Commit Graph

14736 Commits

Author SHA1 Message Date
Martin Diehl 6ba2a08e5a easier to read 2021-12-11 11:50:40 +01:00
Martin Diehl d6ba73d9e2 consistent names 2021-12-11 09:54:46 +01:00
Martin Diehl f51633d43a forall is deprecated
do concurrent is the successor but ifort had problems and generated
faulty code
2021-12-11 09:01:42 +01:00
Martin Diehl 7d7d0c2659 only local variable are good variables 2021-12-11 08:49:30 +01:00
Eureka Pai 2b6283bbe3 flexibility to return with alpha channel and/or as string 2021-12-10 12:53:01 -05:00
Franz Roters 7bb6707b0e [skip ci] Web page was moved 2021-12-10 18:07:04 +01:00
Eureka Pai 947bf946e1 added Colormap.at(fraction) to interpolate 2021-12-10 11:31:26 -05:00
Test User 63c76abed8 [skip ci] updated version information after successful test of v3.0.0-alpha5-263-gfbbe5ec00 2021-12-09 00:09:39 +01:00
Philip Eisenlohr fbbe5ec006 fixed typo 2021-12-08 21:04:22 +00:00
Martin Diehl a23a714bd0 polishing 2021-12-07 19:10:24 +01:00
Test User 811879788a [skip ci] updated version information after successful test of v3.0.0-alpha5-261-g722c9828a 2021-12-07 11:37:02 +01:00
Martin Diehl 722c9828a0 trying to fix errors like
cannot lock ref 'refs/heads/master': is at 2d39da4d8d
but expected 596a8ecd11
2021-12-07 09:27:24 +01:00
Test User 188c199863 [skip ci] Merge branch 'master' into development 2021-12-07 08:49:26 +01:00
Test User 2d39da4d8d Merge commit 'v3.0.0-alpha5-254-gc56642f64' 2021-12-07 08:48:58 +01:00
Test User c56642f64a [skip ci] updated version information after successful test of v3.0.0-alpha5-253-ga4cd663fc 2021-12-07 08:48:55 +01:00
Martin Diehl cf9f770866 Merge branch 'typehints_crystal' into 'development'
Typehints for crystal

See merge request damask/DAMASK!464
2021-12-06 23:49:13 +00:00
Daniel Otto de Mentock be95f9a98a Typehints for crystal 2021-12-06 23:49:12 +00:00
Test User 992f848296 [skip ci] Merge branch 'master' into development 2021-12-06 18:34:35 +01:00
Test User 596a8ecd11 [skip ci] updated version information after successful test of v3.0.0-alpha5-251-g65c4417a2 2021-12-06 18:34:14 +01:00
Sheng Zhang ea25c8ff40 updated tests to have new # of interactions 2021-12-06 16:55:24 +01:00
Sheng Zhang d66b9e1896 subdivision of interaction matrix for hcp 2021-12-06 16:51:18 +01:00
Sheng Zhang a4cd663fc0 Merge branch 'no-2prism-hex' into development 2021-12-06 16:45:01 +01:00
Daniel Otto de Mentock 7c7c3926b7 added array conversion to ambiguous types in grid_filters.coordinates0_point function 2021-12-06 15:48:57 +01:00
Daniel Otto de Mentock 1de12bb402 removed direct attribute assignments for size and origin 2021-12-06 15:48:19 +01:00
Daniel Otto de Mentock 5558c301fa added fist typehints for _grid module 2021-12-06 14:22:52 +01:00
Daniel Otto de Mentock 65c4417a20 Merge branch 'polishing' into 'development'
Polishing

See merge request damask/DAMASK!473
2021-12-06 12:57:17 +00:00
Martin Diehl fe2123bae4 2. order prismatic systems are not needed
not clear for which material they have been introduced, according to
T.R. Bieler and P. Eisenlohr they are typicall not active in any
material of interest
2021-12-06 12:23:24 +01:00
Martin Diehl 8ade749f05 avoid conversions 2021-12-06 08:55:00 +01:00
Martin Diehl 2fb368cf8c consistent space (as in 'end module' etc) 2021-12-06 07:59:40 +01:00
Martin Diehl 08a709c6d9 capitalize HDF5 prefix 2021-12-06 07:55:22 +01:00
Martin Diehl 2f067b544e use variables, not descriptors 2021-12-06 07:55:13 +01:00
Martin Diehl 7b187eb370 new convention 2021-12-06 07:55:05 +01:00
Test User cef8b06dc0 [skip ci] updated version information after successful test of v3.0.0-alpha5-244-gb57351045 2021-12-04 05:43:51 +01:00
Philip Eisenlohr b57351045b follow new convention for "shape" and "len" in docstrings 2021-12-04 03:39:33 +01:00
Martin Diehl 2a6b37a0e5 eq. according to mypy recommendation
note that raising 'NotImplemented' means that __eq__ of the 'other' is
evaluated
https://stackoverflow.com/questions/54801832
https://newbedev.com/why-does-defining-the-argument-types-for-eq-throw-a-mypy-type-error
2021-12-03 12:35:25 +01:00
Martin Diehl 99166a7ce2 Merge remote-tracking branch 'origin/colormap-docstrings' into development 2021-12-03 12:18:24 +01:00
Test User 389d08bdcc [skip ci] updated version information after successful test of v3.0.0-alpha5-234-g66fddda0b 2021-12-03 10:08:09 +01:00
Vitesh 66fddda0bf Merge branch 'check-HDF5-filters' into 'development'
bugfix for HDF5 without deflate filter

See merge request damask/DAMASK!469
2021-12-03 07:13:03 +00:00
Test User 55b8ea9db9 [skip ci] updated version information after successful test of v3.0.0-alpha5-230-g7a78a25e5 2021-12-03 07:39:56 +01:00
Martin Diehl 7a78a25e5c Merge branch 'config-init-yaml' into 'development'
extend config init to allow YAML string and key=value pairs

See merge request damask/DAMASK!470
2021-12-03 04:37:23 +00:00
Philip Eisenlohr dc3db90ce0 fixed typo: colormodel --> color model 2021-12-02 18:59:31 -05:00
Philip Eisenlohr d5da47bf71 extend config init to allow YAML string and key=value pairs 2021-12-02 18:20:27 -05:00
Martin Diehl c818756f68 wrong check
iand is used for checking, see https://support.hdfgroup.org/HDF5/doc/RM/H5Z/H5Zget_filter_info.htm
2021-12-02 20:51:33 +01:00
Test User 88de2720d2 [skip ci] updated version information after successful test of v3.0.0-alpha5-227-g727dd8936 2021-12-02 16:24:54 +01:00
Martin Diehl 731e20261c bugfix for HDF5 without deflate filter
before inquiring whether a filter supports compression/decompression, we
first need to check whether it is available at all to avoid raising an
error.
Extended the check to the shuffle filter
2021-12-02 13:00:59 +01:00
Franz Roters 727dd8936d use latest Marc version 2021-12-02 08:50:59 +01:00
Martin Diehl e43a121e7d polishing 2021-12-01 16:46:58 +01:00
Franz Roters 809221fb7e adjust access rights of newly created files 2021-12-01 16:01:55 +01:00
Martin Diehl 5abfe3c214 Merge remote-tracking branch 'origin/development' into MSC-Version 2021-12-01 15:35:49 +01:00
Martin Diehl f6d2bd0225 fix
not sure why this does not work
2021-12-01 11:46:48 +01:00