Changeset 3221 for trunk/GSASIIphsGUI.py

Timestamp:

Jan 13, 2018 9:20:13 AM (5 years ago)

Author:

vondreele

Message:

fix import of magnetic structures from .EXP files
complete list of pre & post 2002 cubic space groups
make sure SGDataSGGray? is present

File:

• trunk/GSASIIphsGUI.py (modified) (2 diffs)

trunk/GSASIIphsGUI.py

@@ -1157 +1157 @@
                 generalData['AtomPtrs'] = [3,1,10,12]
         if generalData['Modulated']:
-            if 'SGGray' not in generalData['SGData']:
-                generalData['SGData']['SGGray'] = False
-            generalData['Modulated'] = True
             if 'Super' not in generalData:
                 generalData['Super'] = 1
@@ -1171 +1168 @@
         if 'HydIds' not in generalData:
             generalData['HydIds'] = {}
+        if generalData['Type'] == 'magnetic':
+            if 'SGGray' not in generalData['SGData']:
+                generalData['SGData']['SGGray'] = False
+                
 # end of patches
         cx,ct,cs,cia = generalData['AtomPtrs']