Fix adc tests

sunqm · Oct 27, 2023 · 19168dd · 19168dd
1 parent ebf3cfa
commit 19168dd
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/pyscf/pbc/adc/test/test_k_vs_supercell_ea.py b/pyscf/pbc/adc/test/test_k_vs_supercell_ea.py
@@ -60,7 +60,7 @@ def tearDownModule():
 
 class KnownValues(unittest.TestCase):
     def test_ea_adc2_supercell(self):
-        e1,v1,p1,x1 = myadc.kernel(nroots=3)
+        e1,v1,p1,x1 = myadc.kernel(nroots=4)
         self.assertAlmostEqual(e1[1], 0.83425538, 6)
         self.assertAlmostEqual(e1[3], 1.29595017, 6)