Changeset 4972

Timestamp:

Jun 23, 2021 12:07:12 PM (3 months ago)

Author:

vondreele

Message:

hide intensity related variables & set their refinement flags to False for LeBail? selection. Message shows .

Location:

trunk

Files:

• GSASIIddataGUI.py (modified) (5 diffs)
• GSASIIstrMath.py (modified) (1 diff)

trunk/GSASIIddataGUI.py

@@ -495 +495 @@
         poSizer.Add(poVal,0,WACV)
         poSizer.Add(wx.StaticText(DData,wx.ID_ANY,' Unique axis, H K L: '),0,WACV)
-        h,k,l =POData[3]
+        h,k,l = POData[3]
         poAxis = wx.TextCtrl(DData,wx.ID_ANY,'%3d %3d %3d'%(h,k,l),style=wx.TE_PROCESS_ENTER)
         poAxis.Bind(wx.EVT_TEXT_ENTER,OnPOAxis)
@@ -845 +845 @@
                 Obj.SetLabel('Do new Le Bail extraction?')
             UseList[G2frame.hist]['LeBail'] = not UseList[G2frame.hist]['LeBail']
+            wx.CallLater(100,RepaintHistogramInfo,DData.GetScrollPos(wx.VERTICAL))
+            
         def OnResetSize(event):
             Obj = event.GetEventObject()
@@ -919 +921 @@
                 G2frame.SetStatusText('To reset Le Bail, cycle Le Bail check box.',1)
         bottomSizer.Add(useBox,0,wx.TOP|wx.BOTTOM|wx.LEFT,5)
-        if G2frame.testSeqRefineMode():
+        if G2frame.testSeqRefineMode() and not UseList[G2frame.hist]['LeBail']:
             bottomSizer.Add(wx.StaticText(DData,label='     Sequential Refinemment Options'))
             parmChoice = [' ','X','XU','U','F','FX','FXU','FU']
@@ -944 +946 @@
             bottomSizer.Add(fixBox)
         
-        bottomSizer.Add(ScaleSizer(),0,wx.BOTTOM,5)
+        if not UseList[G2frame.hist]['LeBail'] or 'HKLF' in G2frame.hist[:4]:
+            bottomSizer.Add(ScaleSizer(),0,wx.BOTTOM,5)
             
         if G2frame.hist[:4] == 'PWDR':
@@ -1003 +1006 @@
             bottomSizer.Add(DispSizer())
                 
-            poSizer = wx.BoxSizer(wx.VERTICAL)
-            POData = UseList[G2frame.hist]['Pref.Ori.']
+            if not UseList[G2frame.hist]['LeBail']:
+                poSizer = wx.BoxSizer(wx.VERTICAL)
+                POData = UseList[G2frame.hist]['Pref.Ori.']
 # patch - add penalty items
-            if len(POData) < 7:
-                POData.append(['',])
-                POData.append(0.1)
-            if not POData[6]:
-                POData[6] = ['',]
+                if len(POData) < 7:
+                    POData.append(['',])
+                    POData.append(0.1)
+                if not POData[6]:
+                    POData[6] = ['',]
 # end patch
-            poSizer.Add(PoTopSizer(POData))
-            if POData[0] == 'MD':
-                poSizer.Add(MDDataSizer(POData))
-            else:           #'SH'
-                if POData[4]:       #SH order > 0
-                    textJ = G2lat.textureIndex(POData[5])
-                    poSizer.Add(wx.StaticText(DData,wx.ID_ANY,' Spherical harmonic coefficients: '+'Texture index: %.3f'%(textJ))
-                        ,0,wx.TOP|wx.BOTTOM,5)
-                    poSizer.Add(SHDataSizer(POData),0,wx.TOP|wx.BOTTOM,5)
-                    poSizer.Add(SHPenalty(POData),0,wx.TOP|wx.BOTTOM,5)
-                    
-            bottomSizer.Add(poSizer,0,wx.TOP|wx.BOTTOM,5)
-            bottomSizer.Add(ExtSizer('PWDR'),0,wx.TOP|wx.BOTTOM,5)
-            if generalData['Type'] != 'magnetic': 
-                bottomSizer.Add(BabSizer(),0,wx.BOTTOM,5)
+                poSizer.Add(PoTopSizer(POData))
+                if POData[0] == 'MD':
+                    poSizer.Add(MDDataSizer(POData))
+                else:           #'SH'
+                    if POData[4]:       #SH order > 0
+                        textJ = G2lat.textureIndex(POData[5])
+                        poSizer.Add(wx.StaticText(DData,wx.ID_ANY,' Spherical harmonic coefficients: '+'Texture index: %.3f'%(textJ))
+                            ,0,wx.TOP|wx.BOTTOM,5)
+                        poSizer.Add(SHDataSizer(POData),0,wx.TOP|wx.BOTTOM,5)
+                        poSizer.Add(SHPenalty(POData),0,wx.TOP|wx.BOTTOM,5)
+                        
+                bottomSizer.Add(poSizer,0,wx.TOP|wx.BOTTOM,5)
+                bottomSizer.Add(ExtSizer('PWDR'),0,wx.TOP|wx.BOTTOM,5)
+                if generalData['Type'] != 'magnetic': 
+                    bottomSizer.Add(BabSizer(),0,wx.BOTTOM,5)
+            else:   #turn off PWDR intensity related paramters for LeBail refinement
+                UseList[G2frame.hist]['Scale'][1] = False
+                UseList[G2frame.hist]['Pref.Ori.'][2] = False
+                UseList[G2frame.hist]['Extinction'][1] = False
+                for item in UseList[G2frame.hist]['Babinet']:
+                    UseList[G2frame.hist]['Babinet'][item][1] = False
+                G2G.G2MessageBox(G2frame,'Refinement flags for Phase fraction, Preferred orientation, Extinction & Babinet are now off',
+                    title='LeBail refinement flag notice')
         elif G2frame.hist[:4] == 'HKLF':
             bottomSizer.Add(ExtSizer('HKLF'),0,wx.BOTTOM,5)

trunk/GSASIIstrMath.py

@@ -2599 +2599 @@
 def GetIntensityCorr(refl,im,uniq,G,g,pfx,phfx,hfx,SGData,calcControls,parmDict):
     'Needs a doc string'    #need powder extinction!
-    parmDict[phfx+'Scale'] = max(1.e-12,parmDict[phfx+'Scale'])                        #put floor on phase fraction scale
-    parmDict[hfx+'Scale'] = max(1.e-12,parmDict[hfx+'Scale'])                        #put floor on phase fraction scale
+    parmDict[phfx+'Scale'] = max(1.e-12,parmDict[phfx+'Scale'])                      #put floor on phase fraction scale
+    parmDict[hfx+'Scale'] = max(1.e-12,parmDict[hfx+'Scale'])                        #put floor on histogram scale
     Icorr = parmDict[phfx+'Scale']*parmDict[hfx+'Scale']*refl[3+im]               #scale*multiplicity
     if 'X' in parmDict[hfx+'Type']: