pyxtal package ============== .. automodule:: pyxtal :members: :undoc-members: :show-inheritance: Subpackages ----------- .. toctree:: :maxdepth: 4 pyxtal.database pyxtal.interface pyxtal.lego pyxtal.optimize pyxtal.potentials Submodules ---------- .. toctree:: :maxdepth: 4 pyxtal.XRD pyxtal.block_crystal pyxtal.constants pyxtal.crystal pyxtal.db pyxtal.descriptor pyxtal.elasticity pyxtal.io pyxtal.lattice pyxtal.molecular_crystal pyxtal.molecule pyxtal.msg pyxtal.operations pyxtal.plane pyxtal.representation pyxtal.supergroup pyxtal.symmetry pyxtal.tolerance pyxtal.util pyxtal.version pyxtal.viz pyxtal.wyckoff_site pyxtal.wyckoff_split