All modules for which code is available

  • src.bond_angles
  • src.bond_lengths
  • src.data_section
  • src.data_section_with_inputs
  • src.dipole_moments
  • src.final_geom
  • src.homo_lumo_energies
  • src.initial_geom
  • src.input_reader
  • src.loewdin_charge_sums
  • src.loewdin_charges
  • src.mulliken_charge_sums
  • src.mulliken_charges
  • src.orca_out_to_json
  • src.polarizability
  • src.structure_data
  • src.structure_data_builder

orca-data-extraction

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