Merge pull request mala-project#491 from RandomDefaultUser/develop

Hotfixing the tester class
RandomDefaultUser · Oct 26, 2023 · 9c2d434 · 9c2d434
2 parents e769d32 + 6c77a50
commit 9c2d434
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/mala/network/tester.py b/mala/network/tester.py
@@ -210,7 +210,7 @@ def __calculate_observable_error(self, snapshot_number, observable,
             target_calculator.read_from_array(predicted_target)
             predicted = target_calculator.band_energy
             return [actual, predicted,
-                    target_calculator.total_energy_dft_calculation]
+                    target_calculator.band_energy_dft_calculation]
 
         elif observable == "number_of_electrons":
             target_calculator = self.data.target_calculator