CMakeLists.txt
MANIFEST.in
README.md
pyproject.toml
setup.cfg
setup.py
backend/atom_class.cpp
backend/atom_class.h
backend/atom_functions.cpp
backend/atom_functions.h
backend/coincidence_algorithm.cpp
backend/coincidence_algorithm.h
backend/helper_classes.cpp
backend/helper_classes.h
backend/interface_class.cpp
backend/interface_class.h
backend/logging_functions.cpp
backend/logging_functions.h
backend/math_functions.cpp
backend/math_functions.h
backend/pybindings.cpp
bin/hetbuilder
external/pybind11/.appveyor.yml
external/pybind11/.clang-format
external/pybind11/.clang-tidy
external/pybind11/.cmake-format.yaml
external/pybind11/.git
external/pybind11/.gitignore
external/pybind11/.pre-commit-config.yaml
external/pybind11/.readthedocs.yml
external/pybind11/CMakeLists.txt
external/pybind11/LICENSE
external/pybind11/MANIFEST.in
external/pybind11/README.rst
external/pybind11/pyproject.toml
external/pybind11/setup.cfg
external/pybind11/setup.py
external/pybind11/include/pybind11/attr.h
external/pybind11/include/pybind11/buffer_info.h
external/pybind11/include/pybind11/cast.h
external/pybind11/include/pybind11/chrono.h
external/pybind11/include/pybind11/common.h
external/pybind11/include/pybind11/complex.h
external/pybind11/include/pybind11/eigen.h
external/pybind11/include/pybind11/embed.h
external/pybind11/include/pybind11/eval.h
external/pybind11/include/pybind11/functional.h
external/pybind11/include/pybind11/gil.h
external/pybind11/include/pybind11/iostream.h
external/pybind11/include/pybind11/numpy.h
external/pybind11/include/pybind11/operators.h
external/pybind11/include/pybind11/options.h
external/pybind11/include/pybind11/pybind11.h
external/pybind11/include/pybind11/pytypes.h
external/pybind11/include/pybind11/stl.h
external/pybind11/include/pybind11/stl_bind.h
external/pybind11/include/pybind11/detail/class.h
external/pybind11/include/pybind11/detail/common.h
external/pybind11/include/pybind11/detail/descr.h
external/pybind11/include/pybind11/detail/init.h
external/pybind11/include/pybind11/detail/internals.h
external/pybind11/include/pybind11/detail/type_caster_base.h
external/pybind11/include/pybind11/detail/typeid.h
external/pybind11/pybind11/__init__.py
external/pybind11/pybind11/__main__.py
external/pybind11/pybind11/_version.py
external/pybind11/pybind11/_version.pyi
external/pybind11/pybind11/commands.py
external/pybind11/pybind11/py.typed
external/pybind11/pybind11/setup_helpers.py
external/pybind11/pybind11/setup_helpers.pyi
external/pybind11/tools/FindCatch.cmake
external/pybind11/tools/FindEigen3.cmake
external/pybind11/tools/FindPythonLibsNew.cmake
external/pybind11/tools/check-style.sh
external/pybind11/tools/cmake_uninstall.cmake.in
external/pybind11/tools/libsize.py
external/pybind11/tools/make_changelog.py
external/pybind11/tools/pybind11Common.cmake
external/pybind11/tools/pybind11Config.cmake.in
external/pybind11/tools/pybind11NewTools.cmake
external/pybind11/tools/pybind11Tools.cmake
external/pybind11/tools/pyproject.toml
external/pybind11/tools/setup_global.py.in
external/pybind11/tools/setup_main.py.in
external/spglib/.git
external/spglib/.gitignore
external/spglib/.travis.yml
external/spglib/CMakeLists.txt
external/spglib/COPYING
external/spglib/ChangeLog
external/spglib/README.md
external/spglib/src/arithmetic.c
external/spglib/src/arithmetic.h
external/spglib/src/cell.c
external/spglib/src/cell.h
external/spglib/src/debug.c
external/spglib/src/debug.h
external/spglib/src/delaunay.c
external/spglib/src/delaunay.h
external/spglib/src/determination.c
external/spglib/src/determination.h
external/spglib/src/hall_symbol.c
external/spglib/src/hall_symbol.h
external/spglib/src/kgrid.c
external/spglib/src/kgrid.h
external/spglib/src/kpoint.c
external/spglib/src/kpoint.h
external/spglib/src/mathfunc.c
external/spglib/src/mathfunc.h
external/spglib/src/niggli.c
external/spglib/src/niggli.h
external/spglib/src/overlap.c
external/spglib/src/overlap.h
external/spglib/src/pointgroup.c
external/spglib/src/pointgroup.h
external/spglib/src/primitive.c
external/spglib/src/primitive.h
external/spglib/src/refinement.c
external/spglib/src/refinement.h
external/spglib/src/site_symmetry.c
external/spglib/src/site_symmetry.h
external/spglib/src/sitesym_database.c
external/spglib/src/sitesym_database.h
external/spglib/src/spacegroup.c
external/spglib/src/spacegroup.h
external/spglib/src/spg_database.c
external/spglib/src/spg_database.h
external/spglib/src/spglib.c
external/spglib/src/spglib.h
external/spglib/src/spglib_f.c
external/spglib/src/spin.c
external/spglib/src/spin.h
external/spglib/src/symmetry.c
external/spglib/src/symmetry.h
external/spglib/src/test.c
external/spglib/src/version.h
hetbuilder/__init__.py
hetbuilder/algorithm.py
hetbuilder/atom_checks.py
hetbuilder/log.py
hetbuilder/plotting.py
hetbuilder.egg-info/PKG-INFO
hetbuilder.egg-info/SOURCES.txt
hetbuilder.egg-info/dependency_links.txt
hetbuilder.egg-info/requires.txt
hetbuilder.egg-info/top_level.txt
hetbuilder.egg-info/zip-safe