Ignore:
Timestamp:
Jan 11, 2020 2:38:29 AM (22 months ago)
Author:
vondreele
Message:

changes to RMCProfile GUI
now saves settings
diff curve for G(R) plot
min max restraints on neighbor atom-atom distances
speed up generation of rmc6f file

File:
1 edited

Legend:

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Removed
  • trunk/GSASIIlattice.py

    r4213 r4248  
    3232from __future__ import division, print_function
    3333import math
     34import time
    3435import copy
    3536import sys
     
    316317       
    317318    '''
    318    
    319319    cx,ct,cs,cia = oldPhase['General']['AtomPtrs']
    320320    cm = 0
     
    358358                atom[cm:cm+3] = mom*mag
    359359    newPhase['Atoms'] = newAtoms
    360     newPhase['Atoms'],atCodes = GetUnique(newPhase,atCodes)
     360    if SGData['SpGrp'] != 'P 1':
     361        newPhase['Atoms'],atCodes = GetUnique(newPhase,atCodes)
    361362    newPhase['Drawing'] = []
    362363    newPhase['ranId'] = ran.randint(0,sys.maxsize)
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