Issue Date | Title | Author(s) |
2022 | Ab-initio-driven prediction of puckered penta-like PdPSeX (X=O, S, Te) Janus monolayers: Study on the electronic, optical, mechanical and photocatalytic properties | Bafekry, A.; Faraji, M.; Fadlallah, Mohamed M.; Jappor, H. R.; Hieu, N. N.; Ghergherehchi, M.; Gogova, D. |
2021 | Effect of electric field and vertical strain on the electro-optical properties of the MoSi2N4 bilayer: A first-principles calculation | Bafekry, A.; Stampfl, C.; Naseri, M.; Fadlallah, Mohamed M.; Faraji, M.; Ghergherehchi, M.; Feghhi, S. A. H. |
2024 | Electronic Performance and Schottky Contact of 2D GeH/InSe and GeH/In<sub>2</sub>Se<sub>3</sub> Heterostructures: Strain Engineering and Electric Field Tunability | Bafekry, Asadollah; Karbasizadeh, Siavash; Faraji, Mehrdad; Jappor, Hamad Rahman; Ziabari, Ali Abdolahzadeh; Fadlallah, Mohamed M.; Chang, Gap Soo |
2021 | Point Defects in a Two-Dimensional ZnSnN2 Nanosheet: A First-Principles Study on the Electronic and Magnetic Properties | Bafekry, Asadollah; Faraji, Mehrdad; Fadlallah, Mohamed M.; Mortazavi, Bohayra; Ziabari, A. Abdolahzadeh; Khatibani, A. Bagheri; Gogova, Daniela |
2023 | Reply to the Comment on Two-dimensional penta-like PdPSe with a puckered pentagonal structure: a first-principles study''' by S. Chowdhury, F. Shojaei and B. Mortazavi, Phys. Chem. Chem. Phys., 2023, 25, DOI: 10.1039/D2CP01587K | Bafekry, Asadollah; Fadlallah, Mohamed M.; Faraji, Mehrdad; Shafique, A.; Jappor, Hamad R.; Sarsari, I. Abdolhoseini; Ang, Yee Sin |
2021 | Tunable electronic and magnetic properties of MoSi2N4 monolayer via vacancy defects, atomic adsorption and atomic doping | Bafekry, A.; Faraji, M.; Fadlallah, Mohamed M.; Khatibani, A. Bagheri; Ziabari, A. Abdolahzadeh; Ghergherehchi, M.; Gogova, D. |
2022 | Tunable electronic properties of porous graphitic carbon nitride (C6N7) monolayer by atomic doping and embedding: A first-principle study | Bafekry, A.; Faraji, M.; Hieu, N. N.; Khatibani, A. Bagheri; Fadlallah, Mohamed M.; Gogova, D.; Ghergherehchi, M. |
2021 | Two-dimensional buckled tetragonal cadmium chalcogenides including CdS, CdSe, and CdTe monolayers as photo-catalysts for water splitting | Naseri, M.; Bafekry, A.; Faraji, M.; Hoat, D. M.; Fadlallah, Mohamed M.; Ghergherehchi, M.; Gogova, D. |
2022 | Two-dimensional XY monolayers (X = Al, Ga, In; Y = N, P, As) with a double layer hexagonal structure: A first-principles perspective | Faraji, M.; Bafekry, A.; Fadlallah, Mohamed M.; Jappor, H. R.; Ghergherehchi, M.; Nguyen, Chuong V. |