| Theoretical investigation of new thiazolothiazole-based D-π-A organic dyes for efficient dye-sensitized solar cell A Fitri, AT Benjelloun, M Benzakour, M Mcharfi, M Hamidi, M Bouachrine Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 124, 646-654, 2014 | 105 | 2014 |
| Theoretical design of thiazolothiazole-based organic dyes with different electron donors for dye-sensitized solar cells A Fitri, AT Benjelloun, M Benzakour, M Mcharfi, M Hamidi, M Bouachrine Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 132, 232-238, 2014 | 76 | 2014 |
| DFT theoretical investigations of π-conjugated molecules based on thienopyrazine and different acceptor moieties for organic photovoltaic cells M Bourass, AT Benjelloun, M Hamidi, M Benzakour, M Mcharfi, M Sfaira, ... Journal of Saudi Chemical Society 20, S415-S425, 2016 | 54 | 2016 |
| Molecular Design of D-π-A-A Organic Dyes Based on Triphenylamine Derivatives with Various Auxiliary Acceptors for High Performance DSSCs A Slimi, A Fitri, A Touimi Benjelloun, S Elkhattabi, M Benzakour, M Mcharfi, ... Journal of Electronic Materials 48, 4452-4462, 2019 | 25 | 2019 |
| Interaction of lead atom with atmospheric hydroxyl radical. An ab initio and density functional theory study of the resulting complexes PbOH and HPbO AT Benjelloun, A Daoudi, H Chermette The Journal of chemical physics 121 (15), 7207-7221, 2004 | 24 | 2004 |
| Interaction of lead atom with atmospheric dioxygen and ozone: Quantic study of the structure and the stability of resulting Pb (On)(n= 1, 2, 3) compounds AT Benjelloun, A Daoudi, H Chermette The Journal of chemical physics 122 (15), 2005 | 22 | 2005 |
| Theoretical studies of the master factors influencing the efficiency of thiazolothiazole-based organic sensitizers for DSSC A Fitri, AT Benjelloun, M Benzakour, M Mcharfi, M Hamidi, M Bouachrine J Mater Environ Sci 7 (3), 834-844, 2016 | 20 | 2016 |
| DFT, DFTB and TD-DFT theoretical investigations of π-conjugated molecules based on thieno [2, 3-b] indole for dye-sensitized solar cell applications R El Mouhi, A Slimi, A Fitri, AT Benjelloun, S ElKhattabi, M Benzakour, ... Physica B: Condensed Matter 636, 413850, 2022 | 19 | 2022 |
| Ab initio and density functional theory study of lead complexes of atmospheric interest Pb (H2), Pb (OH), Pb (H2O), Pb (HO2) and Pb (OH) 2 A Touimi Benjelloun, A Daoudi, H Chermette* Molecular Physics 103 (2-3), 317-335, 2005 | 18 | 2005 |
| Theoretical investigations of structural, thermal properties and stability of the group 12 metal M (XH) isomers in atmosphere: M=(Zn, Cd, Hg) and XH=(OH, SH) N Ezarfi, A Touimi Benjelloun, S Sabor, M Benzakour, M Mcharfi Theoretical Chemistry Accounts 138, 1-14, 2019 | 6 | 2019 |
| Identification of terpenoids as potential inhibitors of SARS-CoV-2 (main protease) and spike (RBD) via computer-aided drug design H Hadni, A Fitri, A Touimi Benjelloun, M Benzakour, M Mcharfi, ... Journal of Biomolecular Structure and Dynamics, 1-14, 2023 | 5 | 2023 |
| Theoretical investigation by DFT and TDDFT the extension of π-conjugation of novel carbazole-based donor materials for bulk heterojunction organic solar cell applications O Britel, A Fitri, AT Benjelloun, M Benzakour, M Mcharfi Journal of Molecular Modeling 28 (11), 351, 2022 | 5 | 2022 |
| Effects of additional π-spacers on the photovoltaic properties of organic dyes for efficient dye-sensitized solar cells: a theoretical study O Britel, A Fitri, A Touimi Benjelloun, M Benzakour, M Mcharfi Research on Chemical Intermediates 48 (12), 5243-5264, 2022 | 2 | 2022 |
| DFT & TD-DFT STUDIES OF THIAZOLOTHIAZOLE–BASED ORGANIC DYES FOR DSSCs A Fitri, AT Benjelloun, M Benzakour, M Mcharfi, M Hamidi, M Bouachrine This international summer school is organized in the context of CapZeo …, 0 | | |
