Changeset 4557


Ignore:
Timestamp:
Sep 1, 2020 2:51:32 PM (14 months ago)
Author:
vondreele
Message:

fix math error in StructureFactorDeriv? - sym op matrix needed transpose. Affects only trigonal/hexagonal

File:
1 edited

Legend:

Unmodified
Added
Removed
  • trunk/GSASIIstrMath.py

    r4535 r4557  
    864864    ast = np.sqrt(np.diag(G))
    865865    Mast = twopisq*np.multiply.outer(ast,ast)
    866     SGMT = np.array([ops[0] for ops in SGData['SGOps']])
     866    SGMT = np.array([ops[0].T for ops in SGData['SGOps']])
    867867    SGT = np.array([ops[1] for ops in SGData['SGOps']])
    868868    FFtables = calcControls['FFtables']
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