| Theoretical investigation of the adsorption behaviors of fluorouracil as an anticancer drug on pristine and B-, Al-, Ga-doped C36 nanotube M Kurban, İ Muz Journal of Molecular Liquids 309, 113209, 2020 | 45 | 2020 |
| A First-Principles evaluation on the interaction of 1,3,4-Oxadiazole with pristine and B-, Al-, Ga-doped C60 fullerenes İ Muz, M Kurban Journal of Molecular Liquids 335, 116181, 2021 | 40 | 2021 |
| A comprehensive study on electronic structure and optical properties of carbon nanotubes with doped B, Al, Ga, Si, Ge, N, P and As and different diameters İ Muz, M Kurban Journal of Alloys and Compounds 802, 25-35, 2019 | 36 | 2019 |
| A density functional theory study on favipiravir drug interaction with BN-doped C60 heterofullerene İ Muz, F Göktaş, M Kurban Physica E: Low-dimensional Systems and Nanostructures 135, 114950, 2022 | 28 | 2022 |
| Boron-doped hydrogenated Al3 clusters: A material for hydrogen storage İ Muz, M Atiş Journal of Alloys and Compounds 667, 275-281, 2016 | 26 | 2016 |
| Enhanced adsorption of fluoroquinolone antibiotic on the surface of the Mg-, Ca-, Fe- and Zn-doped C60 fullerenes: DFT and TD-DFT approach İ Muz Materials Today Communications 31, 103798, 2022 | 25 | 2022 |
| The electronic structure, transport and structural properties of nitrogen-decorated graphdiyne nanomaterials İ Muz, M Kurban Journal of Alloys and Compounds 842, 155983, 2020 | 22 | 2020 |
| 3d-transition metals (Cu, Fe, Mn, Ni, V and Zn)-doped pentacene π-conjugated organic molecule for photovoltaic applications: DFT and TD-DFT calculations İ Muz, F Göktaş, M Kurban Theoretical Chemistry Accounts 139 (2), 23, 2020 | 20 | 2020 |
| DFT and TD-DFT studies of new pentacene-based organic molecules as a donor material for bulk-heterojunction solar cells İ Muz, M Kurban, M Dalkılıç Journal of Computational Electronics 19 (3), 895-904, 2020 | 19 | 2020 |
| A DFT study on stability and electronic structure of AlN nanotubes İ Muz, H Kurban, M Kurban Materials Today Communications 26, 102118, 2021 | 18 | 2021 |
| Zinc oxide nanoclusters and their potential application as CH4 and CO2 gas sensors: Insight from DFT and TD-DFT İ Muz, M Kurban Journal of Computational Chemistry 43 (27), 1839-1847, 2022 | 14 | 2022 |
| Size dependence in the electronic and optical properties of a BN analogue of two-dimensional graphdiyne: A theoretical study İ Muz, F Göktaş, M Kurban Chemical Physics 539, 110926, 2020 | 13 | 2020 |
| Enhancement of electronic, photophysical and optical properties of 5,5′-Dibromo-2,2′-bithiophene molecule: new aspect to molecular design İ Muz, M Kurban Opto-Electronics Review 27 (2), 113-118, 2019 | 13 | 2019 |
| Electronic transport and non-linear optical properties of Hexathiopentacene (HTP) nanorings: A DFT study İ Muz, M Kurban Journal of Electronic Materials 49 (5), 3282-3289, 2020 | 12 | 2020 |
| Size-Dependent adsorption performance of ZnO nanoclusters for drug delivery applications M Kurban, İ Muz Structural Chemistry 34, 1061-1071, 2023 | 11 | 2023 |
| Sensing capability and diameter-dependent electronic structure of boron nitride nanotubes İ Muz, S Alaei, M Kurban Materials Today Communications 27, 102252, 2021 | 10 | 2021 |
| Search for the global minimum structures of AlB3H2n (n=0-6) clusters İ Muz, O Canko, M Atiş, EK Yıldırım Journal of Computational Chemistry 36 (6), 385-391, 2015 | 10 | 2015 |
| Ab initio search for global minimum structures of neutral and anionic hydrogenated Li5 clusters İ Muz, M Atiş, O Canko, EK Yıldırım Chemical Physics 418, 14-21, 2013 | 10 | 2013 |
| Electronic structures and bonding of graphdiyne and its BN analogs: Transition from quasi-planar to planar sheets İ Muz, M Kurban Journal of Alloys and Compounds 846, 155987, 2020 | 7 | 2020 |
| Structural transformations in the carborane series: CnB6-nH6 (n=0-6) upon substitution of boron by carbon İ Muz, M Atiş Inorganica Chimica Acta 453, 626-632, 2016 | 7 | 2016 |
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