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sunqm committed Sep 2, 2024
1 parent fb330d1 commit 79414db
Showing 1 changed file with 1 addition and 1 deletion.
2 changes: 1 addition & 1 deletion pyscf/x2c/test/test_x2c.py
Original file line number Diff line number Diff line change
Expand Up @@ -215,7 +215,7 @@ def test_ghf(self):
mf.kernel(dm0=dm)
self.assertTrue(mf.converged)
self.assertAlmostEqual(mf.e_tot, ref.e_tot, 9)
self.assertAlmostEqual(abs(mf.dip_moment() - ref.dip_moment()).max(), 0 9)
self.assertAlmostEqual(abs(mf.dip_moment() - ref.dip_moment()).max(), 0, 9)

def test_undo_x2c(self):
mf = mol.RHF().x2c().density_fit()
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