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Loosen slightly tight numerical tolerance
PiperOrigin-RevId: 882616503 Change-Id: Ia52a64395ed984243190dff2b162599795c6cc42
1 parent 6034525 commit c93ea0c

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Lines changed: 4 additions & 4 deletions

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ferminet/utils/tests/gto_test.py

Lines changed: 4 additions & 4 deletions
Original file line numberDiff line numberDiff line change
@@ -12,8 +12,6 @@
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# See the License for the specific language governing permissions and
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# limitations under the License.
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"""Tests for gto.py."""
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from absl.testing import absltest
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from absl.testing import parameterized
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from ferminet.utils import gto
@@ -60,10 +58,12 @@ def test_grad_solid_harmonic(self):
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with self.subTest('by hand'):
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observed = gto.grad_solid_harmonic(r, l_max)
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np.testing.assert_allclose(observed, expected, atol=1.e-4)
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np.testing.assert_allclose(observed, expected, rtol=2.0e-7, atol=1.0e-4)
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with self.subTest('by jax'):
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observed_jacfwd = gto.grad_solid_harmonic_by_jacfwd(r, l_max)
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np.testing.assert_allclose(observed_jacfwd, expected, atol=1.e-4)
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np.testing.assert_allclose(
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observed_jacfwd, expected, rtol=2.0e-7, atol=1.0e-4
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)
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if __name__ == '__main__':
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absltest.main()

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