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  • iprPy 0.10.2 documentation

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  • PotentialProperties
  • calculation_E_vs_r_scan
  • calculation_crystal_space_group
  • calculation_diatom_scan
  • calculation_dislocation_SDVPN
  • calculation_dislocation_monopole
  • calculation_dislocation_periodic_array
  • calculation_elastic_constants_static
  • calculation_isolated_atom
  • calculation_relax_box
  • calculation_relax_dynamic
  • calculation_relax_static
  • calculation_stacking_fault_map_2D
  • calculation_stacking_fault_static
  • calculation_surface_energy_static
  • crystal_prototype
  • dislocation
  • free_surface
  • point_defect
  • potential_LAMMPS
  • potential_openKIM_LAMMPS
  • potential_users_LAMMPS
  • reference_crystal
  • relaxed_crystal
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