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Most notable user-facing change: add
in_place: bool = True
keyword toStructure.make_supercell()
and return the supercell.a70f4c4 add
Structure/Molecule.sites
setter, move@property
to SiteCollection7f510ca don't use implementation detail
(Structure|Molecule)._sites
c5052a2 rename
StructureTest.structure
attr tostruct
28a895f add
IStructureTest.test_sites_setter
185d2cb fix mypy
94f4413 test
translate/rotate_sites
IndexError
if "list index out of range"2ffd3bb tweak doc strings
f482ba0 test inverse
translate_sites
operations leave structure unchanged7197592
Structure.make_supercell()
addin_place: bool = True
keyword and return supercell structure638c095 test
make_supercell
in_place=True
andFalse