prisms-center / CASMcode_crystallography

CASM crystallography
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2.0a1 #10

Closed bpuchala closed 1 year ago

bpuchala commented 1 year ago

This separates out casm/crystallography from CASM v1, in particular removing remaining dependencies on casm/symmetry for constructing symmetry representations and getting basic symmetry operation info. It creates a Python package, libcasm.xtal, that enables using casm/crystallography and may be installed via pip install, using scikit-build, CMake, and pybind11. This release also includes usage and API documentation for using libcasm.xtal, built using Sphinx.