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Reference ABCMolecule ABCMolecule.to_lammps

ABCMolecule.to_lammps

to_lammps(filename)

Write ABCMolecule object to .lammps file.

Parameters:

  • filename (str) –

    Name of .lammps file that will be created.

Returns:

  • .lammps file containing ABCMolecule object.