Fixed the Diagonalization in the supercell when printing the frequencies on the file.

This could now speedup the calculation

Author: mesonepigreco

Modules/Utilities.py

@@ -600,10 +600,9 @@ def CFP_SaveFrequencies(self, minim):
 
         # Generate the supercell in real space (Do it only if the frequency changes)
         if minim.minimizer.new_direction:
-            dyn_sc = minim.dyn.GenerateSupercellDyn( minim.ensemble.supercell )
+            w, pols = minim.dyn.DiagonalizeSupercell()
 
             # Dyagonalize
-            w, pols = dyn_sc.DyagDinQ(0)
             self.total_freqs.append(w)
 
 
@@ -685,4 +684,4 @@ def load_binary(filename):
             The filename you want to read
     """
 
-    return pickle.load(open(filename, "rb"))
+    return pickle.load(open(filename, "rb"))