| DFT study of the molecular structure, conformational preference, HOMO, LUMO, and vibrational analysis of 2-, and 3-furoyl chloride Y Umar, S Abdalla Journal of Solution Chemistry 46, 741-758, 2017 | 23 | 2017 |
| Study of the influence of functionalization on the reorganization energy of naphthalene using DFT R Oshi, S Abdalla, M Springborg Computational and Theoretical Chemistry 1099, 209-215, 2017 | 20 | 2017 |
| Theoretical study on functionalized anthracene and tetraceneas starting species to produce promising semiconductor materials R Oshi, S Abdalla, M Springborg Computational and Theoretical Chemistry 1128, 60-69, 2018 | 19 | 2018 |
| Conformational and vibrational analysis of 2-, 3-and 4-pyridinecarbonyl chloride using DFT S Abdalla, Y Umar, I Mokhtar Zeitschrift für Physikalische Chemie 230 (5-7), 867-882, 2016 | 18 | 2016 |
| Density functional theory studies of conformational stabilities and rotational barriers of 2-and 3-thiophenecarboxaldehydes Y Umar, J Tijani, S Abdalla Journal of Structural Chemistry 57, 1545-1553, 2016 | 16 | 2016 |
| Theoretical study of the effects of solvation, substitution, and structure on the properties of imidazolines, oxazolines, and thiazolines S Abdalla, M Springborg The Journal of Physical Chemistry A 114 (18), 5823-5829, 2010 | 16 | 2010 |
| The impact of functionalization of organic semiconductors by electron donating groups on the reorganization energy R Oshi, S Abdalla, M Springborg The European Physical Journal D 73, 1-8, 2019 | 14 | 2019 |
| Theoretical investigation of the molecular structure, vibrational spectra, and molecular docking of tramadol using density functional theory Y Umar, S Abdalla, SKM Haque, GS Moran, A Ishaq, WC Villada, ... Journal of the Chinese Chemical Society 67 (1), 62-71, 2020 | 13 | 2020 |
| Conformational stabilities, rotational barriers, and vibrational spectra of 2-Pyrrolecarboxaldehyde and 3-Pyrrolecarboxaldehyde calculated using density functional theory Y Umar, J Tijani, S Abdalla Journal of Structural Chemistry 60, 186-197, 2019 | 10 | 2019 |
| Isolated and deposited potassium clusters: energetic and structural properties S Abdalla, M Springborg, Y Dong Surface science 608, 255-264, 2013 | 10 | 2013 |
| A DFT and TD-DFT study on emodin and purpurin and their functionalized molecules to produce promising organic semiconductor materials Z Ali, S Abdalla, EA Hassan, Y Umar, MM Al-Mogren Journal of King Saud University-Science 34 (5), 102117, 2022 | 6 | 2022 |
| A DFT study of the properties of substituted pyrrolidines and phospholanes in gas and in aqueous phase S Abdalla, M Springborg Computational and Theoretical Chemistry 978 (1-3), 143-151, 2011 | 5 | 2011 |
| Theoretical study of tautomerization and isomerization of methylamino-and phenylamino-substituted cyclic azaphospholines, oxaphospholines and thiaphospholines in gas and … S Abdalla, M Springborg Journal of Molecular Structure: THEOCHEM 962 (1-3), 101-107, 2010 | 5 | 2010 |
| Theoretical study of electronic and optical properties of functionalized Indigo and Alizarin as potential organic semi-conductors for solar cells applications Z Ali, S Abdalla, EA Hassan, Y Umar, MM Al-Mogren Materials Today Communications 32, 104048, 2022 | 4 | 2022 |
| Quasiparticle and Optical Properties of Hydrogen Titanate and Its Defective Systems: An Investigation by Density Functional Theory with Hubbard Correction, Many‐Body … W Elsayed, S Abdalla, N Seriani physica status solidi (b) 257 (3), 1900054, 2020 | 4 | 2020 |
| Experimental FTIR and Theoretical Investigation of the Molecular Sturcture and Vibrational Spectra of Terephthaloyl Chloride by Density Functional Theory Y Umar, S Abdalla IOSR Journal of Applied Chemistry (IOSR-JAC) 8 (9), 26-34, 2015 | 4 | 2015 |
| Phytochemicals and in silico investigations of Sudanese roselle A El-Naeem, S Abdalla, I Ahmed, G Alhassan South African Journal of Science 118 (1-2), 1-7, 2022 | 3 | 2022 |
| Theoretical study of the effects of media of the properties of finite sytems: molecules and clusters S Abdalla | 3 | 2012 |
| Facile synthesis of carbon dots by the hydrothermal carbonization of avocado peels and evaluation of the photocatalytic property H Ferjani, S Abdalla, OA Oyewo, DC Onwudiwe Inorganic Chemistry Communications 160, 111866, 2024 | 2 | 2024 |
| Structural characterization, Hirshfeld surface analysis, optical properties, and DFT study of a new copper (II) complex H Ferjani, YB Smida, S Abdalla, DC Onwudiwe, E Hosten Inorganic Chemistry Communications 157, 111314, 2023 | 2 | 2023 |
