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  Author (up) Title Year Publication Volume Times cited Additional Links Links
Bafekry, A.; Shojaei, F.; Obeid, M.M.; Ghergherehchi, M.; Nguyen, C.; Oskouian, M. Two-dimensional silicon bismotide (SiBi) monolayer with a honeycomb-like lattice: first-principles study of tuning the electronic properties 2020 Rsc Advances 10 8 UA library record; WoS full record; WoS citing articles url doi
Bafekry, A.; Shojai, F.; Hoat, D.M.; Shahrokhi, M.; Ghergherehchi, M.; Nguyen, C. The mechanical, electronic, optical and thermoelectric properties of two-dimensional honeycomb-like of XSb (X = Si, Ge, Sn) monolayers: a first-principles calculations 2020 Rsc Advances 10 2 UA library record; WoS full record; WoS citing articles url doi
Bafekry, A.; Stampfl, C.; Akgenc, B.; Ghergherehchi, M. Control of C3N4 and C4N3 carbon nitride nanosheets' electronic and magnetic properties through embedded atoms 2020 Physical Chemistry Chemical Physics 22 18 UA library record; WoS full record; WoS citing articles url doi
Bafekry, A.; Stampfl, C.; Akgenc, B.; Mortazavi, B.; Ghergherehchi, M.; Nguyen, C.V. Embedding of atoms into the nanopore sites of the C₆N₆ and C₆N₈ porous carbon nitride monolayers with tunable electronic properties 2020 Physical Chemistry Chemical Physics 22 17 UA library record; WoS full record; WoS citing articles url 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.; Stampfl, C.; Ghergherehchi, M. Strain, electric-field and functionalization induced widely tunable electronic properties in MoS2/BC3, /C3N and / C3N4 van der Waals heterostructures 2020 Nanotechnology (Bristol. Print) 19 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.; Stampfl, C.; Naseri, M.; Fadlallah, M.M.; Faraji, M.; Ghergherehchi, M.; Gogova, D.; Feghhi, S.A.H. Effect of electric field and vertical strain on the electro-optical properties of the MoSi2N4 bilayer : a first-principles calculation 2021 Journal Of Applied Physics 129 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.; 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. 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.; 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.; 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.; Yagmurcukardes, M.; Akgenc, B.; Ghergherehchi, M.; Mortazavi, B. First-principles investigation of electronic, mechanical and thermoelectric properties of graphene-like XBi (X = Si, Ge, Sn) monolayers 2021 Physical Chemistry Chemical Physics 23 UA library record; WoS full record; WoS citing articles url 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.; 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.; 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
Faraji, M.; Bafekry, A.; Fadlallah, M.M.; Molaei, F.; Hieu, N.N.; Qian, P.; Ghergherehchi, M.; Gogova, D. Surface modification of titanium carbide MXene monolayers (Ti₂C and Ti₃C₂) via chalcogenide and halogenide atoms 2021 Physical Chemistry Chemical Physics 23 UA library record; WoS full record; WoS citing articles url doi
Faraji, M.; Bafekry, A.; Gogova, D.; Hoat, D.M.; Ghergherehchi, M.; Chuong, N.V.; Feghhi, S.A.H. Novel two-dimensional ZnO₂, CdO₂ and HgO₂ monolayers: a first-principles-based prediction 2021 New Journal Of Chemistry 45 UA library record; WoS full record; WoS citing articles url 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
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
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
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
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
Nguyen, H.T.T.; Obeid, M.M.; Bafekry, A.; Idrees, M.; Vu, T.V.; Phuc, H., V; Hieu, N.N.; Le Hoa, T.; Amin, B.; Nguyen, C., V Interfacial characteristics, Schottky contact, and optical performance of a graphene/Ga2SSe van der Waals heterostructure: Strain engineering and electric field tunability 2020 Physical Review B 102 12 UA library record; WoS full record; WoS citing articles url 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
Obeid, M.M.; Stampfl, C.; Bafekry, A.; Guan, Z.; Jappor, H.R.; Nguyen, C., V; Naseri, M.; Hoat, D.M.; Hieu, N.N.; Krauklis, A.E.; Tuan V Vu; Gogova, D. First-principles investigation of nonmetal doped single-layer BiOBr as a potential photocatalyst with a low recombination rate 2020 Physical Chemistry Chemical Physics 22 18 UA library record; WoS full record; WoS citing articles url doi
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