Changeset 2450 for trunk/GSASIIstrIO.py


Ignore:
Timestamp:
Aug 25, 2016 12:22:04 PM (5 years ago)
Author:
vondreele
Message:

fix error in matrix in getCellEsd & RetDistAngle?
Add new atom drawing option for sphere of enclosure

File:
1 edited

Legend:

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  • trunk/GSASIIstrIO.py

    r2448 r2450  
    14871487        Ax[3]*Ax[5]-Ax[1]*Ax[4],
    14881488        Ax[3]*Ax[4]-Ax[0]*Ax[5]])
    1489     srcvlsq = np.inner(drVdA,np.inner(vcov,drVdA.T))
     1489    srcvlsq = np.inner(drVdA,np.inner(drVdA,vcov))
    14901490    Vol = 1/np.sqrt(rVsq)
    14911491    sigVol = Vol**3*np.sqrt(srcvlsq)/2.         #ok - checks with GSAS
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