phonoLAMMPS
stable

Table of contents

  • 1. Introduction
  • 2. Requirements
  • 3. Installation
  • 4. Get started
  • 5. Advanced topics
  • 6. API
  • 7. Troubleshooting
phonoLAMMPS
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Index

C | G | O | P | W

C

  • cell_angles() (phonolammps.PhonoGromacs method)
  • cell_lengths() (phonolammps.PhonoGromacs method)

G

  • get_force_constants() (phonolammps.PhonoBase method)
  • get_forces() (phonolammps.PhonoGromacs method)
    • (phonolammps.PhonoTinker method)
    • (phonolammps.Phonolammps method)
  • get_path_using_seek_path() (phonolammps.PhonoBase method)
  • get_phonopy_phonon() (phonolammps.PhonoBase method)
  • get_supercell_matrix() (phonolammps.PhonoBase method)
  • get_unitcell() (phonolammps.PhonoBase method)
  • get_units() (phonolammps.Phonolammps method)

O

  • optimize_unitcell() (phonolammps.Phonolammps method)

P

  • PhonoBase (class in phonolammps)
  • PhonoGromacs (class in phonolammps)
  • Phonolammps (class in phonolammps)
  • phonolammps (module)
  • PhonoTinker (class in phonolammps)
  • plot_phonon_dispersion_bands() (phonolammps.PhonoBase method)

W

  • write_force_constants() (phonolammps.PhonoBase method)
  • write_force_sets() (phonolammps.PhonoBase method)
  • write_unitcell_POSCAR() (phonolammps.PhonoBase method)

© Copyright 2019, Abel Carreras Revision 6a29fdb4.

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