Browsing by Author "Ghergherehchi, M."
Now showing items 1-3 of 3
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Strain and electric field tuning of semi-metallic character WCrCO2 MXenes with dual narrow band gap
Bafekry, Asadollah; Akgenç, Berna; Ghergherehchi, M.; Peeters, F. M. (Iop Publishing Ltd, 2020)Motivated by the recent successful synthesis of double-M carbides, we investigate structural and electronic properties of WCrC and WCrCO2 monolayers and the effects of biaxial and out-of-plane strain and electric field ... -
Surface functionalization of the honeycomb structure of zinc antimonide (ZnSb) monolayer: A first-Principles study
Bafekry, Asadollah; Shahrokhi, M.; Yağmurcukardeş, Mehmet; Gogova, D.; Ghergherehchi, M.; Akgenç, Berna; Feghhi, S. A. H. (Elsevier, 2021)Structural, electronic, optic and vibrational properties of Zinc antimonide (ZnSb) monolayers and their func-tionalized (semi-fluorinated and fully chlorinated) structures are investigated by means of the first-principles ... -
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
Bafekry, Asadollah; Yağmurcukardeş, Mehmet; Akgenç, Berna; Ghergherehchi, M.; Nguyen, Ch, V (Iop Publishing Ltd, 2020)In this work, we extensively investigate the structural and electronic properties of van der Waals heterostructures (HTs) constructed by MoS2/BC3, MoS2/C3N, MoS2/C3N4, MoS2/C4N3 and those using Janus MoSSe instead of ...