pwtools.crys.Structure
======================

.. currentmodule:: pwtools.crys

.. autoclass:: Structure
   :no-members:
   :no-inherited-members:
   :no-special-members:

  
  

   .. automethod:: __init__

  

   .. rubric:: Methods

   .. autosummary::
      :toctree:
   
      ~Structure.apply_units
      ~Structure.assert_attr
      ~Structure.assert_attr_lst
      ~Structure.assert_set_attr
      ~Structure.assert_set_attr_lst
      ~Structure.check_set_attr
      ~Structure.check_set_attr_lst
      ~Structure.compress
      ~Structure.copy
      ~Structure.dump
      ~Structure.get_ase_atoms
      ~Structure.get_cell
      ~Structure.get_coords
      ~Structure.get_coords_frac
      ~Structure.get_cryst_const
      ~Structure.get_ekin
      ~Structure.get_etot
      ~Structure.get_fake_ase_atoms
      ~Structure.get_forces
      ~Structure.get_mass
      ~Structure.get_mass_unique
      ~Structure.get_natoms
      ~Structure.get_nspecies
      ~Structure.get_nstep
      ~Structure.get_ntypat
      ~Structure.get_order
      ~Structure.get_pressure
      ~Structure.get_return_attr
      ~Structure.get_spglib
      ~Structure.get_stress
      ~Structure.get_symbols
      ~Structure.get_symbols_unique
      ~Structure.get_temperature
      ~Structure.get_time
      ~Structure.get_timestep
      ~Structure.get_traj
      ~Structure.get_typat
      ~Structure.get_velocity
      ~Structure.get_volume
      ~Structure.get_znucl
      ~Structure.get_znucl_unique
      ~Structure.init_attr_lst
      ~Structure.is_set_attr
      ~Structure.is_set_attr_lst
      ~Structure.load
      ~Structure.raw_return
      ~Structure.raw_slice_get
      ~Structure.set_all
      ~Structure.set_attr_lst
      ~Structure.try_set_attr
      ~Structure.try_set_attr_lst
      ~Structure.update_units
   
  
  


  
  
   .. rubric:: Attributes

   .. autosummary::
      :toctree:
   
      ~Structure.is_struct
      ~Structure.is_traj
      ~Structure.timeaxis