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14552 Commits

Author SHA1 Message Date
Martin Diehl 1661b815b2 correct calculation of temperature dependent stacking fault energy 2021-12-31 08:11:01 +01:00
Martin Diehl de9183af4e functions without side-effects are 'pure' 
basically all 'getter' functions should be pure
 2021-12-31 08:10:49 +01:00
Martin Diehl 95c64f7a0a avoid failing self test 
increase number of samples to have less corner cases.
Needs to be allocatable to avoid stack/heap issue on ifort
 2021-12-31 08:10:09 +01:00
Martin Diehl fb51e3c4cd functions have no side-effects, hence 'pure' 2021-12-29 07:19:26 +01:00
Martin Diehl 59bb264b5f LAPACK routines can be considered pure 
all arguments have 'intent' specification and don't access any global
variables.
output to screen only occurs in the case that someting goes wrong
 2021-12-29 07:09:52 +01:00
Martin Diehl 4583c17080 corrent 'intent' specification 
- http://www.netlib.org/lapack/explore-html/d7/d3b/group__double_g_esolve_ga5ee879032a8365897c3ba91e3dc8d512.html
- http://www.netlib.org/lapack/explore-html/dd/d9a/group__double_g_ecomputational_ga56d9c860ce4ce42ded7f914fdb0683ff.html
 2021-12-29 07:00:28 +01:00
Test User e19c17c2bc [skip ci] updated version information after successful test of v3.0.0-alpha5-336-g6871eb302 2021-12-28 14:19:37 +01:00
Franz Roters 6871eb3026 Merge branch 'util-project_homochoric' into 'development' 
Lambert azimuthal equal-area (laea) projection

See merge request damask/DAMASK!476
 2021-12-28 10:19:18 +00:00
Philip Eisenlohr b2d0fd8ff5 Lambert azimuthal equal-area (laea) projection 2021-12-28 10:19:17 +00:00
Test User 2d347e1be1 [skip ci] updated version information after successful test of v3.0.0-alpha5-333-g01cd92755 2021-12-26 21:05:58 +01:00
Martin Diehl 01cd92755d Merge branch 'new-intel' into 'development' 
support for LLVM-based Intel compilers

See merge request damask/DAMASK!489
 2021-12-26 16:56:24 +00:00
Martin Diehl 4168b101f4 testing LLVM-based compilers 
does not work for grid due to missing ML
 2021-12-26 13:07:58 +01:00
Martin Diehl a7440da26a options not supported by LLVM-based Intel compilers 2021-12-26 13:06:41 +01:00
Martin Diehl a9293db171 new LLVM-based Intel compilers work 
quick test shows significant performance improvement
 2021-12-25 18:36:35 +01:00
Martin Diehl e34b8a632c new Intel compilers are available 2021-12-25 16:19:48 +01:00
Test User c080c2d2fd [skip ci] Merge branch 'master' into development 2021-12-25 08:39:19 +01:00
Test User 7acf3d8a02 Merge commit 'v3.0.0-alpha5-324-gac7caa0a6' 2021-12-25 08:39:14 +01:00
Test User ac7caa0a64 [skip ci] updated version information after successful test of v3.0.0-alpha5-323-g2ea293063 2021-12-25 08:39:13 +01:00
Test User 53c81e4af1 [skip ci] Merge branch 'master' into development 2021-12-25 07:15:46 +01:00
Test User 68b34f6022 [skip ci] updated version information after successful test of v3.0.0-alpha5-316-gd8ef23fc9 2021-12-25 07:15:40 +01:00
Philip Eisenlohr 2ea2930638 Merge branch 'keyword-view' into 'development' 
using keywords instead of strings to control view

Closes #133

See merge request damask/DAMASK!484
 2021-12-24 23:07:10 +00:00
Philip Eisenlohr d8ef23fc91 Merge branch 'vtr-to-vti' into 'development' 
don't use deprecated functions

See merge request damask/DAMASK!488
 2021-12-24 23:06:04 +00:00
Test User 368f4ac985 [skip ci] updated version information after successful test of v3.0.0-alpha5-313-g8c2266bc5 2021-12-23 22:35:44 +01:00
Martin Diehl 8c2266bc50 bugfix/workaround for failing pipelines on GitHub 
credits to @miketimofeev and @mikhailkoliada for the fix
 2021-12-23 19:23:02 +01:00
Test User 6e833d2327 [skip ci] updated version information after successful test of v3.0.0-alpha5-311-g38d497819 2021-12-22 12:56:07 +01:00
Martin Diehl dc5172ce63 don't use deprecated functions 2021-12-22 12:41:16 +01:00
Nikhil Prabhu 38d4978191 Merge branch 'Temp-Dependent-BccIron-C' into 'development' 
elastic constants for bcc iron

See merge request damask/DAMASK!486
 2021-12-22 08:25:53 +00:00
Test User 3e01f72daa [skip ci] updated version information after successful test of v3.0.0-alpha5-308-gb4f3ac457 2021-12-21 22:19:29 +01:00
Sharan Roongta 32e741ae2c elastic constants for bcc iron 2021-12-21 15:54:46 +01:00
Sharan Roongta b4f3ac4577 Merge branch 'temperature-direct' into 'development' 
use data from other physics directly

See merge request damask/DAMASK!485
 2021-12-21 12:09:51 +00:00
Martin Diehl 25ab62402a Merge remote-tracking branch 'origin/development' into keyword-view 2021-12-19 22:58:38 +01:00
Martin Diehl e10dea5b6c easier to understand 2021-12-19 22:53:48 +01:00
Martin Diehl 00230d482f use data from other physics directly 
more clear code, simplified interfaces
 2021-12-19 22:07:23 +01:00
Martin Diehl 5af6cc288b whitespace adjustments 2021-12-19 21:46:10 +01:00
Test User eecfed7cda [skip ci] Merge branch 'master' into development 2021-12-19 00:24:18 +01:00
Test User 643e8d1d94 Merge commit 'v3.0.0-alpha5-300-gd060eabb4' 2021-12-19 00:24:13 +01:00
Test User d060eabb45 [skip ci] updated version information after successful test of v3.0.0-alpha5-299-g29122ef41 2021-12-19 00:24:12 +01:00
Test User f106e1bcb1 [skip ci] Merge branch 'master' into development 2021-12-18 22:45:01 +01:00
Test User 28449393bf [skip ci] updated version information after successful test of v3.0.0-alpha5-297-g5ecfba1e5 2021-12-18 22:44:25 +01:00
Philip Eisenlohr 29122ef41f Merge branch 'typehints-adjustments-colormap' into 'development' 
Use ArrayLike for numpy >= 1.20

See merge request damask/DAMASK!482
 2021-12-18 17:21:46 +00:00
Martin Diehl 0468bfd3e1 Use ArrayLike for numpy >= 1.20 2021-12-18 17:21:46 +00:00
Philip Eisenlohr 5ecfba1e5f Merge branch 'better-Gauss' into 'development' 
improved sampling from normal distribution

See merge request damask/DAMASK!483
 2021-12-18 17:15:55 +00:00
Martin Diehl 2fc25c6fa9 correct reporting 2021-12-17 14:31:51 +01:00
Martin Diehl a1e42af860 easier to understand 2021-12-17 10:44:41 +01:00
Martin Diehl c1eabc3384 simplified interface 2021-12-17 10:31:41 +01:00
Martin Diehl 0b6af19e54 use of keywords is more intuitive 
code needs cleaning after revoming of 'what' and 'datasets'. For the
moment, keep the old style for compatibility with existing evaluation
scripts
 2021-12-17 09:48:33 +01:00
Martin Diehl 501465dfd1 more alpha releases than expected 
hopefully, all DAMASK 2 users have been migrated once 3.0 is released
 2021-12-17 09:42:10 +01:00
Martin Diehl f833d348e0 testing random sampling 2021-12-17 08:01:15 +01:00
Martin Diehl f40d731fe1 use the Box-Muller transform instead of random sampling 
still needs testing.
 2021-12-16 21:22:44 +01:00
Test User 430b947c7e [skip ci] Merge branch 'master' into development 2021-12-15 14:21:42 +01:00