2015
DOI: 10.1103/physrevb.92.115427
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Peeling of multilayer graphene creates complex interlayer sliding patterns

Abstract: Peeling, shearing, and sliding are important mechanical phenomena in van der Waals solids. However, theoretically they have been studied mostly using minimal periodic cells and in the context of accurate quantum simulations. Here, we investigate the peeling of large-scale multilayer graphene stacks with varying thicknesses, stackings, and peeling directions by using classical molecular dynamics simulations with a registry-dependent interlayer potential. Simulations show that, while at large scale the peeling p… Show more

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Cited by 25 publications
(16 citation statements)
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“…Fitting the force parameter f with a chosen tolerance a = 0.7Å to simulation data yields f = 0.7 meV/Å 3 . The maximal force per unit area for sliding in an armchair direction is f max = 2.3 meV/Å 3 , which confirms the physical interpretation of the fit (f ≈ 0.3f max ) [35].…”
supporting
confidence: 79%
“…Fitting the force parameter f with a chosen tolerance a = 0.7Å to simulation data yields f = 0.7 meV/Å 3 . The maximal force per unit area for sliding in an armchair direction is f max = 2.3 meV/Å 3 , which confirms the physical interpretation of the fit (f ≈ 0.3f max ) [35].…”
supporting
confidence: 79%
“…2), similar phenomena can be observed upon shear or bending deformations. 24 The paper is organized in the following way. In section 2 we discuss basic characteristics of interlayer interaction and elastic properties of graphene and boron nitride layers.…”
Section: Introductionmentioning
confidence: 99%
“…Because of the smallness of the graphene bending modulus, on micrometer-length scales the mechanical behavior is dominated by in-plane strain energy. 39 The strain energy is minimized when e αβ ≈ 0 or e αβ 0 ≈ δ αβ ε( r ). To a first approximation, eq 1 then implies an area increase of Δ A = [π/(2 log 2)] × fwhm 2 ε 0 .…”
mentioning
confidence: 99%