Update test_molecule.py

workaround for xyz file not found during test
qiboteam · Dec 15, 2023 · d110b04 · d110b04
1 parent cc8c3e0
commit d110b04
Showing 1 changed file with 2 additions and 1 deletion.
diff --git a/tests/test_molecule.py b/tests/test_molecule.py
@@ -25,7 +25,8 @@ def test_run_pyscf():
 
 def test_run_pyscf_molecule_xyz():
     """Pyscf driver with xyz file"""
-
+    with open('lih.xyz', 'a') as file:
+        file.write('2\n 0 1\n Li 0.0 0.0 0.0\n H 0.0 0.0 1.2')
     lih_ref_energy = -7.83561582555692
     lih = Molecule(xyz_file="lih.xyz")
     lih.run_pyscf()