.gitignore
.pre-commit-config.yaml
CONTRIBUTING.md
LICENSE
README.md
pyproject.toml
.github/workflows/pre-commit.yaml
.github/workflows/publish.yaml
.github/workflows/release.yaml
.github/workflows/unittest.yaml
docs/_config.yml
docs/_toc.yml
docs/api.rst
docs/batching.ipynb
docs/boys_function.ipynb
docs/gammanu.ipynb
docs/gto_integrals.ipynb
docs/intro.md
docs/misc.md
docs/optim.ipynb
docs/prologue.md
docs/quadrature.ipynb
docs/quirks.ipynb
docs/references.bib
docs/tour.ipynb
docs/_static/style.css
docs/_templates/class.rst
docs/_templates/module.rst
mess/__init__.py
mess/autograd_integrals.py
mess/basis.py
mess/binom_factor_table.py
mess/hamiltonian.py
mess/integrals.py
mess/interop.py
mess/mesh.py
mess/numerics.py
mess/orbital.py
mess/orthnorm.py
mess/package_utils.py
mess/plot.py
mess/primitive.py
mess/scf.py
mess/special.py
mess/structure.py
mess/types.py
mess/units.py
mess/xcfunctional.py
mess/zeropad_integrals.py
mess_jax.egg-info/PKG-INFO
mess_jax.egg-info/SOURCES.txt
mess_jax.egg-info/dependency_links.txt
mess_jax.egg-info/requires.txt
mess_jax.egg-info/top_level.txt
test/conftest.py
test/test_autograd_integrals.py
test/test_benchmark.py
test/test_hamiltonian.py
test/test_integrals.py
test/test_interop.py
test/test_special.py
test/test_xcfunctional.py