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@797
|
13 years |
vondreele |
some fixes to TOF stuff
some fixes to SXC stuff
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@796
|
13 years |
vondreele |
revise instrument parameters (again); now two dictionaries
revise key …
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@795
|
13 years |
vondreele |
implement TOF input, peak search & fitting
auto peak search
convert …
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@792
|
13 years |
vondreele |
change instrument parameters to dict from lists
chase down effects - …
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@777
|
13 years |
vondreele |
fix problem with missing peakMax
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@766
|
13 years |
vondreele |
map peaks now show with gray scale proportional to density
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@762
|
13 years |
toby |
update py files to use native line ends, add update from svn to help …
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@759
|
13 years |
vondreele |
fix excessive redraws of structure - no redraw on setfocus
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@758
|
13 years |
vondreele |
fix in sph. harm. for hex/rhom/trig
fix for view dir in plots
remove a …
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@757
|
13 years |
vondreele |
remove inverse check from peak search - didn't work
implement Zshift …
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@756
|
13 years |
vondreele |
change display of density maps - now faster
implement a view direction …
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@755
|
13 years |
vondreele |
fix rotation about view direction
eliminate divide by zero error in …
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@754
|
13 years |
vondreele |
final cleanup of quaternion stuff
|
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|
@753
|
13 years |
vondreele |
change structure rotation mechanisms - now use quaternions
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@750
|
13 years |
vondreele |
put inverse checker back in SearchMap?
add atom rename facility
update …
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@749
|
13 years |
vondreele |
fix crash on delete atoms
couple roll & peak shift on charge flip maps
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@748
|
13 years |
vondreele |
change view point operation & use view point as atom insertion
remove …
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@740
|
13 years |
vondreele |
bug fixes
|
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@729
|
13 years |
vondreele |
minor fixes to mapPeaks plotting
begin to add charge flipping tutorial
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@728
|
13 years |
vondreele |
trap sqrt error from bad U,V,W
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@727
|
13 years |
vondreele |
add generic sort routine to G2mth
add dzero - distance of peak from …
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@725
|
13 years |
vondreele |
change f-map color to green
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@723
|
13 years |
toby |
fix other mac/linux error with file naming
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@721
|
13 years |
vondreele |
add dist/angle calc for map peaks
unique peaks selects unique set from …
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@720
|
13 years |
vondreele |
fix to map peak plotting
|
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@713
|
13 years |
vondreele |
fix plot display size for Mac
|
|
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@712
|
13 years |
vondreele |
fis Mac crash after PWDR delete
|
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@711
|
13 years |
vondreele |
fix Mac crash on use of key press pulldown
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@710
|
13 years |
vondreele |
update garnet tutorial to reflect new options
fix backbone plotting …
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@706
|
13 years |
vondreele |
fix sumimage - missing code!
more work on strain fitting
|
|
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@699
|
13 years |
vondreele |
implement restore data window after refine
implement sample parameters …
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@696
|
13 years |
vondreele |
begin implementation of image strain analysis - GUI stuff first
make …
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@687
|
13 years |
vondreele |
histogram wtFactors for PWDR & HKLF (latter not implemented yet)
means …
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@683
|
13 years |
vondreele |
fix dlg.Destroy as needed
continue restraints work
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|
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@661
|
13 years |
toby |
complete revision number tracking
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|
|
@646
|
13 years |
vondreele |
eliminate Friedel argument in genHKLf - didn't do anything
work on …
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@644
|
13 years |
vondreele |
fix map plotting error
working on findOffset
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|
|
@636
|
13 years |
vondreele |
remove self.PWDR - not used
remove phase data plots & cell refine flag …
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@630
|
13 years |
vondreele |
major mods for HKLF data
remove some dead code
mark more code as dead …
|
|
|
@623
|
13 years |
vondreele |
remove powder read from Data menu
remove 'menu' from import menus
use …
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|
@620
|
13 years |
vondreele |
remove excessive tabs in source code
fix HKL controls GUI
change HKL …
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|
|
@612
|
13 years |
vondreele |
complete combined x/n exercise & fix bugs uncovered in process
made …
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|
|
@584
|
13 years |
vondreele |
add coding line everywhere
more options in sample parm copy
|
|
|
@573
|
13 years |
vondreele |
add 'None' as one of the phase data plot options
trap failed charge …
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|
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@552
|
13 years |
vondreele |
charge flipping
|
|
|
@537
|
13 years |
vondreele |
some refactoring/rearrangement in GSASIIgrid.py
fixes to …
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|
|
@536
|
13 years |
vondreele |
add more text to help file
refactor image GUI stuff
add centerAzm …
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|
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@529
|
13 years |
vondreele |
fix rho min/max issues for contouring
fix errors in Fosq extraction in …
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|
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@526
|
13 years |
vondreele |
make SetNewPhase? routine in GSASIIIO.py to initialize phase info
begin …
|
|
|
@523
|
13 years |
toby |
fix plotting with as-inititalized values (oldxy & Fourier map); fix …
|
|
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@522
|
13 years |
vondreele |
begin map search routines - GUI so far
make map move outside unit cell …
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|
|
@521
|
13 years |
vondreele |
fourier maps & contouring - limiting sphere
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|
|
@520
|
13 years |
vondreele |
separate getHKLmax
|
|
|
@515
|
13 years |
vondreele |
add num variables to ViewLSparams
final fixup of error analysis plots …
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@513
|
13 years |
vondreele |
cleanup wxID entries
implement powder pattern error analysis
implement …
|
|
|
@505
|
13 years |
vondreele |
start on plotting "error analysis" for powder patterns
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|
|
@493
|
13 years |
vondreele |
clean up help stuff - get OK respons from resize & now scrolls down a …
|
|
|
@484
|
13 years |
vondreele |
change authorship
split GSASIIelem into a GUI & non-GUI parts
replace …
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|
|
@483
|
13 years |
vondreele |
changes to eliminate wx objects (Colour & Point) from being saved in …
|
|
|
@478
|
13 years |
vondreele |
spelling error!
reduce unneeded Draw() commands in structure plotting. …
|
|
|
@477
|
13 years |
vondreele |
final fixes to dist-angle-torsion calc.
|
|
|
@468
|
13 years |
vondreele |
changed self to G2frame everywhere in all "sub" files that use it …
|
|
|
@466
|
13 years |
vondreele |
fix for PE tif file reading
invert y-axis on images
|
|
|
@460
|
13 years |
vondreele |
add more text to help/gsasII.html
finish best plane calcs
allow …
|
|
|
@456
|
13 years |
toby |
determine path to GSAS files from file; trap & reset focus for …
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|
|
@453
|
13 years |
vondreele |
refactor GSASIIgrid
new Hessian based least squares
new GSASIImath.py …
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|
|
@450
|
13 years |
vondreele |
|
|
|
@449
|
13 years |
toby |
Help updates: refactor help routine; use internal browser on Windows; …
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|
|
@440
|
14 years |
vondreele |
fix the mustrain ve microstrain title problem = GSASII.py
take …
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|
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@432
|
14 years |
vondreele |
remove test prints from GSASIIIO
new Gmat2AB routine
work on the DData …
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|
|
@431
|
14 years |
vondreele |
3D plots for mustrain & size now have correct aspect ratio
title …
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|
|
@430
|
14 years |
vondreele |
NB: There are a few stray print statements in this version
Some work …
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|
|
@428
|
14 years |
vondreele |
begin something for plotting size & PO figures as well as mustrain …
|
|
|
@426
|
14 years |
vondreele |
allow repositioning of reflection markers (up or down)
|
|
|
@423
|
14 years |
vondreele |
Add help to all dataDisplay menus
remove ring fit points from …
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|
|
@420
|
14 years |
vondreele |
small fixes including
move msg = in SetVaryFlags? outside loop …
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|
|
@404
|
14 years |
vondreele |
put error bars on seq refinement plots
add cubic elastic strain coeff …
|
|
|
@400
|
14 years |
vondreele |
new default for Vcov contour plot - RdYlGn?
faster cleanup on …
|
|
|
@399
|
14 years |
vondreele |
Implement sequential refinement
remove print "load" & "save" for each …
|
|
|
@396
|
14 years |
vondreele |
make image calibration 0-360 (not -180-180) to match usual integration …
|
|
|
@392
|
14 years |
vondreele |
put parmNames on y-axis of covariance plot
|
|
|
@391
|
14 years |
vondreele |
set default atom frac=1 for cif files
store covMatrix not normalized …
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|
|
@390
|
14 years |
vondreele |
Add tooltip to covariance plot
clean up LS output formats
Add Fobs …
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|
|
@388
|
14 years |
vondreele |
add SGPolax to SGData dictionary - marks arbitrary axes in polar space …
|
|
|
@383
|
14 years |
vondreele |
small fixes
|
|
|
@373
|
14 years |
vondreele |
new covariance item in tree
new covariance matrix plotting
save cov …
|
|
|
@360
|
14 years |
vondreele |
just backup before trip
|
|
|
@346
|
14 years |
vondreele |
GSASIIgrid.py - clear peaks from peak fit list & allow change from lam …
|
|
|
@342
|
14 years |
vondreele |
major modifications to get 1st "working" version of Refine
Add …
|
|
|
@335
|
14 years |
vondreele |
Add delete Pawley list; scratch "leBail" from things
mods to texture …
|
|
|
@327
|
14 years |
vondreele |
fix to path name for atomdata.dat
fix to texture display - can't have …
|
|
|
@326
|
14 years |
vondreele |
remove cf2py
add inverse polefigure
|
|
|
@313
|
14 years |
vondreele |
work on texture display & computation
|
|
|
@311
|
14 years |
vondreele |
finish new indexing refinement stuff
more on texture plotting
|
|
|
@303
|
14 years |
vondreele |
Allow reading of xye (Topas style) files
Begin implementation of …
|
|
|
@296
|
14 years |
vondreele |
major change to peak fitting in GSASIIpwd.py & GSASIIpwdGUI.py
"Auto …
|
|
|
@289
|
14 years |
vondreele |
|
|
|
@282
|
14 years |
vondreele |
fix "off by one" error in polymask.for
fix azimuth error in …
|
|
|
@281
|
14 years |
vondreele |
implement reusable GSAS-II image files that can be read into a new …
|
|
|
@273
|
14 years |
vondreele |
output of S(Q) and G(R) as files for other use
some effort to fix …
|
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