2012
DOI: 10.1021/jp300840k
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Strain Effect on the Electronic Properties of Single Layer and Bilayer Graphene

Abstract: This paper investigates strain effects on the electronic properties of single-layer and bilayer graphene using a first-principles method. The deformation significantly alters energy dispersion, band overlap, band gap, and the band edges of graphenes. Fermi velocity behaves both linearly and nonlinearly with the strains, depending on the types of deformation and the direction of the Fermi velocity. In bilayer graphene, the uniaxial strain enhances the band overlap by 2 orders of magnitude. A semimetal–insulator… Show more

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Cited by 131 publications
(80 citation statements)
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“…Calculated band-gaps for similarly strained graphene can range from 0.2-0.5 eV depending on the model. 15,17,21 Comparing this strain energy with a finite size band-gap expected for a 1.4 nm graphene ribbon, E g ∼ 1eV-nm/1.4nm = 0.8 eV, 5,18 shows that both effects lead to band gaps similar to the experimental value. Because the energy scales are similar, Peierl's like distortion are potentially important.…”
supporting
confidence: 61%
“…Calculated band-gaps for similarly strained graphene can range from 0.2-0.5 eV depending on the model. 15,17,21 Comparing this strain energy with a finite size band-gap expected for a 1.4 nm graphene ribbon, E g ∼ 1eV-nm/1.4nm = 0.8 eV, 5,18 shows that both effects lead to band gaps similar to the experimental value. Because the energy scales are similar, Peierl's like distortion are potentially important.…”
supporting
confidence: 61%
“…(9) shows that the force between dislocations is zero (i.e., E total is independent of d D ). This is a direct result of the assumption that the dislocation core is of zero width.…”
Section: −10mentioning
confidence: 99%
“…Bandgap modulation induced by application of an electric field in bilayer graphene has been experimentally confirmed 2 . The bandgap of layered materials, such as bilayer graphene [3][4][5] , hexagonal boron nitride, MoS 2 as well as phosphorene can also be varied by changes in bilayer stacking [3][4][5][6][7][8] and elastic strain [8][9][10] . While the relatively weak vdW-like interactions between graphene layers (compared to the strong interlayer covalent bonds) are sufficient to adhere two layers, the energy difference and barriers between different (sliding) translational states are sufficiently small that several distinct bilayer states can be realized.…”
Section: Introductionmentioning
confidence: 99%
“…Due to the hexagonal symmetry with a rotational angle of 60 • , a non-doped graphene is a zero-gap semiconductor with a vanishing density of state at the Fermi level. The essential electronic properties can be drastically changed by the layer number [35][36][37], stacking configuration [37][38][39][40][41][42], magnetic field [43,44], electric field [45][46][47], dopping [48,49], mechanical strain [50][51][52], and temperature variation [53,54]. Few-and multi-layer graphenes have been successfully produced by experimental methods such as exfoliation of highly orientated pyrolytic graphite [55][56][57][58], metalorganic chemical vapour deposition (MOCVD) [61][62][63][64][65][66], chemical and electrochemical reduction of graphene oxide [67][68][69], and arc discharge [70,71].…”
Section: Introductionmentioning
confidence: 99%