Hydrogen storage reactions on titanium decorated carbon nanocones theoretical study AS Shalabi, HO Taha, KA Soliman, SA Aal Journal of Power Sources 271, 32-41, 2014 | 34 | 2014 |
CO catalytic oxidation on Pt-doped single wall boron nitride nanotube: first-principles investigations SA Aal Surface Science 644, 1-10, 2016 | 33 | 2016 |
Theoretical investigation of favipiravir antiviral drug based on fullerene and boron nitride nanocages KA Soliman, SA Aal Diamond and related materials 117, 108458, 2021 | 29 | 2021 |
Ab initio characterization of Ti decorated SWCNT for hydrogen storage AS Shalabi, SA Aal, MM Assem, WSA Halim International journal of hydrogen energy 38 (1), 140-152, 2013 | 27 | 2013 |
The role of oxidation states in FA1 Tln+ (n= 1, 3) lasers and CO interactions at the (1 0 0) surface of NaCl: An ab initio study AS Shalabi, SA Aal, MA Kamel, HO Taha, HY Ammar, WSA Halim Chemical physics 328 (1-3), 8-16, 2006 | 25 | 2006 |
Type I FA (Rb+, Cs+) and II FA (Li+, Na+) tunable laser activities and donor-acceptor properties of O and O− at KCl (001) surface: first principle calculations AS Shalabi, TF El-Essawy, MM Assem, SA Aal, AM El-Mahdy Journal of Physics and Chemistry of Solids 63 (5), 749-758, 2002 | 20 | 2002 |
F2+ laser activity and photographic sensitization at the low coordinated surfaces of AgBr: ab initio calculations AS Shalabi, TF El-Essawy, MM Assem, SA Aal, AM El-Mahdy Physica B: Condensed Matter 315 (1-3), 13-28, 2002 | 20 | 2002 |
Enhancement of hydrogen storage capacities of Co and Pt functionalized h-BN nanosheet: Theoretical study SA Aal, AK Alfuhaidi Vacuum 183, 109838, 2021 | 19 | 2021 |
Metallophthalocyanine and Metallophthalocyanine–fullerene complexes as potential dye sensitizers for solar cells DFT and TD-DFT calculations AS Shalabi, SA Aal, MM Assem, KA Soliman Organic Electronics 13 (10), 2063-2074, 2012 | 17 | 2012 |
FA (Ga+, In+, Tl+) tunable laser activity and interaction of halogen atoms (F, Cl, Br, I, At) at the (001) surface of KCl crystal: ab initio calculations AS Shalabi, TF El-Essawy, MM Assem, S Abdel-Aal, AM El-Mahdy Current Applied Physics 2 (2), 97-105, 2002 | 17 | 2002 |
Artificial polarization effects on FA1: Sr2+ lasers and NO interactions at NaCl (0 0 1) surface: First principles calculations AS Shalabi, SA Aal, WSA Halim, HY Ammar Journal of Molecular Structure: THEOCHEM 823 (1-3), 47-58, 2007 | 16 | 2007 |
Adsorption of He and Ne on regular, irregular and defected surfaces of LiH crystal: ab initio study AS Shalabi, MM Assem, S Abdel-Aal, MA Kamel, MM Abd El-Rahman Solid state communications 111 (12), 735-740, 1999 | 16 | 1999 |
The effect of ruthenium on the performance of porphyrin dye and porphyrin–fullerene dyad solar cells predicted by DFT and TD-DFT calculations AS Shalabi, S Abdel Aal, AM El Mahdy Molecular Simulation 39 (9), 689-699, 2013 | 15 | 2013 |
CO adsorption on Pd atoms deposited on MgO, CaO, SrO and BaO surfaces: density functional calculations WSA Halim, SA Aal, AS Shalabi Thin Solid Films 516 (12), 4360-4365, 2008 | 13 | 2008 |
DFT study of the therapeutic potential of borospherene and metalloborospherenes as a new drug-delivery system for the 5-fluorouracil anticancer drug SA Aal Journal of Molecular Liquids 360, 119457, 2022 | 11 | 2022 |
The effect of anchoring group on the performances of metal-free phthalocyanine and metallophthalocyanine dye/titanium dioxide interface for dye-sensitized solar cells SA Aal, D Awadh Surfaces and Interfaces 32, 102089, 2022 | 9 | 2022 |
Cl2 adsorption on supported alkali metals and on the MgO and CaO (001) supports: A DFT study SA Aal, WSA Halim, AS Shalabi Solid state communications 148 (9-10), 464-468, 2008 | 9 | 2008 |
High Capacity Hydrogen Storage in Ni Decorated Carbon Nanocone:A First-Principles Study KAS S. Abdel Aal*, A. S. Shalabi Journal of Quantum Information Science 5, 134-149, 2015 | 8 | 2015 |
Ti, Ni, and Cu decorated borospherene as potential molecular sensor for phosgene KA Soliman, SA Aal Materials Science in Semiconductor Processing 144, 106574, 2022 | 7 | 2022 |
The role of artificial polarization in FA2: Ca2+ lasers and NO interactions at RbCl (0 0 1) surface: An ab initio study AS Shalabi, SA Aal, MA Kamel, HO Taha, WSA Halim Physica B: Condensed Matter 387 (1-2), 6-17, 2007 | 7 | 2007 |