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  Author Title Year Publication Volume Times cited Additional Links Links (up)
Bafekry, A.; Faraji, M.; Hoat, D.M.; Shahrokhi, M.; Fadlallah, M.M.; Shojaei, F.; Feghhi, S.A.H.; Ghergherehchi, M.; Gogova, D. MoSi₂N₄ single-layer : a novel two-dimensional material with outstanding mechanical, thermal, electronic and optical properties 2021 Journal Of Physics D-Applied Physics 54 UA library record; WoS full record; WoS citing articles pdf doi
Bafekry, A.; Yagmurcukardes, M.; Akgenc, B.; Ghergherehchi, M.; Nguyen, C. Van der Waals heterostructures of MoS₂ and Janus MoSSe monolayers on graphitic boron-carbon-nitride (BC₃, C₃N, C₃N₄ and C₄N₃) nanosheets: a first-principles study 2020 Journal Of Physics D-Applied Physics UA library record; WoS full record; WoS citing articles doi
Bafekry, A.; Stampfl, C.; Faraji, M.; Yagmurcukardes, M.; Fadlallah, M.M.; Jappor, H.R.; Ghergherehchi, M.; Feghhi, S.A.H. A Dirac-semimetal two-dimensional BeN4 : thickness-dependent electronic and optical properties 2021 Applied Physics Letters 118 UA library record; WoS full record; WoS citing articles doi
Bafekry, A.; Shayesteh, S.F.; Ghergherehchi, M.; Peeters, F.M. Tuning the bandgap and introducing magnetism into monolayer BC3 by strain/defect engineering and adatom/molecule adsorption 2019 Journal of applied physics 126 48 UA library record; WoS full record; WoS citing articles pdf doi
Naseri, M.; Bafekry, A.; Faraji, M.; Hoat, D.M.; Fadlallah, M.M.; Ghergherehchi, M.; Sabbaghi, N.; Gogova, D. Two-dimensional buckled tetragonal cadmium chalcogenides including CdS, CdSe, and CdTe monolayers as photo-catalysts for water splitting 2021 Physical Chemistry Chemical Physics 23 UA library record; WoS full record; WoS citing articles doi
Bafekry, A.; Faraji, M.; Fadlallah, M.M.; Mortazavi, B.; Ziabari, A.A.; Khatibani, A.B.; Nguyen, C., V; Ghergherehchi, M.; Gogova, D. Point defects in a two-dimensional ZnSnN₂ nanosheet : a first-principles study on the electronic and magnetic properties 2021 Journal Of Physical Chemistry C 125 UA library record; WoS full record; WoS citing articles pdf doi
Hoat, D.M.; Duy Khanh Nguyen; Bafekry, A.; Vo Van On; Ul Haq, B.; Hoang, D.-Q.; Cocoletzi, G.H.; Rivas-Silva, J.F. Developing feature-rich electronic and magnetic properties in the beta-As monolayer for spintronic and optoelectronic applications by C and Si doping : a first-principles study 2021 Surfaces and interfaces 27 UA library record; WoS full record; WoS citing articles pdf doi
Nguyen, D.K.; Hoat, D.M.; Bafekry, A.; Van On, V.; Rivas-Silva, J.F.; Naseri, M.; Cocoletzi, G.H. Theoretical prediction of the PtOX (X = S and Se) monolayers as promising optoelectronic and thermoelectric 2D materials 2021 Physica E-Low-Dimensional Systems & Nanostructures 131 UA library record; WoS full record; WoS citing articles pdf doi
Bafekry, A. Graphene-like BC₆N single-layer: tunable electronic and magnetic properties via thickness, gating, topological defects, and adatom/molecule 2020 Physica E-Low-Dimensional Systems & Nanostructures 118 30 UA library record; WoS full record; WoS citing articles doi
Mortazavi, B.; Bafekry, A.; Shahrokhi, M.; Rabczuk, T.; Zhuang, X. ZnN and ZnP as novel graphene-like materials with high Li-ion storage capacities 2020 Materials today energy 16 13 UA library record; WoS full record; WoS citing articles pdf doi
Hoat, D.M.; Nguyen, D.K.; Bafekry, A.; Van On, V.; Ul Haq, B.; Rivas-Silva, J.F.; Cocoletzi, G.H. Strain-driven modulation of the electronic, optical and thermoelectric properties of beta-antimonene monolayer : a hybrid functional study 2021 Materials Science In Semiconductor Processing 131 UA library record; WoS full record; WoS citing articles pdf doi
Bafekry, A.; Mortazavic, B.; Shayesteh, S.F. Band gap and magnetism engineering in Dirac half-metallic Na2C nanosheet via layer thickness, strain and point defects 2019 Journal of magnetism and magnetic materials 491 13 UA library record; WoS full record; WoS citing articles pdf doi
Bafekry, A.; Ghergherehchi, M.; Shayesteh, S.F.; Peeters, F.M. Adsorption of molecules on C3N nanosheet : a first-principles calculations 2019 Chemical physics 526 46 UA library record; WoS full record; WoS citing articles pdf doi
Bafekry, A.; Yagmurcukardes, M.; Shahrokhi, M.; Ghergherehchi, M. Electro-optical properties of monolayer and bilayer boron-doped C₃N: Tunable electronic structure via strain engineering and electric field 2020 Carbon 168 21 UA library record; WoS full record; WoS citing articles pdf doi
Bafekry, A.; Faraji, M.; Fadlallah, M.M.; Ziabari, A.A.; Khatibani, A.B.; Feghhi, S.A.H.; Ghergherehchi, M.; Gogova, D. Adsorption of habitat and industry-relevant molecules on the MoSi₂N₄ monolayer 2021 Applied Surface Science 564 UA library record; WoS full record; WoS citing articles pdf doi
Bafekry, A.; Yagmurcukardes, M.; Shahrokhi, M.; Ghergherehchi, M.; Kim, D.; Mortazavi, B. Electro-optical and mechanical properties of Zinc antimonide (ZnSb) monolayer and bilayer : a first-principles study 2021 Applied Surface Science 540 1 UA library record; WoS full record; WoS citing articles pdf doi
Obeid, M.M.; Bafekry, A.; Rehman, S.U.; Nguyen, C., V. A type-II GaSe/HfS₂ van der Waals heterostructure as promising photocatalyst with high carrier mobility 2020 Applied Surface Science 534 4 UA library record; WoS full record; WoS citing articles pdf doi
Bafekry, A.; Van Nguyen, C.; Stampfl, C.; Akgenc, B.; Ghergherehchi, M. Oxygen vacancies in the single layer of Ti₂CO₂ MXene: effects of gating voltage, mechanical strain, and atomic impurities 2020 Physica Status Solidi B-Basic Solid State Physics UA library record; WoS full record; WoS citing articles pdf doi
Bafekry, A.; Stampfl, C.; Peeters, F.M. The electronic, optical, and thermoelectric properties of monolayer PbTe and the tunability of the electronic structure by external fields and defects 2020 Physica Status Solidi B-Basic Solid State Physics 37 UA library record; WoS full record; WoS citing articles pdf doi
Bafekry, A.; Stampfl, C.; Shayesteh, S.F.; Peeters, F.M. Exploiting the novel electronic and magnetic structure of C3Nvia functionalization and conformation 2019 Advanced Electronic Materials 5 35 UA library record; WoS full record; WoS citing articles pdf doi
Bafekry, A.; Stampfl, C.; Shayesteh, S.F. A first-principles study of C3N nanostructures : control and engineering of the electronic and magnetic properties of nanosheets, tubes and ribbons 2020 Chemphyschem 21 27 UA library record; WoS full record; WoS citing articles pdf url doi
Bafekry, A.; Akgenc, B.; Shayesteh, S.F.; Mortazavi, B. Tunable electronic and magnetic properties of graphene/carbon-nitride van der Waals heterostructures 2020 Applied Surface Science 505 26 UA library record; WoS full record; WoS citing articles pdf url doi
Bafekry, A.; Faraji, M.; Fadlallah, M.M.; Khatibani, A.B.; Ziabari, A. abdolahzadeh; Ghergherehchi, M.; Nedaei, S.; Shayesteh, S.F.; Gogova, D. Tunable electronic and magnetic properties of MoSi₂N₄ monolayer via vacancy defects, atomic adsorption and atomic doping 2021 Applied Surface Science 559 UA library record; WoS full record; WoS citing articles pdf url doi
Bafekry, A.; Stampfl, C.; Ghergherehchi, M.; Shayesteh, S.F. A first-principles study of the effects of atom impurities, defects, strain, electric field and layer thickness on the electronic and magnetic properties of the C2N nanosheet 2020 Carbon 157 49 UA library record; WoS full record; WoS citing articles pdf url doi
Bafekry, A.; Shahrokhi, M.; Yagmurcukardes, M.; Gogova, D.; Ghergherehchi, M.; Akgenc, B.; Feghhi, S.A.H. Surface functionalization of the honeycomb structure of zinc antimonide (ZnSb) monolayer : a first-principles study 2021 Surface Science 707 UA library record; WoS full record; WoS citing articles pdf url doi
Bafekry, A.; Shayesteh, S.F.; Peeters, F.M. C3N Monolayer: Exploring the Emerging of Novel Electronic and Magnetic Properties with Adatom Adsorption, Functionalizations, Electric Field, Charging, and Strain 2019 The journal of physical chemistry: C : nanomaterials and interfaces 123 67 UA library record; WoS full record; WoS citing articles url doi
Bafekry, A.; Shahrokhi, M.; Shafique, A.; Jappor, H.R.; Fadlallah, M.M.; Stampfl, C.; Ghergherehchi, M.; Mushtaq, M.; Feghhi, S.A.H.; Gogova, D. Semiconducting chalcogenide alloys based on the (Ge, Sn, Pb) (S, Se, Te) formula with outstanding properties : a first-principles calculation study 2021 ACS Omega 6 UA library record; WoS full record; WoS citing articles url doi
Bafekry, A.; Stampfl, C.; Peeters, F.M. Dirac half-metallicity of thin PdCl₃ nanosheets : investigation of the effects of external fields, surface adsorption and defect engineering on the electronic and magnetic properties 2020 Scientific Reports 10 26 UA library record; WoS full record; WoS citing articles url doi
Bafekry, A.; Mortazavi, B.; Faraji, M.; Shahrokhi, M.; Shafique, A.; Jappor, H.R.; Nguyen, C.; Ghergherehchi, M.; Feghhi, S.A.H. Ab initio prediction of semiconductivity in a novel two-dimensional Sb₂X₃ (X= S, Se, Te) monolayers with orthorhombic structure 2021 Scientific Reports 11 UA library record; WoS full record; WoS citing articles url doi
Bafekry, A.; Ghergherehchi, M.; Shayesteh, S.F. Tuning the electronic and magnetic properties of antimonene nanosheets via point defects and external fields: first-principles calculations 2019 Physical chemistry, chemical physics 21 17 UA library record; WoS full record; WoS citing articles url doi
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