Changeset 1797 for trunk/GSASII.py

Timestamp:

Apr 18, 2015 9:18:31 AM (10 years ago)

Author:

vondreele

Message:

flag HKLF space group extinct reflections (mul=0) & not count them

File:

• trunk/GSASII.py (modified) (2 diffs)

trunk/GSASII.py ¶

@@ -699 +699 @@
                         ref[4+Super] = np.sqrt(1./G2lat.calc_rDsq2(H,G))
                         iabsnt,ref[3+Super],Uniq,phi = G2spc.GenHKLf(H,SGData)
+                        if iabsnt:  #flag space gp. absences
+                            ref[3+Super] = 0
                     UseList[histoName] = SetDefaultDData(reflData['Type'],histoName)
                 elif histoName in PWDRlist:
@@ -841 +843 @@
                     ref[4+Super] = np.sqrt(1./G2lat.calc_rDsq2(H,G))
                     iabsnt,ref[3+Super],Uniq,phi = G2spc.GenHKLf(H,SGData)
+                    if iabsnt:  #flag space gp. absences
+                        ref[3+Super] = 0
         wx.EndBusyCursor()