def test_set_structure_phase_name(self):
name = "al"
p = Phase(name=name)
p.structure = Structure(lattice=Lattice(*([0.405] * 3 + [90] * 3)))
assert p.name == name
assert p.structure.title == name
def test_set_structure_raises(self):
p = Phase()
with pytest.raises(ValueError, match=".* must be a diffpy.structure.Structure"):
p.structure = [1, 2, 3, 90, 90, 90]
def test_set_structure(self, structure):
p = Phase()
p.structure = structure
assert p.structure == structure
