README.rst
setup.py
/Users/leopold/Personal/Postdoc-MARVEL/repos/aiida/aiida_rmq/bin/runaiida
/Users/leopold/Personal/Postdoc-MARVEL/repos/aiida/aiida_rmq/bin/verdi
aiida/__init__.py
aiida/optional.py
aiida/settings.py
aiida/backends/__init__.py
aiida/backends/profile.py
aiida/backends/settings.py
aiida/backends/utils.py
aiida/backends/djsite/__init__.py
aiida/backends/djsite/cmdline.py
aiida/backends/djsite/globalsettings.py
aiida/backends/djsite/manage.py
aiida/backends/djsite/utils.py
aiida/backends/djsite/db/__init__.py
aiida/backends/djsite/db/admin.py
aiida/backends/djsite/db/models.py
aiida/backends/djsite/db/testbase.py
aiida/backends/djsite/db/tests.py
aiida/backends/djsite/db/views.py
aiida/backends/djsite/db/management/__init__.py
aiida/backends/djsite/db/migrations/0001_initial.py
aiida/backends/djsite/db/migrations/0002_db_state_change.py
aiida/backends/djsite/db/migrations/0003_add_link_type.py
aiida/backends/djsite/db/migrations/__init__.py
aiida/backends/djsite/db/subtests/__init__.py
aiida/backends/djsite/db/subtests/backup_script.py
aiida/backends/djsite/db/subtests/backup_setup_script.py
aiida/backends/djsite/db/subtests/calculation_node.py
aiida/backends/djsite/db/subtests/codtools.py
aiida/backends/djsite/db/subtests/dataclasses.py
aiida/backends/djsite/db/subtests/dbimporters.py
aiida/backends/djsite/db/subtests/export_and_import.py
aiida/backends/djsite/db/subtests/generic.py
aiida/backends/djsite/db/subtests/migrations.py
aiida/backends/djsite/db/subtests/nodes.py
aiida/backends/djsite/db/subtests/nwchem.py
aiida/backends/djsite/db/subtests/parsers.py
aiida/backends/djsite/db/subtests/pwinputparser.py
aiida/backends/djsite/db/subtests/quantumespressopw.py
aiida/backends/djsite/db/subtests/quantumespressopwimmigrant.py
aiida/backends/djsite/db/subtests/query.py
aiida/backends/djsite/db/subtests/tcodexporter.py
aiida/backends/djsite/db/subtests/workflows.py
aiida/backends/djsite/db/subtests/parser_tests/__init__.py
aiida/backends/djsite/db/subtests/parser_tests/test_nwchem_nwcpymatgen_1/__init__.py
aiida/backends/djsite/settings/__init__.py
aiida/backends/djsite/settings/settings.py
aiida/backends/djsite/settings/settings_profile.py
aiida/backends/djsite/settings/urls.py
aiida/backends/djsite/settings/wsgi.py
aiida/backends/querybuild/__init__.py
aiida/backends/querybuild/dummy_model.py
aiida/backends/querybuild/querybuilder_base.py
aiida/backends/querybuild/querybuilder_django.py
aiida/backends/querybuild/querybuilder_sa.py
aiida/backends/querybuild/sa_init.py
aiida/backends/sqlalchemy/__init__.py
aiida/backends/sqlalchemy/cmdline.py
aiida/backends/sqlalchemy/globalsettings.py
aiida/backends/sqlalchemy/transition_06dj_to_07sqla.py
aiida/backends/sqlalchemy/utils.py
aiida/backends/sqlalchemy/models/__init__.py
aiida/backends/sqlalchemy/models/authinfo.py
aiida/backends/sqlalchemy/models/base.py
aiida/backends/sqlalchemy/models/comment.py
aiida/backends/sqlalchemy/models/computer.py
aiida/backends/sqlalchemy/models/group.py
aiida/backends/sqlalchemy/models/lock.py
aiida/backends/sqlalchemy/models/log.py
aiida/backends/sqlalchemy/models/node.py
aiida/backends/sqlalchemy/models/settings.py
aiida/backends/sqlalchemy/models/user.py
aiida/backends/sqlalchemy/models/utils.py
aiida/backends/sqlalchemy/models/workflow.py
aiida/backends/sqlalchemy/tests/__init__.py
aiida/backends/sqlalchemy/tests/base.py
aiida/backends/sqlalchemy/tests/dataclasses.py
aiida/backends/sqlalchemy/tests/generic.py
aiida/backends/sqlalchemy/tests/nodes.py
aiida/cmdline/__init__.py
aiida/cmdline/baseclass.py
aiida/cmdline/common.py
aiida/cmdline/verdilib.py
aiida/cmdline/commands/__init__.py
aiida/cmdline/commands/calculation.py
aiida/cmdline/commands/code.py
aiida/cmdline/commands/comment.py
aiida/cmdline/commands/computer.py
aiida/cmdline/commands/daemon.py
aiida/cmdline/commands/data.py
aiida/cmdline/commands/devel.py
aiida/cmdline/commands/exportfile.py
aiida/cmdline/commands/graph.py
aiida/cmdline/commands/group.py
aiida/cmdline/commands/importfile.py
aiida/cmdline/commands/node.py
aiida/cmdline/commands/profile.py
aiida/cmdline/commands/shell.py
aiida/cmdline/commands/user.py
aiida/cmdline/commands/workflow.py
aiida/cmdline/commands/workflow2.py
aiida/common/__init__.py
aiida/common/constants.py
aiida/common/datastructures.py
aiida/common/deserialization.py
aiida/common/example_helpers.py
aiida/common/exceptions.py
aiida/common/extendeddicts.py
aiida/common/folders.py
aiida/common/hashing.py
aiida/common/lang.py
aiida/common/links.py
aiida/common/pluginloader.py
aiida/common/setup.py
aiida/common/test_extendeddicts.py
aiida/common/test_folders.py
aiida/common/test_utils.py
aiida/common/utils.py
aiida/common/additions/__init__.py
aiida/common/additions/migration.py
aiida/common/additions/migration_06dj_to_07dj.py
aiida/common/additions/test_migration.py
aiida/common/additions/backup_script/__init__.py
aiida/common/additions/backup_script/backup.py
aiida/common/additions/backup_script/backup_setup.py
aiida/common/ipython/__init__.py
aiida/common/ipython/ipython_magics.py
aiida/daemon/__init__.py
aiida/daemon/execmanager.py
aiida/daemon/tasks.py
aiida/daemon/timestamps.py
aiida/daemon/workflowmanager.py
aiida/orm/__init__.py
aiida/orm/autogroup.py
aiida/orm/code.py
aiida/orm/computer.py
aiida/orm/group.py
aiida/orm/importexport.py
aiida/orm/lock.py
aiida/orm/mixins.py
aiida/orm/node.py
aiida/orm/querybuilder.py
aiida/orm/querytool.py
aiida/orm/test.py
aiida/orm/user.py
aiida/orm/utils.py
aiida/orm/workflow.py
aiida/orm/calculation/__init__.py
aiida/orm/calculation/inline.py
aiida/orm/calculation/process.py
aiida/orm/calculation/job/__init__.py
aiida/orm/calculation/job/codtools/__init__.py
aiida/orm/calculation/job/codtools/cifcellcontents.py
aiida/orm/calculation/job/codtools/cifcodcheck.py
aiida/orm/calculation/job/codtools/cifcoddeposit.py
aiida/orm/calculation/job/codtools/cifcodnumbers.py
aiida/orm/calculation/job/codtools/ciffilter.py
aiida/orm/calculation/job/codtools/cifsplitprimitive.py
aiida/orm/calculation/job/nwchem/__init__.py
aiida/orm/calculation/job/nwchem/basic.py
aiida/orm/calculation/job/nwchem/nwcpymatgen.py
aiida/orm/calculation/job/quantumespresso/__init__.py
aiida/orm/calculation/job/quantumespresso/cp.py
aiida/orm/calculation/job/quantumespresso/pw.py
aiida/orm/calculation/job/quantumespresso/pwimmigrant.py
aiida/orm/calculation/job/quantumespresso/helpers/__init__.py
aiida/orm/calculation/job/simpleplugins/__init__.py
aiida/orm/calculation/job/simpleplugins/templatereplacer.py
aiida/orm/data/__init__.py
aiida/orm/data/cif.py
aiida/orm/data/error.py
aiida/orm/data/folder.py
aiida/orm/data/parameter.py
aiida/orm/data/remote.py
aiida/orm/data/simple.py
aiida/orm/data/singlefile.py
aiida/orm/data/structure.py
aiida/orm/data/upf.py
aiida/orm/data/array/__init__.py
aiida/orm/data/array/bands.py
aiida/orm/data/array/kpoints.py
aiida/orm/data/array/trajectory.py
aiida/orm/implementation/__init__.py
aiida/orm/implementation/calculation.py
aiida/orm/implementation/django/__init__.py
aiida/orm/implementation/django/code.py
aiida/orm/implementation/django/comment.py
aiida/orm/implementation/django/computer.py
aiida/orm/implementation/django/group.py
aiida/orm/implementation/django/lock.py
aiida/orm/implementation/django/node.py
aiida/orm/implementation/django/querytool.py
aiida/orm/implementation/django/user.py
aiida/orm/implementation/django/utils.py
aiida/orm/implementation/django/workflow.py
aiida/orm/implementation/django/calculation/__init__.py
aiida/orm/implementation/django/calculation/inline.py
aiida/orm/implementation/django/calculation/job/__init__.py
aiida/orm/implementation/general/__init__.py
aiida/orm/implementation/general/code.py
aiida/orm/implementation/general/comment.py
aiida/orm/implementation/general/computer.py
aiida/orm/implementation/general/group.py
aiida/orm/implementation/general/lock.py
aiida/orm/implementation/general/node.py
aiida/orm/implementation/general/querytool.py
aiida/orm/implementation/general/user.py
aiida/orm/implementation/general/workflow.py
aiida/orm/implementation/general/calculation/__init__.py
aiida/orm/implementation/general/calculation/inline.py
aiida/orm/implementation/general/calculation/process.py
aiida/orm/implementation/general/calculation/job/__init__.py
aiida/orm/implementation/sqlalchemy/__init__.py
aiida/orm/implementation/sqlalchemy/code.py
aiida/orm/implementation/sqlalchemy/comment.py
aiida/orm/implementation/sqlalchemy/computer.py
aiida/orm/implementation/sqlalchemy/group.py
aiida/orm/implementation/sqlalchemy/lock.py
aiida/orm/implementation/sqlalchemy/node.py
aiida/orm/implementation/sqlalchemy/querytool.py
aiida/orm/implementation/sqlalchemy/user.py
aiida/orm/implementation/sqlalchemy/utils.py
aiida/orm/implementation/sqlalchemy/workflow.py
aiida/orm/implementation/sqlalchemy/calculation/__init__.py
aiida/orm/implementation/sqlalchemy/calculation/inline.py
aiida/orm/implementation/sqlalchemy/calculation/job/__init__.py
aiida/orm/workflows2/__init__.py
aiida/parsers/__init__.py
aiida/parsers/exceptions.py
aiida/parsers/parser.py
aiida/parsers/plugins/__init__.py
aiida/parsers/plugins/codtools/__init__.py
aiida/parsers/plugins/codtools/baseclass.py
aiida/parsers/plugins/codtools/cifcellcontents.py
aiida/parsers/plugins/codtools/cifcodcheck.py
aiida/parsers/plugins/codtools/cifcoddeposit.py
aiida/parsers/plugins/codtools/cifcodnumbers.py
aiida/parsers/plugins/codtools/ciffilter.py
aiida/parsers/plugins/codtools/cifsplitprimitive.py
aiida/parsers/plugins/nwchem/__init__.py
aiida/parsers/plugins/nwchem/basic.py
aiida/parsers/plugins/nwchem/nwcpymatgen.py
aiida/parsers/plugins/quantumespresso/__init__.py
aiida/parsers/plugins/quantumespresso/basic_raw_parser_cp.py
aiida/parsers/plugins/quantumespresso/basic_raw_parser_pw.py
aiida/parsers/plugins/quantumespresso/basicpw.py
aiida/parsers/plugins/quantumespresso/constants.py
aiida/parsers/plugins/quantumespresso/cp.py
aiida/scheduler/__init__.py
aiida/scheduler/datastructures.py
aiida/scheduler/test_datastructures.py
aiida/scheduler/plugins/__init__.py
aiida/scheduler/plugins/direct.py
aiida/scheduler/plugins/pbsbaseclasses.py
aiida/scheduler/plugins/pbspro.py
aiida/scheduler/plugins/sge.py
aiida/scheduler/plugins/slurm.py
aiida/scheduler/plugins/test_pbspro.py
aiida/scheduler/plugins/test_sge.py
aiida/scheduler/plugins/test_slurm.py
aiida/scheduler/plugins/test_torque.py
aiida/scheduler/plugins/torque.py
aiida/tools/__init__.py
aiida/tools/codespecific/__init__.py
aiida/tools/codespecific/quantumespresso/__init__.py
aiida/tools/codespecific/quantumespresso/pwinputparser.py
aiida/tools/dbexporters/__init__.py
aiida/tools/dbexporters/tcod.py
aiida/tools/dbexporters/tcod_plugins/__init__.py
aiida/tools/dbexporters/tcod_plugins/cp.py
aiida/tools/dbexporters/tcod_plugins/nwcpymatgen.py
aiida/tools/dbexporters/tcod_plugins/pw.py
aiida/tools/dbimporters/__init__.py
aiida/tools/dbimporters/baseclasses.py
aiida/tools/dbimporters/plugins/__init__.py
aiida/tools/dbimporters/plugins/cod.py
aiida/tools/dbimporters/plugins/icsd.py
aiida/tools/dbimporters/plugins/mpod.py
aiida/tools/dbimporters/plugins/nninc.py
aiida/tools/dbimporters/plugins/oqmd.py
aiida/tools/dbimporters/plugins/pcod.py
aiida/tools/dbimporters/plugins/tcod.py
aiida/transport/__init__.py
aiida/transport/plugins/__init__.py
aiida/transport/plugins/local.py
aiida/transport/plugins/ssh.py
aiida/transport/plugins/test_all_plugins.py
aiida/transport/plugins/test_local.py
aiida/transport/plugins/test_ssh.py
aiida/tutorial/__init__.py
aiida/tutorial/simple_wf.py
aiida/utils/__init__.py
aiida/utils/calculation.py
aiida/utils/email.py
aiida/utils/logger.py
aiida/utils/timezone.py
aiida/workflows/__init__.py
aiida/workflows/test.py
aiida/workflows/wf_XTiO3.py
aiida/workflows/wf_demo.py
aiida/workflows/user/__init__.py
aiida/workflows2/__init__.py
aiida/workflows2/daemon.py
aiida/workflows2/db_types.py
aiida/workflows2/defaults.py
aiida/workflows2/execution_engine.py
aiida/workflows2/fragmented_wf.py
aiida/workflows2/process.py
aiida/workflows2/process_factory.py
aiida/workflows2/process_registry.py
aiida/workflows2/run.py
aiida/workflows2/util.py
aiida/workflows2/wf.py
aiida/workflows2/workflow.py
aiida/workflows2/legacy/__init__.py
aiida/workflows2/legacy/job_process.py
aiida/workflows2/legacy/wait_on.py
aiida/workflows2/specs/__init__.py
aiida/workflows2/specs/examples/__init__.py
aiida/workflows2/specs/examples/wf_example.py
aiida/workflows2/specs/examples/wftest.py
aiida_core.egg-info/PKG-INFO
aiida_core.egg-info/SOURCES.txt
aiida_core.egg-info/dependency_links.txt
aiida_core.egg-info/requires.txt
aiida_core.egg-info/top_level.txt
benchmarks/__init__.py
benchmarks/dj.py
benchmarks/json_benchmark.py
benchmarks/normalize_type.py
benchmarks/sqla.py
examples/__init__.py
examples/workflows2/__init__.py
examples/workflows2/async_workflows.py
examples/workflows2/common.py
examples/workflows2/diamond_fcc.py
examples/workflows2/equation_of_states.py
examples/workflows2/fragmented_wf.py
examples/workflows2/load_active.py
examples/workflows2/mixed_calling.py
examples/workflows2/pressure_convergence.py
examples/workflows2/pw_si.py
examples/workflows2/test_pw.py
examples/workflows2/test_simplewf.py
examples/workflows2/wf_test.py
examples/workflows2/workflows_test.py
tests/__init__.py
tests/common/__init__.py
tests/common/test_extendeddicts.py
tests/workflows2/__init__.py
tests/workflows2/common.py
tests/workflows2/test_daemon.py
tests/workflows2/test_fragmentedWorkfunction.py
tests/workflows2/test_process.py
tests/workflows2/test_processSpec.py
tests/workflows2/test_process_registry.py
tests/workflows2/test_tickingEngine.py
tests/workflows2/test_wf.py