Changeset 1915 for trunk/GSASII.py


Ignore:
Timestamp:
Jun 30, 2015 3:52:34 PM (7 years ago)
Author:
vondreele
Message:

start on riding constraints - works for atom frac,x,y,z; skipping u's for now.
start on an add H atoms tool - just the GUI (hidden for now)
more twin work.
removed GSASII.BAT - it didn't work on many user's systems.
need a H atom geometry fixup routine

Location:
trunk
Files:
2 edited

Legend:

Unmodified
Added
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  • trunk

    • Property svn:ignore
      •  

        old new  
        11Exercises
         2GSASII.BAT
  • trunk/GSASII.py

    r1913 r1915  
    835835                UseList[histoName]['Twins'] = [[np.array([[1,0,0],[0,1,0],[0,0,1]]),[1.0,False]],]
    836836                for iT in range(reflData.get('TwMax',0)):
    837                     UseList[histoName]['Twins'].append([[],0.0])
     837                    UseList[histoName]['Twins'].append([False,0.0])
    838838                for iref,ref in enumerate(reflData['RefList']):
    839839                    hkl = ref[:3]
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