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Hi all I am using LAMMPS to model tensile test of graphene.I try to model graphene sheet and thermodynamics settings similar to previous work. I am using periodic boundary condition in plane and...
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I'm using NVT ensemble to equilibrate the graphene nano sheet. after that I think I must compute vacf for atoms and perform FFT transformation to find natural frequency,Is this true...
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I am modeling a graphene nanosheet under compression loading,so I am using "FIX NVT" for equilibration and then applying load with "SET FORCE" in 3 steps and after each step,running for some time...
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