Adds return_value test
@@ -14,6 +14,6 @@ mongo = db_helper("127.0.0.1", 27017, "local")
#print(mongo.get_dataframe("TWO-ELECTRON ENERGY", "HBC6", "FaOOFaOO_0.9444444444444444", "cp", ["B3LYP/adz", "B3LYP/aug-cc-pVDZ"], do_stoich=True, debug_level=1))
-#def test_return_values():
-# wpbe_val = mongo.get_value("return_value", "HBC6", "FaOOFaOO_0.9444444444444444", "cp", "WPBE/qzvp", do_stoich=True, debug_level=1)
-# assert np.allclose(wpbe_val, -20.4963, rtol=1.e-3, atol=1.e-3)
+def test_return_values():
+ wpbe_val = mongo.get_value("return_value", "HBC6", "FaOOFaOO_0.9444444444444444", "cp", "WPBE/qzvp", do_stoich=True, debug_level=1)
+ assert np.allclose(wpbe_val, -20.4963, rtol=1.e-3, atol=1.e-3)
