LICENSE
README.md
pyproject.toml
src/atomate2/turbomole/__init__.py
src/atomate2/turbomole/_version.py
src/atomate2/turbomole/utils.py
src/atomate2/turbomole/custodian/__init__.py
src/atomate2/turbomole/custodian/jobs.py
src/atomate2/turbomole/custodian/validators.py
src/atomate2/turbomole/flows/__init__.py
src/atomate2/turbomole/flows/core.py
src/atomate2/turbomole/jobs/__init__.py
src/atomate2/turbomole/jobs/base.py
src/atomate2/turbomole/jobs/core.py
src/atomate2/turbomole/schemas/__init__.py
src/atomate2/turbomole/schemas/calculation.py
src/atomate2/turbomole/schemas/task.py
src/atomate2/turbomole/schemas/calc_types/__init__.py
src/atomate2/turbomole/sets/__init__.py
src/atomate2/turbomole/sets/base.py
src/atomate2/turbomole/sets/core.py
src/atomate2_turbomole.egg-info/PKG-INFO
src/atomate2_turbomole.egg-info/SOURCES.txt
src/atomate2_turbomole.egg-info/dependency_links.txt
src/atomate2_turbomole.egg-info/requires.txt
src/atomate2_turbomole.egg-info/top_level.txt
tests/test_atomate2_turbomole.py
tests/test_custodian_jobs.py
tests/test_database.py
tests/test_utils.py