Python Module Index a a aiida_quantumespresso aiida_quantumespresso.calculations aiida_quantumespresso.calculations.base aiida_quantumespresso.calculations.cp aiida_quantumespresso.calculations.dos aiida_quantumespresso.calculations.epw aiida_quantumespresso.calculations.functions aiida_quantumespresso.calculations.functions.create_kpoints_from_distance aiida_quantumespresso.calculations.functions.create_magnetic_configuration aiida_quantumespresso.calculations.functions.merge_ph_outputs aiida_quantumespresso.calculations.functions.seekpath_structure_analysis aiida_quantumespresso.calculations.functions.xspectra aiida_quantumespresso.calculations.functions.xspectra.get_powder_spectrum aiida_quantumespresso.calculations.functions.xspectra.get_spectra_by_element aiida_quantumespresso.calculations.functions.xspectra.get_xps_spectra aiida_quantumespresso.calculations.functions.xspectra.merge_spectra aiida_quantumespresso.calculations.helpers aiida_quantumespresso.calculations.matdyn aiida_quantumespresso.calculations.namelists aiida_quantumespresso.calculations.neb aiida_quantumespresso.calculations.open_grid aiida_quantumespresso.calculations.ph aiida_quantumespresso.calculations.pp aiida_quantumespresso.calculations.projwfc aiida_quantumespresso.calculations.pw aiida_quantumespresso.calculations.pw2gw aiida_quantumespresso.calculations.pw2wannier90 aiida_quantumespresso.calculations.pwimmigrant aiida_quantumespresso.calculations.q2r aiida_quantumespresso.calculations.xspectra aiida_quantumespresso.common aiida_quantumespresso.common.hubbard aiida_quantumespresso.common.types aiida_quantumespresso.data aiida_quantumespresso.data.force_constants aiida_quantumespresso.data.hubbard_structure aiida_quantumespresso.parsers aiida_quantumespresso.parsers.base aiida_quantumespresso.parsers.cp aiida_quantumespresso.parsers.dos aiida_quantumespresso.parsers.matdyn aiida_quantumespresso.parsers.neb aiida_quantumespresso.parsers.open_grid aiida_quantumespresso.parsers.parse_raw aiida_quantumespresso.parsers.parse_raw.base aiida_quantumespresso.parsers.parse_raw.cp aiida_quantumespresso.parsers.parse_raw.neb aiida_quantumespresso.parsers.parse_raw.ph aiida_quantumespresso.parsers.parse_raw.pw aiida_quantumespresso.parsers.parse_xml aiida_quantumespresso.parsers.parse_xml.cp aiida_quantumespresso.parsers.parse_xml.cp.legacy aiida_quantumespresso.parsers.parse_xml.exceptions aiida_quantumespresso.parsers.parse_xml.legacy aiida_quantumespresso.parsers.parse_xml.parse aiida_quantumespresso.parsers.parse_xml.pw aiida_quantumespresso.parsers.parse_xml.pw.legacy aiida_quantumespresso.parsers.parse_xml.pw.parse aiida_quantumespresso.parsers.parse_xml.versions aiida_quantumespresso.parsers.ph aiida_quantumespresso.parsers.pp aiida_quantumespresso.parsers.projwfc aiida_quantumespresso.parsers.pw aiida_quantumespresso.parsers.pw2gw aiida_quantumespresso.parsers.pw2wannier90 aiida_quantumespresso.parsers.q2r aiida_quantumespresso.parsers.xspectra aiida_quantumespresso.tools aiida_quantumespresso.tools.base aiida_quantumespresso.tools.calculations aiida_quantumespresso.tools.calculations.pw aiida_quantumespresso.tools.cpinputparser aiida_quantumespresso.tools.data aiida_quantumespresso.tools.data.orbital aiida_quantumespresso.tools.data.orbital.noncollinearhydrogen aiida_quantumespresso.tools.data.orbital.spinorbithydrogen aiida_quantumespresso.tools.pwinputparser aiida_quantumespresso.utils aiida_quantumespresso.utils.bands aiida_quantumespresso.utils.convert aiida_quantumespresso.utils.defaults aiida_quantumespresso.utils.defaults.calculation aiida_quantumespresso.utils.hubbard aiida_quantumespresso.utils.linalg aiida_quantumespresso.utils.mapping aiida_quantumespresso.utils.protocols aiida_quantumespresso.utils.protocols.pw aiida_quantumespresso.utils.resources aiida_quantumespresso.utils.restart aiida_quantumespresso.utils.validation aiida_quantumespresso.utils.validation.trajectory aiida_quantumespresso.workflows aiida_quantumespresso.workflows.functions aiida_quantumespresso.workflows.functions.create_kpoints_from_distance aiida_quantumespresso.workflows.functions.get_marked_structures aiida_quantumespresso.workflows.functions.get_xspectra_structures aiida_quantumespresso.workflows.functions.seekpath_structure_analysis aiida_quantumespresso.workflows.matdyn aiida_quantumespresso.workflows.matdyn.base aiida_quantumespresso.workflows.pdos aiida_quantumespresso.workflows.ph aiida_quantumespresso.workflows.ph.base aiida_quantumespresso.workflows.protocols aiida_quantumespresso.workflows.protocols.ph aiida_quantumespresso.workflows.protocols.pw aiida_quantumespresso.workflows.protocols.utils aiida_quantumespresso.workflows.pw aiida_quantumespresso.workflows.pw.bands aiida_quantumespresso.workflows.pw.base aiida_quantumespresso.workflows.pw.relax aiida_quantumespresso.workflows.q2r aiida_quantumespresso.workflows.q2r.base aiida_quantumespresso.workflows.xps aiida_quantumespresso.workflows.xspectra aiida_quantumespresso.workflows.xspectra.base aiida_quantumespresso.workflows.xspectra.core aiida_quantumespresso.workflows.xspectra.crystal