Minor refactoring

mala-project · Apr 11, 2024 · bf97d37 · bf97d37
1 parent 7d9d5d3
commit bf97d37
Showing 1 changed file with 3 additions and 3 deletions.
diff --git a/mala/targets/ldos.py b/mala/targets/ldos.py
@@ -1362,9 +1362,9 @@ def get_atomic_forces(self, ldos_data=None, dos_data=None,
                 d_n_d_mu = np.dot(ldos_data, d_f01_d_mu)
                 d_E_h_d_mu = np.dot(d_E_h_d_n[:,0], d_n_d_mu)
                 d_mu_d_d = np.zeros_like(ldos_data)
-                d_mu_d_d[:] = (-1.0) * (d_n_d_d*self.voxel.volume)
-                d_mu_d_d /= (self._density_of_states_calculator.
-                             d_number_of_electrons_d_mu)
+                d_mu_d_d[:] = (d_n_d_d*self.voxel.volume)
+                d_mu_d_d /= (-1.0) * (self._density_of_states_calculator.
+                                      d_number_of_electrons_d_mu)
                 d_E_d_n = d_E_h_d_n * d_n_d_d + d_E_h_d_mu * d_mu_d_d
                 d_E_d_d += d_E_d_n