Toward development of high-performance perovskite solar cells based on CH3NH3GeI3 using computational approach AA Kanoun, MB Kanoun, AE Merad, S Goumri-Said Solar Energy 182, 237-244, 2019 | 235 | 2019 |
Ab initio study of the bandgap engineering of Al1− xGaxN for optoelectronic applications B Amin, I Ahmad, M Maqbool, S Goumri-Said, R Ahmad Journal of Applied Physics 109 (2), 2011 | 181 | 2011 |
Theoretical study of mechanical, electronic, chemical bonding and optical properties of Ti2SnC, Zr2SnC, Hf2SnC and Nb2SnC MB Kanoun, S Goumri-Said, AH Reshak Computational Materials Science 47 (2), 491-500, 2009 | 107 | 2009 |
Structure and mechanical stability of molybdenum nitrides: A first-principles study MB Kanoun, S Goumri-Said, M Jaouen Physical Review B—Condensed Matter and Materials Physics 76 (13), 134109, 2007 | 87 | 2007 |
Zinc-blende AlN and GaN under pressure: structural, electronic, elastic and piezoelectric properties MB Kanoun, S Goumri-Said, AE Merad, G Merad, J Cibert, H Aourag Semiconductor science and technology 19 (11), 1220, 2004 | 87 | 2004 |
Advances in science and technology of Mn+ 1AXn phases IM Low Elsevier, 2012 | 79 | 2012 |
On the molecular structure, vibrational spectra, HOMO-LUMO, molecular electrostatic potential, UV–Vis, first order hyperpolarizability, and thermodynamic investigations of 3-(4 … R Rahmani, N Boukabcha, A Chouaih, F Hamzaoui, S Goumri-Said Journal of Molecular Structure 1155, 484-495, 2018 | 77 | 2018 |
Prediction of structural and thermodynamic properties of zinc-blende AlN: molecular dynamics simulation S Goumri-Said, MB Kanoun, AE Merad, G Merad, H Aourag Chemical Physics 302 (1-3), 135-141, 2004 | 63 | 2004 |
Non-local exchange correlation functionals impact on the structural, electronic and optical properties of III–V arsenides NN Anua, R Ahmed, A Shaari, MA Saeed, BU Haq, S Goumri-Said Semiconductor science and technology 28 (10), 105015, 2013 | 62 | 2013 |
DFT characterization of cadmium doped zinc oxide for photovoltaic and solar cell applications BU Haq, R Ahmed, S Goumri-Said Solar Energy Materials and Solar Cells 130, 6-14, 2014 | 60 | 2014 |
Electronic structure and mechanical properties of ternary ZrTaN alloys studied by ab initio calculations and thin-film growth experiments G Abadias, MB Kanoun, S Goumri-Said, L Koutsokeras, SN Dub, ... Physical Review B 90 (14), 144107, 2014 | 56 | 2014 |
Ab initio study of electronic structures and magnetism in ZnMnTe and CdMnTe diluted magnetic semiconductors AE Merad, MB Kanoun, S Goumri-Said Journal of magnetism and magnetic materials 302 (2), 536-542, 2006 | 56 | 2006 |
Liquid-phase exfoliated MoS 2 nanosheets doped with p-type transition metals: a comparative analysis of photocatalytic and antimicrobial potential combined with density … A Raza, U Qumar, A Haider, S Naz, J Haider, A Ul-Hamid, M Ikram, S Ali, ... Dalton Transactions 50 (19), 6598-6619, 2021 | 54 | 2021 |
Electronic properties of the binary noble metal nitride PtN: First-principles calculations MB Kanoun, S Goumri-Said Physical Review B—Condensed Matter and Materials Physics 72 (11), 113103, 2005 | 53 | 2005 |
Synthesis of Al/starch co-doped in CaO nanoparticles for enhanced catalytic and antimicrobial activities: experimental and DFT approaches M Ikram, A Haider, ST Bibi, A Ul-Hamid, J Haider, I Shahzadi, W Nabgan, ... RSC advances 12 (50), 32142-32155, 2022 | 52 | 2022 |
Study of wurtzite and zincblende GaN/InN based solar cells alloys: First-principles investigation within the improved modified Becke–Johnson potential BU Haq, R Ahmed, A Shaari, FEH Hassan, MB Kanoun, S Goumri-Said solar Energy 107, 543-552, 2014 | 52 | 2014 |
Magnetism in Sc-doped ZnO with zinc vacancies: A hybrid density functional and GGA+ U approaches MB Kanoun, S Goumri-Said, U Schwingenschlögl, A Manchon Chemical Physics Letters 532, 96-99, 2012 | 52 | 2012 |
Cr-Doped III–V nitrides: potential candidates for spintronics B Amin, S Arif, I Ahmad, M Maqbool, R Ahmad, S Goumri-Said, K Prisbrey Journal of electronic materials 40, 1428-1436, 2011 | 48 | 2011 |
h-BN nanosheets doped with transition metals for environmental remediation; a DFT approach and molecular docking analysis J Hassan, S Naz, A Haider, A Raza, A Ul-Hamid, U Qumar, J Haider, ... Materials Science and Engineering: B 272, 115365, 2021 | 47 | 2021 |
Ab initio investigation on the magnetic ordering in Gd doped ZnO I Bantounas, S Goumri-Said, M Benali Kanoun, A Manchon, I Roqan, ... Journal of Applied Physics 109 (8), 2011 | 46 | 2011 |