LICENSE.txt
README.md
pyproject.toml
src/microsoft_skala.egg-info/PKG-INFO
src/microsoft_skala.egg-info/SOURCES.txt
src/microsoft_skala.egg-info/dependency_links.txt
src/microsoft_skala.egg-info/requires.txt
src/microsoft_skala.egg-info/top_level.txt
src/skala/__init__.py
src/skala/py.typed
src/skala/ase/__init__.py
src/skala/ase/calculator.py
src/skala/foundry/__init__.py
src/skala/foundry/client.py
src/skala/foundry/schemas.py
src/skala/functional/__init__.py
src/skala/functional/base.py
src/skala/functional/density.py
src/skala/functional/layers.py
src/skala/functional/load.py
src/skala/functional/model.py
src/skala/functional/traditional.py
src/skala/gpu4pyscf/__init__.py
src/skala/gpu4pyscf/dft.py
src/skala/gpu4pyscf/gradients.py
src/skala/pyscf/__init__.py
src/skala/pyscf/backend.py
src/skala/pyscf/dft.py
src/skala/pyscf/features.py
src/skala/pyscf/gradients.py
src/skala/pyscf/numint.py
src/skala/pyscf/retry.py
src/skala/utils/__init__.py
src/skala/utils/scatter.py
tests/test_ase.py
tests/test_enhancement_factor.py
tests/test_gpu4pyscf_classes.py
tests/test_gpu4pyscf_gradients.py
tests/test_model.py
tests/test_pyscf_classes.py
tests/test_pyscf_gradients.py
tests/test_scf_retry.py
tests/test_traditional.py