| Issue Date | Title | Author(s) |
| 2021 | Ab Initio Prediction of Semiconductivity in a Novel Two-Dimensional Sb2x3 (x= S, Se, Te) Monolayers With Orthorhombic Structure | Bafekry, A.; Mortazavi, B.; Faraji, M.; Shahrokhi, M.; Shafique, A.; Jappor, H. R.; Feghhi, S. A. H. |
| 2022 | Ab-Initio 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. |
| 2022 | Biphenylene Monolayer as a Two-Dimensional Nonbenzenoid Carbon Allotrope: a First-Principles Study | Bafekry, A.; Faraji, M.; Fadlallah, M. M.; Jappor, H. R.; Karbasizadeh, S.; Ghergherehchi, M.; Gogova, D. |
| 2021 | A Dirac-Semimetal Two-Dimensional Ben4: Thickness-Dependent Electronic and Optical Properties | Bafekry, A.; Stampfl, C.; Faraji, M.; Yagmurcukardes, M.; Fadlallah, M. M.; Jappor, H. R.; Ghergherehchi, M. |
| 2021 | Electronic and Magnetic Properties of Two-Dimensional of Fex (x = S, Se, Te) Monolayers Crystallize in the Orthorhombic Structures | Bafekry, A.; Sarsari, I. Abdolhosseini; Faraji, M.; Fadlallah, M. M.; Jappor, H. R.; Karbasizadeh, S.; Ghergherehchi, M. |
| 2021 | Electronic, Optical and Thermoelectric Properties of a Novel Two-Dimensional Sbxy (x = Se, Te; Y = Br, I) Family: Ab Initio Perspective | Bafekry, A.; Faraji, M.; Fadlallah, M. M.; Hoat, D. M.; Jappor, H. R.; Sarsari, I. Abdolhosseini; Ghergherehchi, M. |
| 2022 | Investigation of Vacancy Defects and Substitutional Doping in Alsb Monolayer With Double Layer Honeycomb Structure: a First-Principles Calculation | Bafekry, A.; Faraji, M.; Karbasizadeh, S.; Jappor, H. R.; Sarsari, I. Abdolhosseini; Ghergherehchi, M.; Gogova, D. |
| 2024 | Layered Conjugated Porous Fused Aromatic Network Structures of Two-Dimensional Carbon Nitride: a First-Principles Calculation of Optoelectronic Properties | Bafekry, A.; Fadlallah, M. M.; Stampfl, C.; Ziabari, A. Abdolahzadeh; Fazeli, S.; Faraji, M.; Jappor, H. R. |
| 2024 | Metal To Semiconductor Switching in the Agte Monolayer Via Decoration With Alkali Metal and Alkaline Earth Metal Atoms: a First-Principles Perspective | Bafekry, A.; Fadlallah, M. M.; Faraji, M.; Khan, S. Hasan; Jappor, H. R.; Shokri, Babak; Ghergherehchi, M. |
| 2021 | Novel Two-Dimensional Alsb and Insb Monolayers With a Double-Layer Honeycomb Structure: a First-Principles Study | Bafekry, A.; Faraji, M.; Fadlallah, M. M.; Jappor, H. R.; Karbasizadeh, S.; Ghergherehchi, M.; Sarsari, I. Abdolhosseini |
| 2021 | Prediction of Two-Dimensional Bismuth-Based Chalcogenides Bi2x3(x = S, Se, Te) Monolayers With Orthorhombic Structure: a First-Principles Study | Bafekry, A.; Faraji, M.; Fadlallah, M. M.; Jappor, H. R.; Hieu, N. N.; Ghergherehchi, M.; Gogova, D. |
| 2021 | Two-Dimensional Fete2 and Predicted Janus Fexs (x: Te and Se) Monolayers With Intrinsic Half-Metallic Character: Tunable Electronic and Magnetic Properties Via Strain and Electric Field | Bafekry, A.; Faraji, M.; Karbasizadeh, S.; Sarsari, I. Abdolhosseini; Jappor, H. R.; Ghergherehchi, M.; Gogova, D. |
| 2022 | Two-Dimensional Penta-Like Pdpse With a Puckered Pentagonal Structure: a First-Principles Study | Bafekry, A.; Fadlallah, M. M.; Faraji, Mehrdad; Shafique, A.; Jappor, H. R.; Abdolhoseini Sarsari, I.; Ghergherehchi, M. |
| 2021 | Two-Dimensional Porous Graphitic Carbon Nitride C6n7 Monolayer: First-Principles Calculations | Bafekry, A.; Faraji, M.; Fadlallah, M. M.; Abdolhosseini Sarsari, I.; Jappor, H. R.; Fazeli, S.; Ghergherehchi, M. |
| 2022 | Two-Dimensional Porous Graphitic Carbon Nitride C6n7 Monolayer: First-Principles Calculations & Nbsp; (vol 119, 142102 2021) | Bafekry, A.; Faraji, M.; Fadlallah, M. M.; Sarsari, I. Abdolhosseini; Jappor, H. R.; Fazeli, S.; Ghergherehchi, M. |
| 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. |
