--- tests/analysis/interfaces/test_substrate_analyzer.py.orig 2026-04-20 05:45:36 UTC +++ tests/analysis/interfaces/test_substrate_analyzer.py @@ -50,11 +50,11 @@ def test_generate_surface_vectors(): assert [substrate_millers] == substrate_miller_indices assert_allclose( film_vectors, - [[0, 0, 3.035429], [-2.764654e-16, 4.515023, 2.764654e-16]], + [[4.881342e-16, 3.035429e+00, 1.858664e-16], [4.515023e+00, 0.0, 2.764654e-16]], atol=1e-6, ) assert_allclose( substrate_vectors, - [[-3.766937, -1.928326, -6.328967], [3.766937, -12.307154, 0.0]], - atol=1e-6, + [[1.928326e+00, 6.328967e+00, -3.766937e+00], [1.2307154e+01, 0.0, 3.766937e+00]], + atol=1e-5, )