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Performing Uniaxial Tensile Tests of Graphene in LAMMPS

Nuwan Dewapriya's picture

I would like to share the codes required to perform an end-to-end molecular dynamics simulation, which will be useful to the novice researchers in the filed of atomistic simulations. I focus on simulating uniaxial tensile tests of a graphene sample in the LAMMPS molecular dynamics simulator, and I have attached two MATLAB scripts to create the input files for LAMMPS and to extract data from the LAMMPS output file. More details about the simulation and codes are given here.

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