LICENSE
README.md
pyproject.toml
stjames/__init__.py
stjames/base.py
stjames/basis_set.py
stjames/calculation.py
stjames/corrections.py
stjames/grid_settings.py
stjames/int_settings.py
stjames/methods.py
stjames/modes.py
stjames/molecule.py
stjames/opt_settings.py
stjames/scf_settings.py
stjames/settings.py
stjames/status.py
stjames/tasks.py
stjames/thermochem_settings.py
stjames.egg-info/PKG-INFO
stjames.egg-info/SOURCES.txt
stjames.egg-info/dependency_links.txt
stjames.egg-info/requires.txt
stjames.egg-info/top_level.txt