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lammps

LAMMPS (Large-scale Atomic/Molecular Massively Parallel Simulator) is a molecular dynamics simulation software package. It can be used to model various materials and systems, such as liquids, solids, polymers, biomolecules, and complex fluids. LAMMPS is designed for parallel computing and can run on a wide range of platforms, including desktops, clusters, supercomputers, and GPUs. Its capabilities include various force fields, boundary conditions, time integration algorithms, and analysis tools. LAMMPS is open-source software released under the GPL license.

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