Mechanical properties of graphene under shear deformation

By K. Min, N. Aluru. 2011

331 citations recorded by the source corpus.

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A review on mechanics and mechanical properties of 2D materials—Graphene and beyond (2016, background): “The band structure calculation of bulk MoS2 with an indirect gap of ~1.2 eV was also predicted to monotonically decrease with increasing pressure until the gap closure at ~19 GPa [244].”
Mechanical properties of graphene and graphene-based nanocomposites (2017, methodology): “Min and Aluru [100] performed shear test on zigzag graphene using molecular dynamic simulations in order to study the effect of wrinkles on the fracture stress.”
Tailoring the mechanical properties of 2D materials and heterostructures (2018, background): “Min et al [137] examined single layer graphene under shear deformations by molecular dynamic simulations.”
Fracture of graphene: a review (2015, methodology): “By tilting the simulation box in the MD simulations and allowing the out-of-plane displacements for the carbon atoms, Min and Aluru (2011) demonstrated that the defect-free graphene sheet can wrinkle under shear deformation (Fig.”
Atomistic Studies of Mechanical Properties of Graphene (2014, methodology): “The atomic simulations of graphene are mainly based on the classical molecular dynamics (MD) with empirical interatomic potentials [14–33], the semi-empirical methods (tight-biding) [14,34] and the first-principle quantum mechanics (QM) calculations [35–42].”