source: trunk/imports/G2phase_CIF.py

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Diff Rev Age Author Log Message
(edit) @4877   4 years toby fix read w/blank name
(edit) @4832   4 years vondreele fix gaim map calc to include cylindrical sample absorption fix phase …
(edit) @4830   4 years vondreele show more places in Absorb output improve image absorption calcs for …
(edit) @4659   5 years toby extensive Origin 1->2 updates; merge SetupGeneral? into a single …
(edit) @4635   5 years vondreele change all 'Ur' to 'r' in open commands double all '\' in G2scriptable …
(edit) @4476   5 years vondreele make sure if Uij = None that it is zero, type is 'I' and that after a …
(edit) @4475   5 years vondreele fix prolem in cif files where anisotropic params are as ...... --> …
(edit) @4410   5 years toby do much more cleanup after phase delete; refactor some importer …
(edit) @4399   5 years toby major refactoring & corrections to ISODISTORT mode import and computations
(edit) @4379   5 years toby fix isodistort constraint processing
(edit) @4158   6 years vondreele fix cif importer to read B values for Uiso
(edit) @3783   6 years vondreele fix Bruker read problem - checked with 1 & 2 block RAW 1.01 files add …
(edit) @3736   7 years vondreele modifications to allow Load Unit Cell command for incommensurate …
(edit) @3710   7 years vondreele fix issues about site sym & multilicity for mcif import of gray …
(edit) @3491   7 years vondreele fix export/import of magnetic cifs
(edit) @3465   7 years vondreele deal with export/import issues for mag cif files fix bug for new phase …
(edit) @3401   7 years vondreele fix problem with atom IDs for magnetic atoms
(edit) @3338   7 years vondreele fix SpnFlp? issues for mcif imports - had messed up mag structure …
(edit) @3335   7 years vondreele fix display of magnetic symmetry operators with colors ("Show spins")
(edit) @3334   7 years vondreele correct issues with import & display of incommensurate magnetic spin …
(edit) @3276   7 years vondreele fixes to WaveSizer? for individual wavetypes. fixes to GetSSfxuinel to …
(edit) @3266   7 years vondreele change modulated wave type assignments so one for each kind of wave …
(edit) @3261   7 years vondreele implement import of mcif with Crenel site fraction functions
(edit) @3257   7 years vondreele fixes to incommensurate space group symbol handling
(edit) @3220   7 years vondreele minor fixes to commensurate magnetic cif import & display
(edit) @3219   7 years vondreele fix import mag commensurate structures - all drawn correctly now …
(edit) @3215   7 years vondreele mag incommensurate stuff
(edit) @3211   7 years vondreele fix integer divide in wave display some fixes to mcif import
(edit) @3210   7 years vondreele some fixes for magnetic incommensurate cifs - dealing with 2 different …
(edit) @3208   7 years vondreele fix transformation bug abc -> abc* needed transform of matrix - …
(edit) @3199   7 years vondreele more revisions to the cif phase importer.
(edit) @3198   7 years vondreele fix cif phase importer - will now read commensurate magnetic & …
(edit) @3197   7 years vondreele Rearrange SingleStringDialog? window - put '?' at end of text box …
(edit) @3194   7 years vondreele fix to CifFile? fixes to cbf & tif importers for new Pilatus 2M …
(edit) @3192   7 years vondreele the cif reader will now read magnetic cif files as two phases - one …
(edit) @3191   7 years vondreele fix integer divides in responding to unit cell changes on Unit Cells …
(edit) @3186   8 years vondreele revisions to integrate images so that masks are reused if not changed …
(edit) @3172   8 years vondreele change from wx.DefaultSize? to our defaults if window size is 'None' A …
(edit) @3169   8 years vondreele more complete fixes to G2phase_CIF.py importer for incommensurate …
(edit) @3168   8 years vondreele fix phase data copy operations - needed copy.deepcopy in 2 places …
(edit) @3163   8 years vondreele fix typo in Tb neutron scattering factors; extra space fix lst output …
(edit) @3137   8 years vondreele replace old CifFile? with new py 2/7/3.6 compliant code fix cif file …
(edit) @3136   8 years vondreele make GSAS-II python 3.6 compliant & preserve python 2.7 use;changes: …
(edit) @2817   8 years vondreele major revision - move all importers to GSASIIobj & make them …
(edit) @2738   8 years vondreele removed all "except Exception as detail" blocks from importers & …
(edit) @2470   9 years vondreele magnetic structure editing/drawing work - includes site symm restrictions
(edit) @2039   10 years vondreele remove "crenelType" from SS atom data - won't be needed implement …
(edit) @2038   10 years vondreele add betaij2Uij to G2lattice revisions to SS structure factor calcs. …
(edit) @1985   10 years toby fix CIF import where ? is used for Uiso value and where iso/aniso type …
(edit) @1982   10 years vondreele add messages to cif import fail to identify atoms
(edit) @1883   10 years vondreele revise cif importer to handle atoms without type. Atom name is …
(edit) @1762   10 years vondreele fix exports of reflection csv & txt files to work for CW & TOF data as …
(edit) @1168   11 years toby update imports to provide error messages
(edit) @1147   12 years toby Complete initial ISODISPLACE implementation; mod. phase …
(edit) @1123   12 years toby add import and export routines to sphinx
(edit) @1077   12 years toby cleanup plot & svn bugs; set missing keywords; CIF export done; update docs
(edit) @1074   12 years toby more CIF work
(edit) @1069   12 years toby finally a working CIF exporter (export mechanism needs configuring); …
(edit) @1046   12 years vondreele put in missing GSASIIpath & version finder
(edit) @1006   12 years toby fix Bob's bug when multiple HKL files are read; pickup shelx …
(edit) @850   12 years vondreele fix problem with atoms with An+ style of valence more places for size …
(edit) @762   13 years toby update py files to use native line ends, add update from svn to help …
(edit) @760   13 years toby try to deal with unrecognized space group symbols
(edit) @643   13 years toby allow multiple selection from zip on data input, read structure CIFs …
(add) @614   13 years toby import GSAS powder data tested; import routines moved to imports
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