Changeset 3068 for trunk/GSASIIstrMath.py

Timestamp:

Sep 12, 2017 10:54:45 AM (5 years ago)

Author:

vondreele

Message:

fix parameter display to show nan (crashed before)
trap with error if any parameter is nan
skip postprocessing for failed refinements (IfOK=False)
fix Jacobian to use GetProfileDervMP

File:

• trunk/GSASIIstrMath.py (modified) (1 diff)

trunk/GSASIIstrMath.py

@@ -4070 +4070 @@
             xB = np.searchsorted(x,Limits[0])
             xF = np.searchsorted(x,Limits[1])+1
-            dMdvh = np.sqrt(w[xB:xF])*getPowderProfileDerv(parmDict,x[xB:xF],
-                varylist,Histogram,Phases,rigidbodyDict,calcControls,pawleyLookup,dependentVars)
+            dMdvh = np.sqrt(w[xB:xF])*getPowderProfileDervMP([parmDict,x[xB:xF],
+                varylist,Histogram,Phases,rigidbodyDict,calcControls,pawleyLookup,dependentVars])
         elif 'HKLF' in histogram[:4]:
             Histogram = Histograms[histogram]