Ignore:
Timestamp:
Nov 21, 2020 2:15:49 PM (12 months ago)
Author:
toby
Message:

extensive Origin 1->2 updates; merge SetupGeneral? into a single routine in G2Elem; read sym ops from CIF; fix sites sym/mult after cood xform

File:
1 edited

Legend:

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Added
Removed
  • trunk/GSASIIdataGUI.py

    r4658 r4659  
    11271127            rd.Phase['General']['Name'] = G2obj.MakeUniqueLabel(PhaseName,phaseNameList)
    11281128            if rd.Phase['General']['SGData']['SpGrp'] in G2spc.spg2origins:
    1129                 wx.MessageDialog(self,' The atom positions for this structure must be in the 2nd setting for the space group '+
    1130                     rd.Phase['General']['SGData']['SpGrp'],
    1131                     'Is this 2nd setting?',  wx.OK).ShowModal()
    1132                
     1129                choice = G2G.ChooseOrigin(self,rd)
     1130                if choice is None: return # dialog cancelled
     1131                rd.Phase = choice
    11331132            PhaseName = rd.Phase['General']['Name'][:]
    11341133            newPhaseList.append(PhaseName)
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