LICENSE
MANIFEST.in
README.md
pyproject.toml
setup.json
setup.py
aiida_sssp_workflow/__init__.py
aiida_sssp_workflow/helpers.py
aiida_sssp_workflow/parsers.py
aiida_sssp_workflow/utils.py
aiida_sssp_workflow.egg-info/PKG-INFO
aiida_sssp_workflow.egg-info/SOURCES.txt
aiida_sssp_workflow.egg-info/dependency_links.txt
aiida_sssp_workflow.egg-info/entry_points.txt
aiida_sssp_workflow.egg-info/requires.txt
aiida_sssp_workflow.egg-info/top_level.txt
aiida_sssp_workflow/REF/__init__.py
aiida_sssp_workflow/calculations/__init__.py
aiida_sssp_workflow/calculations/birch_murnaghan_fit.py
aiida_sssp_workflow/calculations/calculate_bands_distance.py
aiida_sssp_workflow/calculations/calculate_delta.py
aiida_sssp_workflow/calculations/wien2k_ref.py
aiida_sssp_workflow/cli/__init__.py
aiida_sssp_workflow/cli/launch.py
aiida_sssp_workflow/cli/options.py
aiida_sssp_workflow/cli/validate.py
aiida_sssp_workflow/cli/workflows/__init__.py
aiida_sssp_workflow/cli/workflows/delta_factor.py
aiida_sssp_workflow/cli/workflows/verification.py
aiida_sssp_workflow/data/__init__.py
aiida_sssp_workflow/workflows/__init__.py
aiida_sssp_workflow/workflows/_eos.py
aiida_sssp_workflow/workflows/bands_distance.py
aiida_sssp_workflow/workflows/delta_factor.py
aiida_sssp_workflow/workflows/verifications.py
aiida_sssp_workflow/workflows/convergence/__init__.py
aiida_sssp_workflow/workflows/convergence/bands.py
aiida_sssp_workflow/workflows/convergence/base.py
aiida_sssp_workflow/workflows/convergence/cohesive_energy.py
aiida_sssp_workflow/workflows/convergence/engine.py
aiida_sssp_workflow/workflows/convergence/phonon_frequencies.py
aiida_sssp_workflow/workflows/convergence/pressure.py
aiida_sssp_workflow/workflows/legacy_convergence/__init__.py
aiida_sssp_workflow/workflows/legacy_convergence/bands.py
aiida_sssp_workflow/workflows/legacy_convergence/cohesive_energy.py
aiida_sssp_workflow/workflows/legacy_convergence/engine.py
aiida_sssp_workflow/workflows/legacy_convergence/phonon_frequencies.py
aiida_sssp_workflow/workflows/legacy_convergence/pressure.py
efermi/__init__.py
efermi/efermi.py
tests/__init__.py
tests/conftest.py
tests/sample_processes.py
tests/test_calcfunction.py
tests/test_convergence_engine.py
tests/test_efermi.py
tests/test_utils.py