|
|
@5231
|
3 years |
toby |
remove duplicate dir
|
|
|
@5230
|
3 years |
vondreele |
add G2export_racket.py -it seems to work ok now.
|
|
|
@5229
|
3 years |
vondreele |
add mossing figures
|
|
|
@5228
|
3 years |
toby |
updated Tutorials web page for PDFfit
|
|
|
@5227
|
3 years |
vondreele |
|
|
|
@5226
|
3 years |
vondreele |
add missing figs
|
|
|
@5225
|
3 years |
vondreele |
add missing figs
|
|
|
@5224
|
3 years |
vondreele |
fix file reference
|
|
|
@5223
|
3 years |
vondreele |
bad name - fixed
|
|
|
@5222
|
3 years |
vondreele |
missing figures for PDFfit-III
|
|
|
@5221
|
3 years |
toby |
updated Tutorials web page for PDFfit
|
|
|
@5220
|
3 years |
vondreele |
Minor correction to PDFfit initialization stuff in G2phsGUI
|
|
|
@5219
|
3 years |
vondreele |
Add PDFfit-IV tutorial & small corrections to PDFfit-II and PDFfit-III …
|
|
|
@5218
|
3 years |
vondreele |
fix copy issues in TransformDialog? so that new phase is independent of …
|
|
|
@5217
|
3 years |
toby |
further reorg of sequential table build
|
|
|
@5216
|
3 years |
toby |
improve display of processed constraints
|
|
|
@5215
|
3 years |
vondreele |
Add new PDFfit-III tutorial
|
|
|
@5214
|
3 years |
vondreele |
yet another fi to seq PDFfit - fix tabulation error
|
|
|
@5213
|
3 years |
toby |
add proper computation for Mass fractions (not yet used)
|
|
|
@5212
|
3 years |
vondreele |
add new tool for showing neutron, x-ray & magnetic (if any) form …
|
|
|
@5211
|
3 years |
vondreele |
fix bug in background deriv function
|
|
|
@5210
|
3 years |
vondreele |
add more to bad copy error for instrument parameters
fixes to seq. PDFfit
|
|
|
@5209
|
3 years |
toby |
fix edit error
|
|
|
@5208
|
3 years |
toby |
better error msg on invalid cell tensor
|
|
|
@5207
|
3 years |
toby |
show error on invalid cell tensor
|
|
|
@5206
|
3 years |
vondreele |
one more fix to seq. PDFfit
|
|
|
@5205
|
3 years |
vondreele |
more fixes to pdffit & sequential PDFfit - now working
|
|
|
@5204
|
3 years |
toby |
track dep & indep parms better; create fmtESD to flag su vals from dep …
|
|
|
@5203
|
3 years |
vondreele |
fix 'Type' bug in getBackground for stacking fault simulations
add new …
|
|
|
@5202
|
3 years |
toby |
fix constraint sums -- I hope
|
|
|
@5201
|
3 years |
toby |
update tutorials web page
|
|
|
@5200
|
3 years |
vondreele |
fix unclosed file errors in G2pdf_gr
|
|
|
@5199
|
3 years |
vondreele |
Add documents for PDFfit to diffpy
|
|
|
@5198
|
3 years |
toby |
new spin/TextCtrl widget
|
|
|
@5197
|
3 years |
vondreele |
introduce 4 PDFfit tutorials to GSAS-II
some fixes driven by tutorial …
|
|
|
@5196
|
3 years |
vondreele |
new PDFfit-II tutorial
|
|
|
@5195
|
3 years |
vondreele |
New PDFfit-I tutorial
|
|
|
@5194
|
3 years |
toby |
include wx.Yield during refinement progress updates
|
|
|
@5193
|
3 years |
vondreele |
fix q-plot reflection marker bug
|
|
|
@5192
|
3 years |
toby |
fix constraints where sum is not the same for all eqns
|
|
|
@5191
|
3 years |
toby |
pseudovars & parametric fitting fixes; add G2 version to CIFs
|
|
|
@5190
|
3 years |
toby |
remove out of date damping mention, improve Controls formatting
|
|
|
@5189
|
3 years |
toby |
fix ISO mode display, atoms and dep. params
|
|
|
@5188
|
3 years |
vondreele |
fix G2pwd.UpdatePDFfit to correctly update data set variables (dscale, …
|
|
|
@5187
|
3 years |
toby |
more seq fixes: no SetISOmodes msgs; cleanup tbl creation & fix iso …
|
|
|
@5186
|
3 years |
vondreele |
remove neg profile width warning for EDX data & saved profile; gives …
|
|
|
@5185
|
3 years |
toby |
seq: load only used phases into parmDict, speed constr. check; trim …
|
|
|
@5184
|
3 years |
vondreele |
fix instrument resolution plot update after parameter change & fix …
|
|
|
@5183
|
3 years |
vondreele |
Add a list of atoms moved by each ISO mode
|
|
|
@5182
|
3 years |
vondreele |
some cosmetic code fixes here & there
implement/fix LeBail? refinments …
|
|
|
@5181
|
3 years |
toby |
use angle radii & and show value for selected angle
|
|
|
@5180
|
3 years |
toby |
fix angle searching to use angle radii
|
|
|
@5179
|
3 years |
toby |
more work on Dist & Angle GUI for Seq Table
|
|
|
@5178
|
3 years |
toby |
fix wrong indent on search code & remove code that caused crash on …
|
|
|
@5177
|
3 years |
toby |
fixups to distances in SeqRes? table
|
|
|
@5176
|
3 years |
toby |
Report error location for ouch #0
|
|
|
@5175
|
3 years |
vondreele |
Add a Calculate Rings menu item to Image/Calibrate?; useful for very …
|
|
|
@5174
|
3 years |
vondreele |
adjust powder contour plots so run no. is at center of bin; this …
|
|
|
@5173
|
3 years |
vondreele |
Add the pattern name to the plot status line for contour powder patterns
|
|
|
@5172
|
3 years |
vondreele |
fix problem in G2pwdGUI.InstCopy? for missing Source item
|
|
|
@5171
|
3 years |
vondreele |
fix ApplyModeDisp? to follow site symmetry rules.
Add xyz pointers to …
|
|
|
@5170
|
3 years |
toby |
deal with ISODISP _iso_coordinate_formula with - rather than +
|
|
|
@5169
|
3 years |
vondreele |
fix full symbol interpretation (remove a comment by ISODISTORT)
|
|
|
@5168
|
3 years |
toby |
fixes to warn rather than fail with Python 3.10
|
|
|
@5167
|
3 years |
vondreele |
extend OnAllSampleLoad? to read simple lists of data no., value (e.g. …
|
|
|
@5166
|
3 years |
vondreele |
implement ISODISTORT displacement mode parameters for PDFfit
limited …
|
|
|
@5165
|
3 years |
vondreele |
fix structure plot stepping bug with & without sequential fits
|
|
|
@5164
|
3 years |
toby |
some PWD cleanups from Laue Fringe work & fullrmc
|
|
|
@5163
|
3 years |
vondreele |
implement structure drawing that follows changes from sequential PDFfits
|
|
|
@5162
|
3 years |
vondreele |
add an "Are you sure" to the save distortion mode values button
fix …
|
|
|
@5161
|
3 years |
vondreele |
cleanup constraint display - remove excessive wx.RIGHT,wx.LEFT, etc. - …
|
|
|
@5160
|
3 years |
vondreele |
fix parameter name issues for sequential PDFFIT RESULTS
|
|
|
@5159
|
3 years |
toby |
reformat Phase help page; needs missing figures
|
|
|
@5158
|
3 years |
vondreele |
correct keys for sequential PDFfit refinements - now all int
|
|
|
@5157
|
3 years |
toby |
clean up ISODISTORT GUI and add ne buttons
|
|
|
@5156
|
3 years |
toby |
clean up ISO mode printing
|
|
|
@5155
|
3 years |
vondreele |
fix update of ISODISTORT modes if not refined.
|
|
|
@5154
|
3 years |
vondreele |
fix to ISODISTORT mode result listing after refinement
|
|
|
@5153
|
3 years |
toby |
revamp of constraints New Var does not use dependent param vary flags; …
|
|
|
@5152
|
3 years |
vondreele |
fix RMC GUI options for PDFfit
fix background Bragg peak fits for EDX data
|
|
|
@5151
|
3 years |
toby |
improve seq. ref. constraint warning
|
|
|
@5150
|
3 years |
toby |
add CSV seq exports; fix multiphase seq CIF exports
|
|
|
@5149
|
3 years |
toby |
more doc formatting cleanup
|
|
|
@5148
|
3 years |
toby |
add/fix comments
|
|
|
@5147
|
3 years |
vondreele |
Add new routine to G2lat - AplusDij? & use it in a couple of places
add …
|
|
|
@5146
|
3 years |
toby |
fix slider
|
|
|
@5145
|
3 years |
toby |
fix testDeriv to handle derivatives of parameters created by …
|
|
|
@5144
|
3 years |
vondreele |
G2pwd - close file left unclosed (fqdata)
skip generating …
|
|
|
@5143
|
3 years |
toby |
more Mogul fixes
|
|
|
@5142
|
3 years |
toby |
revise CIF output to include only unique su values
|
|
|
@5141
|
3 years |
vondreele |
avoid crash & provide error message on console if EDX data used in a …
|
|
|
@5140
|
3 years |
vondreele |
fix fitting background points for EDX data
|
|
|
@5139
|
3 years |
vondreele |
further fixes for putting Type in the DData entry.
|
|
|
@5138
|
3 years |
vondreele |
Add histogram Type to default DData dictionary; needed for EDX but …
|
|
|
@5137
|
3 years |
vondreele |
fix to constraint delete function - order of delete list must be …
|
|
|
@5136
|
3 years |
toby |
warn if shift/s.u. may not be correct for CIF project export
|
|
|
@5135
|
3 years |
toby |
show that max(shtf/esd) is from all cycles; fix bug for install path …
|
|
|
@5134
|
3 years |
toby |
update MacOS M1 binaries
|
|
|
@5133
|
3 years |
toby |
deal with .so files not working in upgraded OS on M1 Mac
|
|
|
@5132
|
3 years |
toby |
correct M1 Mac bin path name
|
|
|