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A. Bafekry

Shahid Beheshti University

49H-index
99Paper Count
5.0KCitation Count
Published Papers 37
Publication Date
Surface modification of XSe (X = Cu and Ag) monolayers by grope 1 elements: A metal to semiconductor transition by a first-principles perspective
err2024-06-03
err29
errOAAI
errBafekry, A.; Faraji, M.; Khan, S. Hasan; Fadlallah, M. M.; Jappor, H. R.; Shokri, B.; Ghergherehchi, M.; Chang, Gap Soo
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Controlling the Electro-Optical Properties of an AlSb Monolayer with a DLHC Structure through Phosphorus Alloying: A DFT Study
err2024-05-06
err9
PREAI
errBafekry, A.; Faraji, M.; Fazeli, S.; Khan, S. H.; Fadlallah, M. M.; Stampfl, C.; Ghergherehchi, M.; Chang, G. S.; Shokri, B.
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Theoretical prediction of two-dimensional BC2X (X = N, P, As) monolayers: ab initio investigations
err2022-12-23
err77
errOAAI
errBafekry, A.; Naseri, M.; Faraji, M.; Fadlallah, M. M.; Hoat, D. M.; Jappor, H. R.; Ghergherehchi, M.; Gogova, D.; Afarideh, H.
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In silico study of adsorption of oxide gases by MN4 (M = Be, Mg) monolayers
err2022-12-01
err13
PREAI
errZala, Vidit B.; Shukla, Rishit S.; Bafekry, Asadollah; Gupta, Sanjeev K.; Gajjar, P. N.
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Two-dimensional XY monolayers (X = Al, Ga, In; Y = N, P, As) with a double layer hexagonal structure: A first-principles perspective
err2022-07-01
err66
PREAI
errFaraji, M.; Bafekry, A.; Fadlallah, Mohamed M.; Jappor, H. R.; Ghergherehchi, M.; Nguyen, Chuong V.
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Two-dimensional porous graphitic carbon nitride C6N7 monolayer: First-principles calculations (vol 119, 142102 2021)
err2022-05-02
err2
errOAAI
errBafekry, A.; Faraji, M.; Fadlallah, M. M.; Sarsari, I. Abdolhosseini; Jappor, H. R.; Fazeli, S.; Ghergherehchi, M.
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Tunable electronic properties of porous graphitic carbon nitride (C6N7) monolayer by atomic doping and embedding: A first-principle study
err2022-05-01
err46
PREAI
errBafekry, A.; Faraji, M.; Hieu, N. N.; Khatibani, A. Bagheri; Fadlallah, Mohamed M.; Gogova, D.; Ghergherehchi, M.
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Puckered Penta-like PdPX (X = O, S, Te) Semiconducting Nanosheets: First-Principles Study of the Mechanical, Electro-Optical, and Photocatalytic Properties
err2022-04-26
err69
PREAI
errBafekry, Asadollah; Fadlallah, Mohamed M.; Faraji, Mehrdad; Hieu, Nguyen N.; Jappor, Hamad R.; Stampfl, Catherine; Ang, Yee Sin; Ghergherehchi, Mitra
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Ab-initio-driven prediction of puckered penta-like PdPSeX (X=O, S, Te) Janus monolayers: Study on the electronic, optical, mechanical and photocatalytic properties
err2022-04-01
err65
errOAAI
errBafekry, A.; Faraji, M.; Fadlallah, Mohamed M.; Jappor, H. R.; Hieu, N. N.; Ghergherehchi, M.; Gogova, D.
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Monoelemental two-dimensional iodinene nanosheets: a first-principles study of the electronic and optical properties
err2021-12-31
err10
PREAI
errBafekry, A.; Stampfl, C.; Faraji, M.; Mortazavi, B.; Fadlallah, M. M.; Nguyen, Chuong, V; Fazeli, S.; Ghergherehchi, M.
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Developing feature-rich electronic and magnetic properties in the β-As monolayer for spintronic and optoelectronic applications by C and Si doping: A first-principles study
err2021-12-01
err3
PREAI
errHoat, D. M.; Duy Khanh Nguyen; Bafekry, Asadollah; Vo Van On; Ul Haq, Bakhtiar; Duc-Quang Hoang; Cocoletzi, Gregorio H.; Rivas-Silva, J. F.
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Band-gap engineering, magnetic behavior and Dirac-semimetal character in the MoSi2N4 nanoribbon with armchair and zigzag edges
err2021-10-18
err26
errOAAI
errBafekry, A.; Faraji, M.; Stampfl, C.; Sarsari, I. Abdolhosseini; Ziabari, A. Abdollahzadeh; Hieu, N. N.; Karbasizadeh, S.; Ghergherehchi, M.
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Two-dimensional porous graphitic carbon nitride C6N7 monolayer: First-principles calculations
err2021-10-04
err70
PREAI
errBafekry, A.; Faraji, M.; Fadlallah, M. M.; Sarsari, I. Abdolhosseini; Jappor, H. R.; Fazeli, S.; Ghergherehchi, M.
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Adsorption of habitat and industry-relevant molecules on the MoSi2N4 monolayer
err2021-10-01
err66
PREAI
errBafekry, A.; Faraji, M.; Fadlallah, M. M.; Ziabari, A. Abdolahzadeh; Khatibani, A. Bagheri; Feghhi, S. A. H.; Ghergherehchi, M.; Gogova, D.
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Tunable electronic and magnetic properties of MoSi2N4 monolayer via vacancy defects, atomic adsorption and atomic doping
err2021-09-01
err102
errOAAI
errBafekry, A.; Faraji, M.; Fadlallah, Mohamed M.; Khatibani, A. Bagheri; Ziabari, A. abdolahzadeh; Ghergherehchi, M.; Nedaei, Sh; Shayesteh, S. Farjami; Gogova, D.
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Strain-driven modulation of the electronic, optical and thermoelectric properties of β-antimonene monolayer: A hybrid functional study
err2021-08-01
err5
PREAI
errHoat, D. M.; Nguyen, Duy Khanh; Bafekry, Asadollah; Van On, Vo; Ul Haq, Bakhtiar; Rivas-Silva, J. F.; Cocoletzi, Gregorio H.
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Prediction of two-dimensional bismuth-based chalcogenides Bi2X3(X = S, Se, Te) monolayers with orthorhombic structure: a first-principles study
err2021-07-19
err49
errOAAI
errBafekry, A.; Faraji, M.; Fadlallah, M. M.; Jappor, H. R.; Hieu, N. N.; Ghergherehchi, M.; Feghhi, S. A. H.; Gogova, D.
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Point Defects in a Two-Dimensional ZnSnN2 Nanosheet: A First-Principles Study on the Electronic and Magnetic Properties
err2021-06-03
err36
PREAI
errBafekry, Asadollah; Faraji, Mehrdad; Fadlallah, Mohamed M.; Mortazavi, Bohayra; Ziabari, A. Abdolahzadeh; Khatibani, A. Bagheri; Nguyen, Chuong, V; Ghergherehchi, Mitra; Gogova, Daniela
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A Dirac-semimetal two-dimensional BeN4: Thickness-dependent electronic and optical properties
err2021-05-20
err75
PREAI
errBafekry, A.; Stampfl, C.; Faraji, M.; Yagmurcukardes, M.; Fadlallah, M. M.; Jappor, H. R.; Ghergherehchi, M.; Feghhi, S. A. H.
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Ab initio prediction of semiconductivity in a novel two-dimensional Sb2X3 (X= S, Se, Te) monolayers with orthorhombic structure
err2021-05-14
err53
errOAAI
errBafekry, A.; Mortazavi, B.; Faraji, M.; Shahrokhi, M.; Shafique, A.; Jappor, H. R.; Nguyen, C.; Ghergherehchi, M.; Feghhi, S. A. H.
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