Commit Graph

1066 Commits

Author SHA1 Message Date
Martin Diehl ff1778d149 Merge branch 'development' into new-ASCII 2019-12-03 15:56:49 +01:00
Martin Diehl 62ca2952fc polishing 2019-12-03 11:27:14 +01:00
Martin Diehl e2b13a5ca3 using de-facto standard naming 2019-11-29 19:32:18 +01:00
Martin Diehl 9b4252da68 smart handling of leading zeros 2019-11-29 16:58:11 +01:00
Martin Diehl 3e65d44e07 centralized facilities for differential operations
note the need to reverse the grid shape in data from the ASCII table. If x is fastest,
z is slowest we require x to be the rightmost index
2019-11-28 15:46:22 +01:00
Martin Diehl 4c4ccfe72e not needed 2019-11-28 06:27:19 +01:00
Martin Diehl a8016d64bb simplified 2019-11-27 12:31:32 +01:00
Martin Diehl cee095b58e better use centralized code 2019-11-27 12:22:28 +01:00
Martin Diehl 7d4b982c73 make information on modifications mandatory 2019-11-27 12:08:23 +01:00
Martin Diehl 9ad74745c1 missing import detected by prospector 2019-11-27 08:48:41 +01:00
Martin Diehl ab83dc2ebc use central facilities 2019-11-27 08:45:01 +01:00
Martin Diehl eb033e11b2 polishing 2019-11-27 08:44:38 +01:00
Martin Diehl 31d3958ca6 using fast new Table class
more a proof-of-concept since shell scripts are deprecated. The detailed
error handling of the former scripts is not implemented, i.e. the user
need to ensure that the files exist and the data has the correct shape
2019-11-26 22:59:42 +01:00
Martin Diehl 2d96136a0d more general constructor for Table
reading from file is just one case (now handled by static method).
General constructor needs data and header information as dictionary.
Works only with python 3.7 where dict keeps the insertion order. Earlier
python versions/other implementations might fail.
2019-11-26 22:53:46 +01:00
Martin Diehl 845cfc34ec similar logic as in geom class
- filename is not part of the object
- transparent handling of files, strings, and path-like objects for file
IO
2019-11-26 14:26:25 +01:00
Martin Diehl 81abc43920 Merge branch 'development' into new-ASCII 2019-11-26 10:29:05 +01:00
Martin Diehl 406ca39b2c ASCII table unable to handle inhomogeneous situations 2019-11-24 21:23:43 +01:00
Martin Diehl c9b1944493 handling of derived datatypes/structs
currently required for orientation
2019-11-24 08:50:27 +01:00
Martin Diehl fb286af354 [skip sc] first draft 2019-10-31 10:47:40 +01:00
Martin Diehl da79949c2a old python2 script, not needed for DADF5 2019-10-19 23:14:17 +02:00
Martin Diehl f4a0a5cfe5 substitute error introduced when enabling MSC.Marc 2019-10-18 22:03:31 +02:00
Martin Diehl b70ad9ff54 Merge branch 'development' into DADF5-improvements 2019-10-18 20:54:54 +02:00
Philip Eisenlohr f8ffd7e39c added specifics to resulting column label (sum or prod) 2019-10-18 09:30:43 -04:00
Martin Diehl edcb8f9c4d name change in development 2019-10-18 12:55:15 +02:00
Martin Diehl de912c22b4 Merge branch 'development' into HDF5-spectral-displacements 2019-10-18 12:54:12 +02:00
Martin Diehl 76236a4a0c direct initialization (float64 is anyway standard) 2019-10-17 22:41:18 +02:00
Philip Eisenlohr 03a3edc128 added option to multiply values instead of summing them 2019-10-17 13:23:14 -04:00
Franz Roters 91691744c6 Merge branch 'Marc-No-nonlocal' into 'development'
Marc no nonlocal

See merge request damask/DAMASK!98
2019-10-15 10:35:37 +02:00
Martin Diehl d73e653f50 support for unstructured grid (FEM) 2019-10-14 14:13:03 +02:00
Martin Diehl 708bbd3cb9 mesh/grid type transparent handling of coordinates 2019-10-12 16:15:04 +02:00
Martin Diehl 513f1c6726 write out point data
might be possible to use a rectilinear grid for this also in the case of
grid solvers
2019-10-12 12:34:37 +02:00
Martin Diehl b208fa6565 takeover from Vitesh's work with small adoptions to current DADF5 2019-10-12 08:02:57 +02:00
Martin Diehl 3206ee04bc nodal displacements for grid solver
currently for non-MPI only
2019-09-27 20:38:02 -07:00
Martin Diehl 8793050329 fixed handling of subfolders
now inline with post results.
Still a little bit unclear what happens if an absolute directory is
given. Probably best to either specify absolute or relative with respect
to working directory
2019-09-19 16:10:07 -07:00
Martin Diehl 4cedcee0b4 handling of increments follows handling of other 'visible'-items 2019-09-15 17:08:03 -07:00
Martin Diehl f6ac8c995f simplified and selected better names 2019-09-15 16:00:19 -07:00
Martin Diehl 04aefa84bc more appropriate names 2019-09-15 15:02:16 -07:00
Martin Diehl de316f1afe Merge remote-tracking branch 'origin/development' into even-more-HDF5-postprocessing 2019-09-14 12:48:42 -07:00
Martin Diehl b85ac11c49 implemented ideas from discussion with Philip
group matching unified and with wildcard support
time step handling should become more convenient (WIP)
add_norm can not compute abs of scalar, added function for that
general polishing here and there
2019-09-14 09:07:23 -07:00
Martin Diehl c13db4b3ca renaming
on_air/active are not clear. visible seems to be the most appropriate
name
2019-09-13 21:49:22 -07:00
Martin Diehl a6567e0cc6 safer to use functions
don't mess with attributes of the object, they might be renamed
2019-09-13 21:41:35 -07:00
Martin Diehl 002383afc2 solved problem with postprocessing
- to not 'try' with h5py library, it might have another 'try'. Check
explicitly for empty argument

also some polishing
2019-09-13 16:01:30 -07:00
Martin Diehl 52904a81dc taking prospector complaints serious 2019-09-13 06:49:25 -07:00
Martin Diehl a3c6f6682e using eigh should ensure orthogonal eigenvectors 2019-09-13 06:42:01 -07:00
Martin Diehl 890a6cf42f avoid floating point comparison and simply play it safe 2019-09-13 06:40:41 -07:00
Martin Diehl 0497b58629 use existing functionality 2019-09-13 06:38:22 -07:00
Martin Diehl cd6a4d1cfd that's all we need 2019-09-13 06:37:47 -07:00
Martin Diehl 66d8a3e601 stretch is symmetric (play it safe here) 2019-09-13 06:35:48 -07:00
Martin Diehl 79d2432c6c R not needed 2019-09-13 06:33:00 -07:00
Martin Diehl 49b3cd2145 transpose evuivalent for rot but faster 2019-09-13 06:32:05 -07:00
Martin Diehl 462bb07efd Merge branch 'development' into even-more-HDF5-postprocessing 2019-09-11 16:29:44 -07:00
Philip Eisenlohr 926217fcb6 added possibility to reduce rotation to specific fundamental zone, and to output 3-dim Rodrigues vector 2019-09-10 15:09:27 -04:00
Martin Diehl d446248d75 also ouptut materialpoint results if requested 2019-07-15 17:07:04 -07:00
Martin Diehl b6bb8a4650 simple strain calculation for DADF5
further enhancement requires to give optional arguments to
add_genericpontwise
2019-07-06 21:41:29 -07:00
Martin Diehl a8ed982706 [skip ci] better name 2019-06-15 07:31:30 +02:00
Martin Diehl eb8be13203 missing import 2019-06-14 17:27:00 +02:00
Martin Diehl 1cf9c59850 standardizing
import follows PEP style guide, encoding not needed for python3
2019-06-14 13:03:30 +02:00
Martin Diehl 4ff3efb1a5 to 'stack' tables 2019-06-13 23:14:40 +02:00
Martin Diehl bf27505faa Merge branch 'development' into geometry-class 2019-05-31 16:21:50 +02:00
Martin Diehl 5cf63bbbc3 vtk 7 is out for more than 3 years 2019-05-27 08:34:36 +02:00
Martin Diehl af493cf9fd using class
needs more memory, but should be faster and is better readable
2019-05-26 21:32:08 +02:00
Martin Diehl 339b86f784 bugfix + more verbose reporting 2019-05-16 11:44:03 +02:00
Martin Diehl 9f7fa5393a fix for scalar datasets 2019-05-16 09:31:13 +02:00
Martin Diehl 4599d1c34e does not match
node does not make sense, is weirdly numbered
2019-05-16 00:42:22 +02:00
Martin Diehl 3c0c0a2cd1 more flexible in selecting data 2019-05-16 00:27:06 +02:00
Franz Roters 998789528c Merge branch 'HDF5-out-homog-2' into 'development'
Hdf5 out homog 2

See merge request damask/DAMASK!78
2019-05-13 17:34:59 +02:00
Vitesh Shah feb1465803 Better to have actual increment num in output file 2019-05-08 17:31:18 +02:00
Martin Diehl 0cc2b1214d store requested data in ASCII file 2019-05-07 15:18:12 +02:00
Martin Diehl 1eaf67ad82 store results in subdirectory
defaults to postProc
2019-05-07 13:30:05 +02:00
Martin Diehl f65423fe9f rudimentary postResults for HDF5 output
only meant for compatibility during transition
2019-05-05 10:09:23 +02:00
Martin Diehl 8a9baf6d78 preparing output of mech_homog to HDF5 2019-04-30 18:45:38 +02:00
Philip Eisenlohr d74599d39a Merge branch 'HDF5-postprocessing' into 'development'
Hdf5 postprocessing

See merge request damask/DAMASK!72
2019-04-29 23:24:42 +02:00
Martin Diehl 6b7fd6b7ea visualizing data from DADF5: first prototype 2019-04-18 11:58:17 +02:00
Martin Diehl 7177813710 adding data to geometry 2019-04-17 19:57:16 +02:00
Martin Diehl 8eb1a35dfb first version of a library to parse HDF5
- preliminarly called DADF5 (DAMASK HDF5)
- script to write (empty undeformed) geometries is also added
2019-04-13 11:25:53 +02:00
Martin Diehl 0c6fde97f9 wrong positions for point visualization
- now the cell centers are at the centers of the cells for cell
visualization
2019-04-13 00:42:05 +02:00
Martin Diehl 433281f71d following Rowenhorst convention 2019-03-09 19:58:17 +01:00
Martin Diehl 0d08659b2a general cleaning 2019-03-09 11:11:40 +01:00
Martin Diehl 60feb96afd let vtk decide on the file extension 2019-03-09 11:11:40 +01:00
Martin Diehl 5ab8e50d09 consistent with reference paper 2019-03-08 19:07:19 +01:00
Philip Eisenlohr c706ca5ba3 no progress bars in quite mode 2019-02-26 21:22:49 -05:00
Eureka Pai f3d2803443 addMises failed for single run of either --stress or --strain 2019-02-25 19:29:12 -05:00
Eureka Pai 2089726800 corrected output extension of vtk files to reflect binary format 2019-02-25 18:48:40 -05:00
Martin Diehl d3ac3cc0f5 using new Orientation class 2019-02-24 08:34:20 +01:00
Martin Diehl 9fa2553af4 task for DREAM.3D if needed
pointwise takeover should not be a problem anymore as reading in takes
no time (at least in comparison to addGrainID)
2019-02-23 22:14:55 +01:00
Martin Diehl b3455c825e transition to new orientation class
forward-backward conversion quite stable
2019-02-23 21:49:05 +01:00
Martin Diehl 93ae5cbd07 Merge remote-tracking branch 'origin/development' into 10-consistent-orientation-conversions-3 2019-02-22 23:05:36 +01:00
Martin Diehl 43a451b2e1 inplace not useful
use shell script if you want to keep an backup of your old data
2019-02-18 14:36:04 +01:00
Martin Diehl 27ebe1f665 improved documentation 2019-02-17 08:17:40 +01:00
Martin Diehl 5c20609e81 more verbose help, drop support for really old vtk 2019-02-16 22:20:44 +01:00
Martin Diehl 802ef6fe5c more precise help 2019-02-16 18:25:41 +01:00
Martin Diehl c6781e415a using default notation for vector access 2019-02-16 18:23:00 +01:00
Martin Diehl 0b1bfdfd4e was only working with python2 2019-02-16 18:17:05 +01:00
Martin Diehl 29fc53fdcb more specific about invocation 2019-02-16 17:41:56 +01:00
Martin Diehl fa003e8077 small adjustments for autodoc 2019-02-16 15:26:21 +01:00
Martin Diehl 4ce151c967 camel casing (easer for foswiki) 2019-02-15 23:22:51 +01:00
Martin Diehl 0cc4e582e4 Merge branch 'development' into 26_autodoc-2 2019-02-15 20:47:14 +01:00
Martin Diehl 566099ad81 automatic documentation for some post processing scripts 2019-02-15 18:52:47 +01:00
Philip Eisenlohr d58c3008ae fixed too long line in addLinked 2019-02-14 18:31:22 -05:00
Philip Eisenlohr 742d58cfce added ASCIItable tests to CI pipelining 2019-02-14 18:24:09 -05:00
Martin Diehl c4cb35891c all fine with python3 2019-02-14 22:56:39 +01:00
Martin Diehl 889cfc8ba0 vtk script only work with python3 on new testing 2019-02-14 01:39:54 +01:00
Martin Diehl 217024667b forgotten comma 2019-02-12 11:30:43 +01:00
Martin Diehl 608852df83 rotation paper has angle as last component 2019-02-12 10:58:38 +01:00
Martin Diehl 7da8980cc0 bugfixes: wrong shape, wrong conversion 2019-02-12 09:04:35 +01:00
Martin Diehl 336a80091f rodrigues is 4-vector with rotation being the last component
established a single source of truth for length
2019-02-12 08:59:26 +01:00
Martin Diehl 97ac437686 more user friendly constructors 2019-02-12 08:14:27 +01:00
Martin Diehl ef3fc0b58a bugfix: wrong array indexing
rotation of meshgrid tuple implemented
2019-02-12 07:42:46 +01:00
Martin Diehl 48b0307fab using new rotation class
cannot rotate matrices (3,3) and (3,3,3,3) at the moment
2019-02-12 00:27:13 +01:00
Philip Eisenlohr 74956c0290 avoid error for empty "name" 2019-01-23 20:59:07 -05:00
Martin Diehl 1192f16582 Merge remote-tracking branch 'origin/development' into 56-parallel-hdf5 2019-01-06 20:56:36 +01:00
Martin Diehl 7768c5874b simpler interface for progress bar 2019-01-05 10:41:49 +01:00
Martin Diehl c00d00c219 Merge remote-tracking branch 'origin/development' into misc-improvements 2019-01-05 09:22:41 +01:00
Philip Eisenlohr 3c5df0a4a4 [skip ci] viewTable acknowledges requested output type(s) 2019-01-04 16:34:21 -05:00
Philip Eisenlohr bcd4288f1e [skip ci] groupTable according to unique values in more than one column 2019-01-03 18:25:28 -05:00
Philip Eisenlohr b5d62c8e29 [skip ci] print estimated remaining processing time for postResults 2019-01-03 11:31:04 -05:00
Martin Diehl 835e3f95a5 [skip ci] was not used 2018-12-31 08:05:56 +01:00
Martin Diehl 6f40989465 order was randomized when creating dict 2018-12-31 07:18:45 +01:00
Martin Diehl a992b8b1f5 random order caused test to fail
rather a workaround, but since HDF5 is coming...
2018-12-30 11:41:22 +01:00
Philip Eisenlohr 25a80723c0 numpy interface changed to be strict about 2D array shape in histogram 2018-12-20 17:14:55 -05:00
Martin Diehl 1ef82e351b Merge branch 'orientationClass_with_negative_P' into development 2018-12-20 20:43:00 +01:00
Philip Eisenlohr 7df6dfbf3f renamed "showTable" to "viewTable" to avoid clashing with astropy.table module 2018-12-18 15:10:26 -05:00
Martin Diehl 3bab08fdeb Merge branch 'development' into 56-parallel-hdf5 2018-12-12 07:46:02 +01:00
Martin Diehl 1f2fbbee21 consistent name 2018-12-10 09:38:57 +01:00
Martin Diehl 767650e002 more general option + improved descriptions
hopefully more user friendly
2018-12-10 09:27:39 +01:00
Martin Diehl d219842ad8 [skip ci] consistent tolerances 2018-12-09 20:19:33 +01:00
Martin Diehl 60686fb72c [skip ci] improved reporting 2018-12-09 18:05:37 +01:00
Martin Diehl bc04b83d8a no reason for using python2.7 2018-12-09 14:09:26 +01:00
Martin Diehl 08ac49fac0 line too long 2018-12-09 13:21:56 +01:00
Martin Diehl 130fac21c6 cleaning 2018-12-09 13:15:59 +01:00
Martin Diehl d43dfa569b lines too long 2018-12-09 12:37:27 +01:00
Martin Diehl 65165ffc5e assumed wrong type
quaternion should have lenght one
2018-12-09 12:35:32 +01:00
Martin Diehl 697d97cd38 cleaned
legacy format was for pre-MPI output where the extra bytes at start and
end of a chunk (Fortran out) had to be handled manually
2018-12-09 12:30:07 +01:00
Martin Diehl 5054291557 python3 compatible status message 2018-12-09 12:25:31 +01:00
Martin Diehl 741032339e time/math/datatype are not used/defined any more 2018-12-09 11:05:35 +01:00
Martin Diehl aefa006d09 simplified
assume quaternions as input
2018-12-09 10:53:53 +01:00
Martin Diehl 213e31ff87 string was split into letters 2018-12-09 10:53:25 +01:00
Martin Diehl d9b47f09bc modernized
split arguments logically, assume 3-vector for coordinates
2018-12-09 10:52:37 +01:00
Martin Diehl 7eaea64d09 python3 compatible
hope that the new bar causes less trouble than the background message
2018-12-09 09:08:33 +01:00
Martin Diehl 6b73840853 works with python3 2018-12-09 08:07:40 +01:00
Martin Diehl 83a3628765 bug fixes 2018-12-09 07:58:42 +01:00
Martin Diehl d145b257aa new version of numpy complain about overlong range argument 2018-12-09 07:57:05 +01:00
Martin Diehl 4130cbcffa simplified
- always use quaternion as input for orientation
- addAPS34IDEstrainCoords uses table functionality
- rotateData can figure out whether input is vector or tensor
2018-12-09 07:10:31 +01:00
Philip Eisenlohr 3f8726464d addOrientations now checks its input for convention conformity 2018-12-08 13:22:22 -05:00
Philip Eisenlohr ac45a9e2d3 more output options, frame input changed to "lab expressed in crystal" 2018-12-07 22:03:14 -05:00
Philip Eisenlohr c0f7ae2798 updated scripts that still used formerly valid object properties of quaternions 2018-12-05 09:07:29 -05:00
Martin Diehl 8f26fc9358 Merge remote-tracking branch 'origin/development' into 56-parallel-hdf5 2018-12-04 22:34:29 +01:00
Martin Diehl c0ad496764 eigenvalue solver seems to depent on python version 2018-11-22 23:13:49 +01:00
Martin Diehl 76accdeaf2 all orientations are passive now
.conjugated() not needed anymore.
Rest is polishing
2018-11-22 18:45:01 +01:00
Philip Eisenlohr 9b82b7fadd removed obsolete keyword "Bunge" from asEulers() method 2018-11-22 11:51:53 -05:00