def test_apply_transformation(self):
# non-sensical example just for testing purposes
struct = self.get_structure("BaNiO3")
trans = DisorderOrderedTransformation()
output = trans.apply_transformation(struct)
self.assertFalse(output.is_ordered)
self.assertDictEqual(output[-1].species.as_dict(), {"Ni": 0.5, "Ba": 0.5})
def test_apply_transformation(self):
# non-sensical example just for testing purposes
struct = self.get_structure('BaNiO3')
trans = DisorderOrderedTransformation()
output = trans.apply_transformation(struct)
self.assertFalse(output.is_ordered)
self.assertDictEqual(output.species_and_occu[-1].as_dict(),
{'Ni': 0.5, 'Ba': 0.5})
def test_apply_transformation(self):
# non-sensical example just for testing purposes
struct = self.get_structure('BaNiO3')
trans = DisorderOrderedTransformation()
output = trans.apply_transformation(struct)
self.assertFalse(output.is_ordered)
self.assertDictEqual(output.species_and_occu[-1].as_dict(), {
'Ni': 0.5,
'Ba': 0.5
})