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Molecular dynamics simulation for interlayer interactions of graphene nanoribbons with multiple layers
, Article Superlattices and Microstructures ; Volume 98 , 2016 , Pages 228-234 ; 07496036 (ISSN) ; Zare, M ; Hosseini Hashemi, Sh ; Shokrollahi, H ; Sharif University of Technology
Academic Press
Abstract
A new study is conducted with the aid of molecular dynamics (MD) simulation to investigate the effect of shear modulus value of the interlayer van der Waals (vdWs) interactions on free vibration of cantilever multi-layer graphene nanoribbons (MLGNRs). The corresponding calibrated nonlocal parameters of the nonlocal model are obtained accordingly. The vdWs interactions are treated as the cores between every two adjacent graphene layers and their equivalent shear modulus is calculated using MD simulation. The obtained resonant frequencies via the nonlocal sandwich model are compared to the MD simulation results to calibrate the nonlocal parameter. Results reveal a strong conclusion that the...