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DAMASK_EICMD
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4185 Commits

Author SHA1 Message Date
Martin Diehl f1051ec28f polishing 2022-01-21 23:34:42 +00:00
Sharan Roongta c2a822d8fd keys() function for dictionary as in Python. 
Does not work for gfortran which fails with an ICE.
 2022-01-20 23:45:47 +00:00
Martin Diehl 869fdc847a Merge branch 'development' into misc-improvements 2022-01-18 11:02:18 +01:00
Martin Diehl c5fd6a3677 random seed should contain some entropy 
setting all elements to the same value does not make sense. Moreover,
negative values are allowed
 2022-01-18 10:47:26 +01:00
Philip Eisenlohr 8b5122f52a Merge branch 'physics-based-hex-interactions' into 'development' 
Physics based hex interactions

See merge request damask/DAMASK!495
 2022-01-17 15:24:05 +00:00
Sharan Roongta 40ee4d3dd1 Merge branch 'petsc-64bit-integer' into 'development' 
support for PETSc with 64bit integers

See merge request damask/DAMASK!496
 2022-01-17 09:16:39 +00:00
Franz Roters 1d2bbc8cd9 Merge branch 'dislotwin-fix-tangent' into 'development' 
corrected tangent calculation for twinning and transformation

See merge request damask/DAMASK!492
 2022-01-17 07:57:51 +00:00
Martin Diehl a37178ddee handle case of -0.0 
-0.0 < 0.0 ! false
so need sign to change direction for also for the corner case of -0.0
 2022-01-15 12:28:39 +01:00
Martin Diehl d1cd125a5b direct array reversal, don't duplicate FFTW manual 2022-01-15 12:27:07 +01:00
Philip Eisenlohr 2c054f2b38 use same hex-hex interaction documentation as webpage 2022-01-13 11:23:09 -05:00
Philip Eisenlohr 45e33782e4 documentating more hex interactions 2022-01-13 10:42:05 -05:00
Martin Diehl 82dabe29c1 mesh: separate kind for DAMASK and PETSc integers 2022-01-13 16:30:42 +01:00
Philip Eisenlohr 4562f4262c add documentation to source code 2022-01-13 10:14:36 -05:00
Martin Diehl 29530da579 use correct kind of constants for calls to MPI/PETSc 2022-01-13 13:50:30 +01:00
Martin Diehl 91a3ea96ec final MPI-DAMASK integer kind decoupling 
bugfix: set error for openMP-calucations
 2022-01-13 13:21:44 +01:00
Martin Diehl d7dbb6ffc2 needs to be public for Marc 2022-01-13 12:03:22 +01:00
Martin Diehl a7417a7ad7 default integer, PETSc integer, and MPI integer might be different 2022-01-13 12:02:33 +01:00
Martin Diehl a3a3388855 decouple DAMASK default integer from MPI default integer 2022-01-13 10:25:45 +01:00
Martin Diehl 1c46e7ea1a not needed 2022-01-13 08:30:46 +01:00
Martin Diehl 8223dc7fa7 polishing 
MPI, HDF5, PETSc, and DAMASK might have different integer kinds ..
 2022-01-13 08:17:31 +01:00
Martin Diehl 3fb5bd459c pInt leftovers 2022-01-13 07:44:15 +01:00
Martin Diehl 4727652856 default integer is set via a compiler flag 2022-01-13 07:37:38 +01:00
Martin Diehl fd3c18ea4d calculate global entry in 64 bit 2022-01-12 17:58:44 +01:00
Martin Diehl ae0eead748 write out mapping as 64 bit integer 2022-01-12 17:44:07 +01:00
Martin Diehl 18913bb94e autodetect datatype 2022-01-12 17:33:14 +01:00
Martin Diehl a87db2ba0b test for long long integer 2022-01-12 16:56:24 +01:00
Martin Diehl 4bfc814a53 Merge remote-tracking branch 'origin/development' into petsc-64bit-integer 2022-01-12 16:37:22 +01:00
Franz Roters 76fe2d2b36 Merge branch 'misc-improvements' into 'development' 
polishing

See merge request damask/DAMASK!497
 2022-01-11 15:45:09 +00:00
Martin Diehl 16fbd1757c integer exponents are potentially faster 2022-01-10 20:50:46 +01:00
Martin Diehl eea8aa94af not used 2022-01-10 18:50:28 +01:00
Martin Diehl 1026d56842 credit where credit is due 
referencing DOI gives faster access to actual data
 2022-01-09 08:05:42 +01:00
Martin Diehl a884b99aa9 Merge remote-tracking branch 'origin/development' into physics-based-hex-interactions 2022-01-08 20:45:46 +01:00
Martin Diehl dd6e9a016e just off by 46 orders of magnitude ;) 2022-01-08 12:07:29 +00:00
Philip Eisenlohr b12a180974 added literature reference for constitutive law 2022-01-06 09:54:33 -05:00
Martin Diehl 1140625b12 copy and paste error 2022-01-04 17:29:45 +01:00
Martin Diehl 03e3fbd98f compute only when needed 2022-01-04 07:44:14 +01:00
Martin Diehl 4a7f23069c avoid misleading variable name 2022-01-04 07:32:56 +01:00
Martin Diehl 79fa888c99 Merge remote-tracking branch 'origin/development' into dislotwin-fix-tangent 2022-01-04 07:05:40 +01:00
Sharan Roongta b8203e94d8 Merge branch 'pure-LAPACK' into 'development' 
improved function attributes

See merge request damask/DAMASK!491
 2022-01-03 14:07:54 +00:00
Martin Diehl 510a26ded9 is used in dislotwin according to original paper 2022-01-03 10:36:23 +01:00
Martin Diehl 03c6708629 polishing 2022-01-01 19:52:32 +01:00
Martin Diehl d181b988c1 using vector access 2022-01-01 19:52:20 +01:00
Martin Diehl 770cf33667 correct calculation of tangent. 
thanks to Seyedamirhossein Motaman (RWTH Aachen) for reporting
 2022-01-01 19:51:31 +01:00
Martin Diehl b34655b7fc functions without side-effects are 'pure' 
basically all 'getter' functions should be pure
 2022-01-01 11:39:14 +01:00
Martin Diehl 2f74e0d070 avoid failing self test 
increase number of samples to have less corner cases.
Needs to be allocatable to avoid stack/heap issue on ifort
 2022-01-01 11:39:02 +01:00
Martin Diehl e678b231d9 following naming convention 2021-12-31 13:32:18 +01:00
Martin Diehl 017c182640 branch only once 2021-12-31 13:30:53 +01:00
Martin Diehl 0116e2dae6 bugfix: write only to active twin/trans system 2021-12-31 10:44:12 +01:00
Martin Diehl f2b6ddece1 reduce memory footprint 2021-12-31 08:12:30 +01:00
Martin Diehl d130225c9f polishing 2021-12-31 08:12:17 +01:00