Changeset 1664


Ignore:
Timestamp:
Feb 19, 2015 9:28:15 AM (7 years ago)
Author:
vondreele
Message:

fix rhombohedral lattice constraints

File:
1 edited

Legend:

Unmodified
Added
Removed
  • trunk/GSASIIstrIO.py

    r1663 r1664  
    635635    elif SGData['SGLaue'] in ['3R', '3mR']:
    636636        G2mv.StoreEquivalence(pfx+'A0',(pfx+'A1',pfx+'A2',))
    637         return [pfx+'A0',pfx+'A1',pfx+'A2']                       
     637        G2mv.StoreEquivalence(pfx+'A3',(pfx+'A4',pfx+'A5',))
     638        return [pfx+'A0',pfx+'A1',pfx+'A2',pfx+'A3',pfx+'A4',pfx+'A5']                       
    638639    elif SGData['SGLaue'] in ['m3m','m3']:
    639640        G2mv.StoreEquivalence(pfx+'A0',(pfx+'A1',pfx+'A2',))
     
    10091010            pfx+'A3':A[3],pfx+'A4':A[4],pfx+'A5':A[5],pfx+'Vol':G2lat.calc_V(A)})
    10101011        if cell[0]:
    1011             phaseVary += cellVary(pfx,SGData)
     1012            phaseVary += cellVary(pfx,SGData)       #also fills in symmetry required constraints
    10121013        SSGtext = []    #no superstructure
    10131014        im = 0
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