Changeset 1363


Ignore:
Timestamp:
May 23, 2014 12:45:28 PM (8 years ago)
Author:
vondreele
Message:

fix to error in restraint processing

Location:
trunk
Files:
2 edited

Legend:

Unmodified
Added
Removed
  • trunk/GSASIImath.py

    r1282 r1363  
    713713            oprs = op.split('+')
    714714            unit = [0,0,0]
    715             if oprs[1]:
     715            if len(oprs)>1:
    716716                unit = np.array(list(eval(oprs[1])))
    717717            syop =int(oprs[0])
  • trunk/atmdata.py

    r1361 r1363  
    230230    'Cf':   {'Z':98,'fa':[ 36.9185,  25.1995,  18.3317,  4.24391],'fb':[ 0.437533,  3.00775,  12.4044,  83.7881],'fc':  13.2674},
    231231        }
    232 # atom Sizees, bond radii, angle radii, H-bond radii
     232# atom Sizes, bond radii, angle radii, H-bond radii
    233233AtmSize = {
    234234    'H': [0.98,  0.78, 1.20, 0],
     
    258258    'V': [1.55,  1.35, 1.70, 0],
    259259    'Cr':[1.56,  1.36, 1.70, 0],
    260     'Mn':[1.50,  1.30, 1.70, 0],
     260    'Mn':[1.54,  1.30, 1.70, 0],
    261261    'Fe':[1.47,  1.27, 1.70, 0],
    262262    'Co':[1.45,  1.25, 1.70, 0],
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