Mathias, Gideon E.; Osabor, Vincent N.; Ahuekwe, Eze F.; Adeyinka, Adedapo S. 分享 收藏
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Interaction of 5-Fluorouracil on the Surfaces of Pristine and Functionalized Ca12O12 Nanocages: An Intuition from DFT Ogunwale, Goodness J.; Louis, Hitler; Unimuke, Tomsmith O.; Mathias, Gideon E.; Owen, Aniekan E.; Edet, Henry O.; Enudi, Obieze C.; Oluwasanmi, Esther O.; Adeyinka, Adedapo S.; Mohammadi, Mohsen Doust 分享 收藏
Investigation of crystal structures, spectral (FT-IR and NMR) analysis, DFT, and molecular docking studies of novel piperazine derivatives as antineurotic drugs Jaziri, Emna; Louis, Hitler; Gharbi, Chaima; Lefebvre, Frederic; Kaminsky, Werner; Agwamba, Ernest C.; Egemonye, ThankGod C.; Unimuke, Tomsmith O.; Ikenyirimba, Onyinye J.; Mathias, Gideon E.; Khedhiri, Lamia; Ben Nasr, Cherif 分享 收藏