pyiron\_atomistics.vasp.vaspsol.VaspSol
=======================================

.. currentmodule:: pyiron_atomistics.vasp.vaspsol

.. autoclass:: VaspSol
   :members:
   :show-inheritance:
   :inherited-members:

   
   .. automethod:: __init__

   
   .. rubric:: Methods

   .. autosummary::
   
      ~VaspSol.__init__
      ~VaspSol.animate_structure
      ~VaspSol.animate_structures
      ~VaspSol.append_charge_density
      ~VaspSol.append_wave_function
      ~VaspSol.calc_md
      ~VaspSol.calc_minimize
      ~VaspSol.calc_static
      ~VaspSol.check_if_job_exists
      ~VaspSol.check_setup
      ~VaspSol.cleanup
      ~VaspSol.clear_job
      ~VaspSol.collect_errors
      ~VaspSol.collect_logfiles
      ~VaspSol.collect_output
      ~VaspSol.collect_structures
      ~VaspSol.collect_warnings
      ~VaspSol.compress
      ~VaspSol.continue_with_final_structure
      ~VaspSol.continue_with_restart_files
      ~VaspSol.convergence_check
      ~VaspSol.copy
      ~VaspSol.copy_file_to_working_directory
      ~VaspSol.copy_hamiltonian
      ~VaspSol.copy_template
      ~VaspSol.copy_to
      ~VaspSol.create_job
      ~VaspSol.create_pipeline
      ~VaspSol.db_entry
      ~VaspSol.decompress
      ~VaspSol.drop_status_to_aborted
      ~VaspSol.from_dict
      ~VaspSol.from_directory
      ~VaspSol.from_hdf
      ~VaspSol.from_hdf_args
      ~VaspSol.get
      ~VaspSol.get_bader_charges
      ~VaspSol.get_bader_volumes
      ~VaspSol.get_calculate_function
      ~VaspSol.get_charge_density
      ~VaspSol.get_density_of_states
      ~VaspSol.get_eddrmm_handling
      ~VaspSol.get_electronic_structure
      ~VaspSol.get_electrostatic_potential
      ~VaspSol.get_encut
      ~VaspSol.get_final_structure
      ~VaspSol.get_final_structure_from_file
      ~VaspSol.get_from_table
      ~VaspSol.get_icharg_value
      ~VaspSol.get_input_parameter_dict
      ~VaspSol.get_job_id
      ~VaspSol.get_k_mesh_by_cell
      ~VaspSol.get_kpoints
      ~VaspSol.get_magnetic_moments
      ~VaspSol.get_neighbors
      ~VaspSol.get_neighbors_snapshots
      ~VaspSol.get_nelect
      ~VaspSol.get_output_parameter_dict
      ~VaspSol.get_rwigs
      ~VaspSol.get_structure
      ~VaspSol.get_valence_and_total_charge_density
      ~VaspSol.get_workdir_file
      ~VaspSol.gui
      ~VaspSol.inspect
      ~VaspSol.instantiate
      ~VaspSol.interactive_atom_spin_constraints_getter
      ~VaspSol.interactive_atom_spins_getter
      ~VaspSol.interactive_cell_organizer
      ~VaspSol.interactive_cells_getter
      ~VaspSol.interactive_cells_setter
      ~VaspSol.interactive_close
      ~VaspSol.interactive_collect
      ~VaspSol.interactive_computation_time_getter
      ~VaspSol.interactive_energy_pot_getter
      ~VaspSol.interactive_energy_tot_getter
      ~VaspSol.interactive_fetch
      ~VaspSol.interactive_flush
      ~VaspSol.interactive_forces_getter
      ~VaspSol.interactive_index_organizer
      ~VaspSol.interactive_indices_getter
      ~VaspSol.interactive_indices_setter
      ~VaspSol.interactive_initialize_interface
      ~VaspSol.interactive_is_activated
      ~VaspSol.interactive_magmom_organizer
      ~VaspSol.interactive_magnetic_forces_getter
      ~VaspSol.interactive_open
      ~VaspSol.interactive_positions_getter
      ~VaspSol.interactive_positions_organizer
      ~VaspSol.interactive_positions_setter
      ~VaspSol.interactive_prepare
      ~VaspSol.interactive_pressures_getter
      ~VaspSol.interactive_spin_constraints_getter
      ~VaspSol.interactive_spin_constraints_setter
      ~VaspSol.interactive_spins_getter
      ~VaspSol.interactive_steps_getter
      ~VaspSol.interactive_store_in_cache
      ~VaspSol.interactive_stress_getter
      ~VaspSol.interactive_structure_setter
      ~VaspSol.interactive_temperatures_getter
      ~VaspSol.interactive_time_getter
      ~VaspSol.interactive_unwrapped_positions_getter
      ~VaspSol.interactive_volume_getter
      ~VaspSol.is_compressed
      ~VaspSol.is_master_id
      ~VaspSol.is_self_archived
      ~VaspSol.iter_structures
      ~VaspSol.job_file_name
      ~VaspSol.kill
      ~VaspSol.list_all
      ~VaspSol.list_childs
      ~VaspSol.list_files
      ~VaspSol.list_groups
      ~VaspSol.list_nodes
      ~VaspSol.list_potentials
      ~VaspSol.load
      ~VaspSol.map
      ~VaspSol.modify_kpoints
      ~VaspSol.move_to
      ~VaspSol.nbands_convergence_check
      ~VaspSol.refresh_job_status
      ~VaspSol.relocate_hdf5
      ~VaspSol.remove
      ~VaspSol.remove_and_reset_id
      ~VaspSol.remove_child
      ~VaspSol.rename
      ~VaspSol.reset_job_id
      ~VaspSol.reset_output
      ~VaspSol.restart
      ~VaspSol.restart_for_band_structure_calculations
      ~VaspSol.restart_from_charge_density
      ~VaspSol.restart_from_wave_and_charge
      ~VaspSol.restart_from_wave_functions
      ~VaspSol.run
      ~VaspSol.run_if_interactive
      ~VaspSol.run_if_interactive_non_modal
      ~VaspSol.run_if_modal
      ~VaspSol.run_if_refresh
      ~VaspSol.run_if_scheduler
      ~VaspSol.run_static
      ~VaspSol.run_time_to_db
      ~VaspSol.save
      ~VaspSol.save_output
      ~VaspSol.self_archive
      ~VaspSol.self_unarchive
      ~VaspSol.set_algorithm
      ~VaspSol.set_convergence_precision
      ~VaspSol.set_coulomb_interactions
      ~VaspSol.set_dipole_correction
      ~VaspSol.set_eddrmm_handling
      ~VaspSol.set_electric_field
      ~VaspSol.set_empty_states
      ~VaspSol.set_encut
      ~VaspSol.set_exchange_correlation_functional
      ~VaspSol.set_fft_mesh
      ~VaspSol.set_for_band_structure_calc
      ~VaspSol.set_input_to_read_only
      ~VaspSol.set_kpoints
      ~VaspSol.set_mixing_parameters
      ~VaspSol.set_occupancy_smearing
      ~VaspSol.set_rwigs
      ~VaspSol.set_spin_constraint
      ~VaspSol.show_hdf
      ~VaspSol.signal_intercept
      ~VaspSol.species_from_hdf
      ~VaspSol.stop_calculation
      ~VaspSol.store_structure
      ~VaspSol.suspend
      ~VaspSol.to_dict
      ~VaspSol.to_hdf
      ~VaspSol.to_object
      ~VaspSol.trajectory
      ~VaspSol.transfer_from_remote
      ~VaspSol.transform_structures
      ~VaspSol.update_master
      ~VaspSol.validate_ready_to_run
      ~VaspSol.view_structure
      ~VaspSol.write_input
      ~VaspSol.write_magmoms
      ~VaspSol.write_traj
   
   

   
   
   .. rubric:: Attributes

   .. autosummary::
   
      ~VaspSol.calculate_kwargs
      ~VaspSol.child_ids
      ~VaspSol.content
      ~VaspSol.current_structure
      ~VaspSol.database_entry
      ~VaspSol.encut
      ~VaspSol.exchange_correlation_functional
      ~VaspSol.exclude_groups_hdf
      ~VaspSol.exclude_nodes_hdf
      ~VaspSol.executable
      ~VaspSol.executor_type
      ~VaspSol.files
      ~VaspSol.files_to_compress
      ~VaspSol.files_to_remove
      ~VaspSol.fix_spin_constraint
      ~VaspSol.fix_symmetry
      ~VaspSol.id
      ~VaspSol.initial_structure
      ~VaspSol.interactive_enforce_structure_reset
      ~VaspSol.interactive_flush_frequency
      ~VaspSol.interactive_write_frequency
      ~VaspSol.job_id
      ~VaspSol.job_info_str
      ~VaspSol.job_name
      ~VaspSol.job_type
      ~VaspSol.k_mesh_center_shift
      ~VaspSol.k_mesh_spacing
      ~VaspSol.kpoint_mesh
      ~VaspSol.logger
      ~VaspSol.master_id
      ~VaspSol.name
      ~VaspSol.number_of_structures
      ~VaspSol.parent_id
      ~VaspSol.path
      ~VaspSol.plane_wave_cutoff
      ~VaspSol.potential
      ~VaspSol.potential_available
      ~VaspSol.potential_list
      ~VaspSol.potential_view
      ~VaspSol.project
      ~VaspSol.project_hdf5
      ~VaspSol.publication
      ~VaspSol.queue_id
      ~VaspSol.reduce_kpoint_symmetry
      ~VaspSol.restart_file_dict
      ~VaspSol.restart_file_list
      ~VaspSol.server
      ~VaspSol.sorted_indices
      ~VaspSol.spin_constraints
      ~VaspSol.status
      ~VaspSol.structure
      ~VaspSol.version
      ~VaspSol.working_directory
      ~VaspSol.write_charge_density
      ~VaspSol.write_electrostatic_potential
      ~VaspSol.write_resolved_dos
      ~VaspSol.write_wave_funct
      ~VaspSol.xc