|
|
|
@3521
|
7 years |
vondreele |
fix In neutron scattering length info
add MAXMAGN.py
minor changes to …
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|
|
|
@3465
|
7 years |
vondreele |
deal with export/import issues for mag cif files
fix bug for new phase …
|
|
|
|
@3450
|
7 years |
vondreele |
put a check on existence of "dataWindow" before clearing it - line …
|
|
|
|
@3435
|
7 years |
vondreele |
make new routine GetSpGrpfromUser? & use it inGeneral & Transform fo …
|
|
|
|
@3434
|
7 years |
vondreele |
working magnetic extinction check routine w. reference & comments - works
|
|
|
|
@3433
|
7 years |
vondreele |
objectScanIgnore additions
put in phase fro mag reflections
better …
|
|
|
|
@3425
|
7 years |
vondreele |
use nxs = np.newaxis in G2spc.
Add 2 functions for checking symm …
|
|
|
|
@3418
|
7 years |
vondreele |
move SGMagSpinBox from G2phsGUI to G2ctrlGUI
add selection of spin …
|
|
|
|
@3400
|
7 years |
vondreele |
fix space group operator interpreter for magnetic mcif files (only …
|
|
|
|
@3399
|
7 years |
vondreele |
remove debug print from ApplyStringOpsMom?
|
|
|
|
@3398
|
7 years |
vondreele |
drawing reload (almost) works for magnetic structures - suspect for …
|
|
|
|
@3397
|
7 years |
vondreele |
fix Constraints problem when no histograms (or phases)
display new BNS …
|
|
|
|
@3396
|
7 years |
vondreele |
set refList=False for a couple of calls to GetHistogramPhaseData? where …
|
|
|
|
@3393
|
7 years |
vondreele |
implement GUI to change BNS lattice centering for magnetic space …
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|
|
|
@3390
|
7 years |
vondreele |
fix issue with deleted phases in Restraints - they are now deleted …
|
|
|
|
@3387
|
7 years |
vondreele |
fix to GetLittleGrpOps?
|
|
|
|
@3380
|
7 years |
vondreele |
Add several text blocks to tutorial listing & switch format to display …
|
|
|
|
@3379
|
7 years |
vondreele |
fix problem of bad space group symbol (no field spaces) found in cif file
|
|
|
|
@3340
|
7 years |
vondreele |
make testDeriv py3 compatible
fix problem with Reload draw atoms - mag …
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|
|
|
@3338
|
7 years |
vondreele |
fix SpnFlp? issues for mcif imports - had messed up mag structure …
|
|
|
|
@3336
|
7 years |
vondreele |
fix atom multiplicity doubling if centro & magnetic imported from cif …
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|
|
|
@3335
|
7 years |
vondreele |
fix display of magnetic symmetry operators with colors ("Show spins")
|
|
|
|
@3334
|
7 years |
vondreele |
correct issues with import & display of incommensurate magnetic spin …
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|
|
|
@3320
|
7 years |
vondreele |
implement new delt/sig subplot for PWDR & SASD plots - nvoked with 'w' …
|
|
|
|
@3317
|
7 years |
vondreele |
magnetic site symmetry restrictions on moments & magnetic site …
|
|
|
|
@3311
|
7 years |
vondreele |
remove unused SytSym? argument from GetCSpqinel - not needed
|
|
|
|
@3310
|
7 years |
vondreele |
still more magsym fixes
|
|
|
|
@3309
|
7 years |
vondreele |
remove debug prints!
|
|
|
|
@3308
|
7 years |
vondreele |
more fixes for mag site symmetry constraints
|
|
|
|
@3307
|
7 years |
vondreele |
provide print tool for magnetic space group operators that can be fed …
|
|
|
|
@3306
|
7 years |
vondreele |
remove a debug print & fix mag site sym problem
|
|
|
|
@3302
|
7 years |
vondreele |
mag sym fixes
|
|
|
|
@3300
|
7 years |
vondreele |
magnetic phase changes, check importers, read old gpxfiles, etc.
|
|
|
|
@3297
|
7 years |
vondreele |
progress on magnetism - BNS system ok for monoclinic, orthorhombic, …
|
|
|
|
@3295
|
7 years |
vondreele |
remove superfluous calls to SpcGroup? after SGData has been defined
add …
|
|
|
|
@3293
|
7 years |
vondreele |
Fix problems with GenAtom?
|
|
|
|
@3287
|
7 years |
vondreele |
fix atom transformation issues in modulation drawings.
|
|
|
|
@3286
|
7 years |
vondreele |
add modulation movies to structure drawings; makes gif files for both …
|
|
|
|
@3285
|
7 years |
vondreele |
start on symmetry constraints for magnetic modulations
add error …
|
|
|
|
@3282
|
7 years |
vondreele |
proper handling of gray group supersymmetry symbols, fix special …
|
|
|
|
@3276
|
7 years |
vondreele |
fixes to WaveSizer? for individual wavetypes.
fixes to GetSSfxuinel to …
|
|
|
|
@3266
|
7 years |
vondreele |
change modulated wave type assignments so one for each kind of wave …
|
|
|
|
@3257
|
7 years |
vondreele |
fixes to incommensurate space group symbol handling
|
|
|
|
@3254
|
7 years |
vondreele |
fix XsSave? names problem (G2IO)
try to get ProgressBar? box to stay on …
|
|
|
|
@3247
|
7 years |
vondreele |
implement pick of protein validation bar - new view point on structure …
|
|
|
|
@3245
|
7 years |
vondreele |
fix problem with incommensurate magnetic structures from CIFhklReader …
|
|
|
|
@3242
|
7 years |
vondreele |
implement calc of mean mustrain from generalized mustrain coefficients
|
|
|
|
@3239
|
7 years |
vondreele |
implement use of 2-site disordered amino acid residues in proteins: …
|
|
|
|
@3234
|
7 years |
vondreele |
new G2spc.SSChoice routine finds all allowed super space group symbols …
|
|
|
|
@3227
|
7 years |
vondreele |
incommensurate ndexing changes & fixes
|
|
|
|
@3225
|
7 years |
vondreele |
fix modulation phase
|
|
|
|
@3224
|
7 years |
vondreele |
fix phase offset in modulations
mark places to fix mag structure …
|
|
|
|
@3221
|
7 years |
vondreele |
fix import of magnetic structures from .EXP files
complete list of pre …
|
|
|
|
@3220
|
7 years |
vondreele |
minor fixes to commensurate magnetic cif import & display
|
|
|
|
@3219
|
7 years |
vondreele |
fix import mag commensurate structures - all drawn correctly now …
|
|
|
|
@3215
|
7 years |
vondreele |
mag incommensurate stuff
|
|
|
|
@3212
|
7 years |
vondreele |
fix problem of missing rd.MPhase in phase imports
work on display of …
|
|
|
|
@3211
|
7 years |
vondreele |
fix integer divide in wave display
some fixes to mcif import
|
|
|
|
@3210
|
7 years |
vondreele |
some fixes for magnetic incommensurate cifs - dealing with 2 different …
|
|
|
|
@3208
|
7 years |
vondreele |
fix transformation bug abc -> abc* needed transform of matrix - …
|
|
|
|
@3200
|
7 years |
vondreele |
fix bugs in various exporters for cif & pdb files.
allow for missing …
|
|
|
|
@3197
|
7 years |
vondreele |
Rearrange SingleStringDialog? window - put '?' at end of text box …
|
|
|
|
@3194
|
7 years |
vondreele |
fix to CifFile?
fixes to cbf & tif importers for new Pilatus 2M …
|
|
|
|
@3191
|
7 years |
vondreele |
fix integer divides in responding to unit cell changes on Unit Cells …
|
|
|
|
@3186
|
7 years |
vondreele |
revisions to integrate images so that masks are reused if not changed …
|
|
|
|
@3176
|
7 years |
vondreele |
Add A centered monoclinics to super symmetry ptssdict
Add import of …
|
|
|
|
@3172
|
8 years |
vondreele |
change from wx.DefaultSize? to our defaults if window size is 'None'
A …
|
|
|
|
@3171
|
8 years |
vondreele |
fix missing window size parameter
changes to super symmetry selection stuff
|
|
|
|
@3168
|
8 years |
vondreele |
fix phase data copy operations - needed copy.deepcopy in 2 places …
|
|
|
|
@3136
|
8 years |
vondreele |
make GSAS-II python 3.6 compliant & preserve python 2.7 use;changes: …
|
|
|
|
@3102
|
8 years |
toby |
docs for G2scripting; start thinking about how to postpone G2path.SetBinary?
|
|
|
|
@3097
|
8 years |
vondreele |
fix origin shift transformation & vec,matrix, vec transformations; now …
|
|
|
|
@2875
|
8 years |
toby |
Allow space group entry by number; move SGMessageBox to GSASIIctrls
|
|
|
|
@2809
|
8 years |
vondreele |
add new transform option for moving atoms from setting #1 --> #2
|
|
|
|
@2753
|
8 years |
vondreele |
minor shuffling about for atom constraints - no discernable impact …
|
|
|
|
@2567
|
8 years |
vondreele |
fix to export CIF sym. op. problem
use ValidatedTxtctrl? for all values …
|
|
|
|
@2549
|
9 years |
vondreele |
fix special position restrictions on Mx,MY,Mz on -1 site.
|
|
|
|
@2546
|
9 years |
vondreele |
cleanup of all GSASII main routines - remove unused variables, dead …
|
|
|
|
@2544
|
9 years |
vondreele |
major cleanup of unused variables, etc.
|
|
|
|
@2492
|
9 years |
vondreele |
fix handling of Lande g factor
fix Mag structure factor calcs - now OK …
|
|
|
|
@2486
|
9 years |
vondreele |
fix mag form factor lookup - some aren't chemical valences (e.g. Fe+4) …
|
|
|
|
@2483
|
9 years |
vondreele |
fix site symmetry issues for magnetic moments on special positions
|
|
|
|
@2473
|
9 years |
vondreele |
work on magnetic structures - import from EXP, plotting, LS refine …
|
|
|
|
@2470
|
9 years |
vondreele |
magnetic structure editing/drawing work - includes site symm restrictions
|
|
|
|
@2468
|
9 years |
vondreele |
add dzero calc from compression 2D images
plot magnetic structures; …
|
|
|
|
@2467
|
9 years |
vondreele |
modify 2D strain Dcalc to be dmin+(dmax-dmin)/4. per Yan Gao
begin …
|
|
|
|
@2466
|
9 years |
vondreele |
implement user entered starting Marquardt lambda value (order of …
|
|
|
|
@2464
|
9 years |
vondreele |
magnetic space group work - spin flip display
|
|
|
|
@2461
|
9 years |
vondreele |
magnetic space group determination done
|
|
|
|
@2458
|
9 years |
vondreele |
Mag space group work
|
|
|
|
@2406
|
9 years |
vondreele |
change spin flip from red/black to -1/1
|
|
|
|
@2402
|
9 years |
vondreele |
a patch for use of old fortran binaries
|
|
|
|
@2401
|
9 years |
vondreele |
begin adding magnetism; change space group fortran code
modify …
|
|
|
|
@2367
|
9 years |
vondreele |
add display of inverse pole figure for each histogram - works but are …
|
|
|
|
@2289
|
9 years |
vondreele |
fixed interpretation of space group symbols with :1/2 at end …
|
|
|
|
@2158
|
9 years |
vondreele |
Add C1 to Bravais lattice tables - future use
some replacement of …
|
|
|
|
@2136
|
9 years |
vondreele |
fix indexing problem in 32 bit versions - Skip in ProgressDialog? …
|
|
|
|
@2075
|
10 years |
vondreele |
explicit plot destroy when GSAS2 closes
work on scrolling on phase …
|
|
|
|
@2062
|
10 years |
vondreele |
exclude non variable SS parms from constraint lists
define ZigZag? & …
|
|
|
|
@2061
|
10 years |
vondreele |
modify export app peak lists to include d-spacing as a column
fix 2x …
|
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|
