|
|
@2487
|
7 years |
vondreele |
fix unit cell search range for bond distance & angle restraints
fix …
|
|
|
@2486
|
7 years |
vondreele |
fix mag form factor lookup - some aren't chemical valences (e.g. Fe+4) …
|
|
|
@2485
|
7 years |
toby |
add Compute density to Phase/atoms
|
|
|
@2484
|
7 years |
vondreele |
fix transform to properly move magnetic moments (if space group is not …
|
|
|
@2483
|
7 years |
vondreele |
fix site symmetry issues for magnetic moments on special positions
|
|
|
@2482
|
7 years |
vondreele |
allow atom constraints between phases
|
|
|
@2481
|
7 years |
vondreele |
force Transform to delete nonmagnetic atoms if phase made magnetic & …
|
|
|
@2480
|
7 years |
vondreele |
add make magnetic phase to General/Transform? option
trap missing rigid …
|
|
|
@2479
|
7 years |
toby |
Rework plotting to refresh after refinements
|
|
|
@2478
|
7 years |
vondreele |
work up to magnetic structure factor calcs.
|
|
|
@2477
|
7 years |
vondreele |
fix bug in integration limits
set better default plot offsets for …
|
|
|
@2476
|
7 years |
vondreele |
Add new feature to structure plots - display an hkl plane or stack of …
|
|
|
@2475
|
7 years |
vondreele |
fix spin transform errors - now match old GSAS
fix spin flip import …
|
|
|
@2474
|
7 years |
vondreele |
fix spin inversion plot & some refine list issues
|
|
|
@2473
|
7 years |
vondreele |
work on magnetic structures - import from EXP, plotting, LS refine …
|
|
|
@2472
|
7 years |
vondreele |
fix color issues with structure plots
|
|
|
@2471
|
7 years |
vondreele |
complete atom/draw atom editing for magnetic structures
|
|
|
@2470
|
7 years |
vondreele |
magnetic structure editing/drawing work - includes site symm restrictions
|
|
|
@2469
|
7 years |
vondreele |
implement plot of Dzero line on Strain plots from 2D images.
|
|
|
@2468
|
7 years |
vondreele |
add dzero calc from compression 2D images
plot magnetic structures; …
|
|
|
@2467
|
7 years |
vondreele |
modify 2D strain Dcalc to be dmin+(dmax-dmin)/4. per Yan Gao
begin …
|
|
|
@2466
|
7 years |
vondreele |
implement user entered starting Marquardt lambda value (order of …
|
|
|
@2465
|
7 years |
toby |
implement 3 dimensional HDF images
|
|
|
@2464
|
7 years |
vondreele |
magnetic space group work - spin flip display
|
|
|
@2463
|
7 years |
toby |
allow comma & semicolon for .xye; validate .csv
|
|
|
@2462
|
7 years |
toby |
allow semicolon for .csv
|
|
|
@2461
|
7 years |
vondreele |
magnetic space group determination done
|
|
|
@2460
|
7 years |
vondreele |
further fixes to edf importer
|
|
|
@2459
|
7 years |
vondreele |
fix import of edf SignedLong? image
|
|
|
@2458
|
7 years |
vondreele |
Mag space group work
|
|
|
@2457
|
7 years |
vondreele |
fix bug in PWDR selection for PDF
|
|
|
@2456
|
7 years |
toby |
fix Rigaku bug
|
|
|
@2455
|
7 years |
vondreele |
implement Clip_on as config parameter with True as default
|
|
|
@2454
|
7 years |
vondreele |
make clip_on configurablle
|
|
|
@2453
|
7 years |
vondreele |
changed clip_on=False to True in GSASIIplot.py. Stops plotting outside …
|
|
|
@2452
|
7 years |
toby |
read Rigaku 2 column files
|
|
|
@2451
|
7 years |
vondreele |
Add target atom type selection to sphere of enclosure
|
|
|
@2450
|
7 years |
vondreele |
fix error in matrix in getCellEsd & RetDistAngle?
Add new atom drawing …
|
|
|
@2449
|
7 years |
toby |
Fix CIF exports; make sure exporters are imported only once (on Mac)
|
|
|
@2448
|
7 years |
vondreele |
fix error in getCellEsd - bad v*mat*v inner product. Cell esds now OK
|
|
|
@2447
|
7 years |
toby |
fix/cleanup 'Reverse Seq'
|
|
|
@2446
|
7 years |
toby |
rebuilds after unpack update
|
|
|
@2445
|
7 years |
vondreele |
fixes to pack_f.for & unpack_cbf.for; replace all binwin2.7 & …
|
|
|
@2444
|
7 years |
vondreele |
small correction to unpack_cbf.py, new binwin2.7 & binwin66-2.7
|
|
|
@2443
|
7 years |
toby |
rebuild 64 bin mac & linux binaries
|
|
|
@2442
|
7 years |
vondreele |
missed one
|
|
|
@2441
|
7 years |
vondreele |
fix bug in unpack_cbf.for, cleanup G2img_CF.py & reload win32 & win64 …
|
|
|
@2440
|
7 years |
vondreele |
a modified version of G2img_CBF
|
|
|
@2439
|
7 years |
vondreele |
missing unpack_cbf.pyd
|
|
|
@2438
|
7 years |
vondreele |
new CBF importer with fortran routine to decode image - much, much faster
|
|
|
@2437
|
7 years |
vondreele |
new fortran routine for reading cbf files
|
|
|
@2436
|
7 years |
vondreele |
implement decimal azimuth ranges (from integer)
|
|
|
@2435
|
7 years |
toby |
relabel other 'Edit' menus to avoid Mac glitch
|
|
|
@2434
|
7 years |
toby |
Fix constraint edit bug in wx3.0; relabel constraint menu items to …
|
|
|
@2433
|
7 years |
toby |
update for sequential export
|
|
|
@2432
|
7 years |
vondreele |
allow cbf file imports
|
|
|
@2431
|
7 years |
vondreele |
fix problem with wxPython 3.x with changing text entry focus. Needed a …
|
|
|
@2430
|
7 years |
vondreele |
force limits from d-min to be within allowed range & less than 168.5 …
|
|
|
@2429
|
7 years |
vondreele |
force powder histograms limits to conform to dmin choice for Pawley …
|
|
|
@2428
|
7 years |
vondreele |
allow saving rigid body drawing as jpeg/tiff/bmp
|
|
|
@2427
|
7 years |
vondreele |
forgot one
|
|
|
@2426
|
7 years |
vondreele |
apply reverse to seq. results if done in reverse to restore to …
|
|
|
@2425
|
7 years |
vondreele |
tidy up GetTthAzmDsp?
add comments to plotXY & plotXYZ
|
|
|
@2424
|
7 years |
toby |
windows install fixes
|
|
|
@2423
|
7 years |
vondreele |
fix bug in charge flip phase plotting
|
|
|
@2422
|
7 years |
vondreele |
allow saving of plotted XY data from PlotXY as csv file
|
|
|
@2421
|
7 years |
vondreele |
name sequential results by type of sequence (peak fit, SASD, etc.) so …
|
|
|
@2420
|
7 years |
vondreele |
add "All scales value" to SumDialog?
|
|
|
@2419
|
7 years |
vondreele |
Add use of PWDR limits for PDF calculations
improve duplicate peak …
|
|
|
@2418
|
7 years |
vondreele |
another fix to GE importer
|
|
|
@2417
|
7 years |
vondreele |
fix PDF graphic errors
|
|
|
@2416
|
7 years |
vondreele |
fix issues with summing images & powder patterns - SumDialog? is now a …
|
|
|
@2415
|
7 years |
vondreele |
fix Cancel bugs in image integrate all
|
|
|
@2414
|
7 years |
toby |
support for Rigaku .txt file
|
|
|
@2413
|
7 years |
vondreele |
fix bug in ge image importer
|
|
|
@2412
|
7 years |
vondreele |
fixes to PDF stuff
|
|
|
@2411
|
7 years |
vondreele |
fix image plot rescaling problem
add ring graininess determination - …
|
|
|
@2410
|
7 years |
toby |
update for new mac build
|
|
|
@2409
|
7 years |
vondreele |
fix GE image importer
|
|
|
@2408
|
7 years |
toby |
error message for Bruker v. 4 Raw file import
|
|
|
@2407
|
7 years |
toby |
downdate error
|
|
|
@2406
|
7 years |
vondreele |
change spin flip from red/black to -1/1
|
|
|
@2405
|
7 years |
vondreele |
fix missing 'Modulated' key problem
|
|
|
@2404
|
7 years |
toby |
Fix problem saving windows paths
|
|
|
@2403
|
7 years |
toby |
fix William's bug
|
|
|
@2402
|
7 years |
vondreele |
a patch for use of old fortran binaries
|
|
|
@2401
|
7 years |
vondreele |
begin adding magnetism; change space group fortran code
modify …
|
|
|
@2400
|
7 years |
vondreele |
remove duplicate tutorials
|
|
|
@2399
|
7 years |
vondreele |
|
|
|
@2398
|
7 years |
vondreele |
|
|
|
@2397
|
7 years |
vondreele |
|
|
|
@2396
|
7 years |
vondreele |
|
|
|
@2395
|
7 years |
vondreele |
|
|
|
@2394
|
7 years |
vondreele |
|
|
|
@2393
|
7 years |
vondreele |
|
|
|
@2392
|
7 years |
vondreele |
|
|
|
@2391
|
7 years |
vondreele |
|
|
|
@2390
|
7 years |
vondreele |
|
|
|
@2389
|
7 years |
vondreele |
|
|
|
@2388
|
7 years |
vondreele |
|
|
|