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Density functional theory analysis of flexural modes, elastic constants, and corrugations in strained graphene
2012
Physical Review B
Ab initio density functional theory has been used to analyze flexural modes, elastic constants, and atomic corrugations on single and bi-layer graphene. Frequencies of flexural modes are sensitive to compressive stress; its variation under stress can be related to the anomalous thermal expansion via a simple model based in classical Elasticity Theory [Phys. Rev. B 86, 144103]. Under compression, flexural modes are responsible for a long wavelength rippling with a large amplitude and a marked
doi:10.1103/physrevb.86.245409
fatcat:wt4mcp5rprdnpkxvc7csyvgmny