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Important note: your simulations have to be in your Downloads folder. LAMMPS is a classical molecular dynamics code that models an ensemble of particles in a liquid, solid, or gaseous state. It can model atomic, polymeric, biological, metallic, granular, and coarse-grained systems using a variety of force fields and boundary conditions. The typical workflow when developing LAMMPS scripts includes working with several programs. A text editor is needed to modify the scripts, the terminal to run the simulation, and programs like VMD or Ovito to visualize the system over time. If physical quantit…

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