Changeset 3707


Ignore:
Timestamp:
Oct 26, 2018 9:35:33 AM (3 years ago)
Author:
vondreele
Message:

fix mag site symmetries for certain cubics

File:
1 edited

Legend:

Unmodified
Added
Removed
  • trunk/GSASIIspc.py

    r3706 r3707  
    33113311       
    33123312    elif '32' in SytSym:
    3313         ops = {'(120)':['3','2(120)',],'(100)':['3','2(100)']}
     3313        ops = {'(120)':['3','2(120)',],'(100)':['3','2(100)'],'(111)':['3(111)','2(x)']}
    33143314    elif '23' in SytSym:
    33153315        ops = {'':['2(x)','3(111)']}
     
    33213321               '(100)':['3','m(100)'],'(120)':['3','m(210)',]}
    33223322   
    3323     if SytSym.split('(')[0] in ['6/m','6mm','-6m2','622','-6','-3','-3m',]:     #not simple cases
     3323    if SytSym.split('(')[0] in ['6/m','6mm','-6m2','622','-6','-3','-3m','-43m',]:     #not simple cases
    33243324        MagSytSym = SytSym
    33253325        if "-1'" in dupDir:
     
    33393339            if "m'(110)" in dupDir:
    33403340                MagSytSym = "6'm'm"
     3341        elif '-43m' in SytSym:
     3342            if "m'(110)" in dupDir:
     3343                MagSytSym = "-43m'"
    33413344        return MagSytSym
    33423345    try:
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