Fix geomopt test

ElliottKasoar · Jun 4, 2024 · 7ae292c · 7ae292c
1 parent 22c0926
commit 7ae292c
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/tests/calculations/test_geomopt.py b/tests/calculations/test_geomopt.py
@@ -91,7 +91,7 @@ def test_run_opt(model_folder, janus_code):
     assert "traj_output" in result
     assert "traj_file" in result
     assert result["traj_output"].numsteps == 3
-    assert result["final_structure"].cell[0][1] == pytest.approx(2.8442048309822)
+    assert result["final_structure"].cell[0][1] == pytest.approx(2.8438848145858)
     assert result["xyz_output"].filename == "aiida-results.xyz"