Clean ouput

irrep/bandstructure.py

@@ -255,7 +255,7 @@ def __init_vasp(
                         ("Invalid value for keyword EF. It must be "
                          "a number or 'auto'")
                         )
-        print("Efermi = {:.4f} eV".format(self.efermi) + msg)
+        print("\nEfermi = {:.4f} eV".format(self.efermi) + msg)
         WCF = WAVECARFILE(fWAV)
         # RECLENGTH=3 # the length of a record in WAVECAR. It is defined in the
         # first record, so let it be 3 so far"
@@ -298,7 +298,7 @@ def __init_vasp(
         )
 
         print(
-            "WAVECAR contains {0} k-points and {1} bands.\n Saving {2} bands starting from {3} in the output".format(
+            "WAVECAR contains {0} k-points and {1} bands.\nSaving {2} bands starting from {3} in the output".format(
                 NK, NBin, NBout, IBstart + 1
             )
         )

irrep/cli.py

@@ -349,7 +349,7 @@ def cli(
         print(fwfk.split("/")[0].split("-"))
         preline = " ".join(s.split("_")[1] for s in fwfk.split("/")[0].split("-")[:3])
     except Exception as err:
-        print(err)
+        # print(err)
         preline = ""
     json_data = {}
 
@@ -467,7 +467,7 @@ def cli(
 
     if plotbands:
         json_data["characters_and_irreps"] = {}
-        print("plotbands = True --> writing bands")
+        print("\nSaving bands for plotting (plotbands == True)")
         for k, sub in subbands.items():
             if isymsep is not None:
                 print(

irrep/gvectors.py

@@ -96,7 +96,8 @@ def calc_gvectors(
     for N in range(nplanemax):
         flag = True
         if N % 10 == 0:
-            print(N, len(igall))
+            # print(N, len(igall))
+            pass
         # if len(igall) >= nplane / (2 if spinor else 1):
         #     break
         if len(igall) >= nplane / 2:    # Only enters if vasp

irrep/spacegroup.py

@@ -655,7 +655,6 @@ def _findsym(self, inPOSCAR, cell, magnetic_moments):
                     dataset['origin_shift']
                     )
         else:
-            print("MAGNETIC DATASET")
             dataset = spglib.get_magnetic_symmetry_dataset((*cell, magnetic_moments))
             if dataset is None:
                 raise ValueError("No magnetic space group could be detected!")
@@ -830,10 +829,11 @@ def show(self, symmetries=None):
         print('')
         print("\n ---------- INFORMATION ABOUT THE SPACE GROUP ---------- \n")
         print('')
-        print("Space group {0} (# {1}) has {2} symmetry operations  ".format(
+        print("Space group {0} (# {1}) has {2}{3}symmetry operations  ".format(
             self.name,
             self.number, 
-            len(self.symmetries))
+            len(self.symmetries),
+            " unitary " if self.magnetic else " "),
             )
 
         if (not np.allclose(self.refUC, np.eye(3)) or

irreptables/irreptables/__init__.py

@@ -369,7 +369,7 @@ def __init__(self, SGnumber, spinor, name=None, magnetic=False):
             elif l[0].lower() == "spinor":
                 assert str2bool(l[1]) == self.spinor
             elif l[0].lower() == "symmetries":
-                print("Reading symmetries from tables")
+                print(f"\nReading symmetries from tables for SG {self.number}")
                 symmetries = []
                 while len(symmetries) < self.nsym:
                     l = lines.pop()