Changeset 2116 for trunk/GSASIIphsGUI.py

Timestamp:

Jan 7, 2016 12:40:19 PM (8 years ago)

Author:

vondreele

Message:

change error message about 'X' space groups!
add Transform stub in General Compute menu - see bottom of General stuff in G2phsGUI

File:

• trunk/GSASIIphsGUI.py (modified) (3 diffs)

trunk/GSASIIphsGUI.py

@@ -1174 +1174 @@
         G2frame.dataFrame.SetStatusText('')
         SetPhaseWindow(G2frame.dataFrame,General,mainSizer,Scroll)
+        
+    def OnTransform(event):
+        '''What is needed here? Get user to refer to Intl. Tables 1A (or Bilbao server) & use new
+        space group, cell transformation & origin displacement (if needed) given therein.
+        Do this in popup dialog box with OK, Cancel buttons; if OK
+        apply to lattice parameters & atom position/Uij parameters
+        need to start with full unit cell contents, transform & then filter out symm. equiv.
+        '''
+        print 'Transform crystal structure - TBD'
+        
+                    
 
 ################################################################################
@@ -5700 +5711 @@
         data['MCSA']['Results'] = []
         UpdateMCSA()
-                    
+        
 ################################################################################
 ##### Pawley routines
@@ -6388 +6399 @@
         G2frame.dataFrame.Bind(wx.EVT_MENU, OnRunSingleMCSA, id=G2gd.wxID_SINGLEMCSA)
         G2frame.dataFrame.Bind(wx.EVT_MENU, OnRunMultiMCSA, id=G2gd.wxID_MULTIMCSA)
+        G2frame.dataFrame.Bind(wx.EVT_MENU, OnTransform, id=G2gd.wxID_TRANSFORMSTRUCTURE)
         # Data
         FillSelectPageMenu(TabSelectionIdDict, G2frame.dataFrame.DataMenu)