symmetry

is_same_struct(st1, st2)

Test if two Structure instances are the same.

spglib2struct(tup)

Transform returned tuple from various spglib functions to Structure.

spglib_get_primitive(struct, **kwds)

Find primitive structure for given Structure.

spglib_get_spacegroup(struct, **kwds)

Find spacegroup for given Structure.

struct2spglib(st)

Transform Structure to spglib input tuple (cell, coords_frac, znucl).