def test_convert_to_ieee(self):
for xtal in self.ieee_data.keys():
orig = TensorBase(self.ieee_data[xtal]['original_tensor'])
ieee = TensorBase(self.ieee_data[xtal]['ieee_tensor'])
struct = Structure.from_dict(self.ieee_data[xtal]['structure'])
diff = np.max(abs(ieee - orig.convert_to_ieee(struct)))
err_msg = "{} IEEE conversion failed with max diff {}".format(
xtal, diff)
self.assertArrayAlmostEqual(ieee, orig.convert_to_ieee(struct),
err_msg = err_msg, decimal=3)
def test_convert_to_ieee(self):
for entry in self.ieee_data:
xtal = entry['xtal']
orig = TensorBase(entry['original_tensor'])
ieee = TensorBase(entry['ieee_tensor'])
struct = Structure.from_dict(entry['structure'])
diff = np.max(abs(ieee - orig.convert_to_ieee(struct)))
err_msg = "{} IEEE conversion failed with max diff {}".format(
xtal, diff)
self.assertArrayAlmostEqual(ieee, orig.convert_to_ieee(struct),
err_msg = err_msg, decimal=3)
def test_convert_to_ieee(self):
for xtal in self.ieee_data.keys():
orig = TensorBase(self.ieee_data[xtal]['original_tensor'])
ieee = TensorBase(self.ieee_data[xtal]['ieee_tensor'])
struct = Structure.from_dict(self.ieee_data[xtal]['structure'])
self.assertArrayAlmostEqual(ieee, orig.convert_to_ieee(struct))
