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Drude pair polarizability in LAMMPS

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lammps-drude

This is a unofficial user package of the LAMMPS simulation software for enabling the simulation of polarizable atoms using Drude oscillators.

The current version has been tested successfully with the 08 July 2015 LAMMPS version.

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Drude pair polarizability in LAMMPS

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  • C++ 78.2%
  • Python 21.2%
  • Shell 0.6%