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DAMASK_EICMD
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3282 Commits

Author SHA1 Message Date
Martin Diehl 2dd520b4a2 P_aim should be independent from P_av 
P_av is not defined after restart or cutback. Restart with change of
load case is probably still an issue
 2020-12-15 08:06:50 +01:00
Martin Diehl a881e6e57a Merge remote-tracking branch 'origin/development' into misc-improvements 2020-12-10 23:41:59 +01:00
Martin Diehl 3ad741dbeb only used in one function 2020-12-10 00:31:58 +01:00
Martin Diehl 97ee7e6ee5 not needed anymore 2020-12-07 17:26:50 +01:00
Martin Diehl 429b84004d more filters 
- shuffle: significanlty better compression
- Fletcher32: checksum to detect errors

computational overhead is very small
 2020-12-06 19:57:00 +01:00
Martin Diehl bc4361c2ae use variable string length 
for array, padding is needed to get same length
 2020-12-06 13:32:20 +01:00
Martin Diehl 52e3fb50bc compress. 
Datasets are chunked along first timension. Chunk size (1MB for real) is
probably not optimal
 2020-12-06 11:44:52 +01:00
Martin Diehl 000de75617 write orientation as plain array, not derived type 2020-12-06 08:36:16 +01:00
Martin Diehl 78a246b44a avoid constant reallocation, it is slow for large vtr files 2020-12-05 12:46:48 +01:00
Martin Diehl 42eb802126 not needed anymore 2020-12-05 11:29:23 +01:00
Martin Diehl ac0a20696c rename: grid -> cells 2020-12-03 22:16:34 +01:00
Martin Diehl 85d161f039 missing rename: bcc -> cI 
also, no CamelCase in disloTungsten + a few renames of variable names
for more consistency
 2020-11-29 12:57:51 +01:00
Martin Diehl c712332e87 using consistent names for Bravais lattice in Fortran and Python 2020-11-28 22:38:12 +01:00
Martin Diehl b7ae2c72f5 allow to parse extra options to PETSc in case of debugging 2020-11-28 11:47:20 +01:00
Martin Diehl 80c8c9e51e fixing use for new Intel Fortran 
visibility of use associated entities can now be limited
 2020-11-28 07:23:55 +01:00
Martin Diehl 5bed0787ed replace log scaling with geometric regression scaling 
more flexibility in time discretization via parameter 'r'.
Also, changed variable names to reflect names in loadcase.yaml
 2020-11-25 18:56:03 +01:00
Martin Diehl 4bf802a28e fixed documentation 2020-11-18 21:51:37 +01:00
Martin Diehl 870c0f7aca removed aliases 
required bump of DADF5 version
 2020-11-18 14:53:11 +01:00
Sharan Roongta 2157bf50cd mech --> mechanics 2020-11-17 22:21:35 +01:00
Franz Roters 523a0979eb Merge branch 'mpi-single-process-read' into 'development' 
MPI single process read of grid

See merge request damask/DAMASK!277
 2020-11-17 17:00:09 +01:00
Sharan Roongta c16ad845bc Merge branch 'modernize-testing' into 'development' 
Modernize testing

See merge request damask/DAMASK!280
 2020-11-16 20:10:38 +01:00
Sharan Roongta c430b571fc Merge branch 'safe-mpi-nonblocking' into 'development' 
check all errors, avoid intermediate wait

See merge request damask/DAMASK!282
 2020-11-16 18:50:05 +01:00
Martin Diehl cf3a28952a fixed tests 2020-11-16 16:38:17 +01:00
Martin Diehl 0bd8a410ad check all errors, avoid intermediate wait 2020-11-16 09:22:55 +01:00
Martin Diehl b3955573f6 using new tests 2020-11-15 22:39:47 +01:00
Martin Diehl c9356fd447 error checking, making readable with damask.Result 2020-11-15 15:39:54 +01:00
Martin Diehl 5a28a5b4db correct handling of C strings 
cleaning and improving the C code for system routines and the interface
to Fortran
Reporting PETSc version
 2020-11-14 14:36:10 +01:00
Martin Diehl e419eea507 read vtr file only by process 1 2020-11-12 14:40:25 +01:00
Martin Diehl bb471cb923 it's a process, not a thread 2020-11-12 07:51:07 +01:00
Martin Diehl 9c75674b20 unused 2020-11-12 07:50:56 +01:00
Martin Diehl ff2eec133f underflow/denormal might appear for gfortran 2020-11-11 21:30:11 +01:00
Martin Diehl 3d7aceb99b avoid underflow/division by zero 2020-11-11 20:57:17 +01:00
Martin Diehl cd7ada0da9 use Fortran internals for error handling 2020-11-11 20:09:14 +01:00
Martin Diehl 3dd5eaf1c1 clean exit with stack trace 2020-11-11 14:06:21 +01:00
Martin Diehl 8e89452791 not needed 2020-11-11 13:59:37 +01:00
Martin Diehl 5531f892c3 z = 0 for invalid number of processes 
e.g. using 24 processes for a 128x128x128 grid would need 21 processes
with z=6 and 1 process with z=2
 2020-11-11 12:47:13 +01:00
Martin Diehl 429c226008 IO is not inherited when using ifort 19 
this is intented, public modules should only bring their own functions
and variables into global scope
 2020-11-11 12:19:39 +01:00
Martin Diehl b46a25a7d2 C capitalization 2020-11-11 11:47:23 +01:00
Martin Diehl 53110ccf35 use (also) PETSc error trapping 2020-11-11 11:46:12 +01:00
Martin Diehl 9c87142e6d Merge branch 'development' into hdf5-error-stop 2020-11-11 11:17:37 +01:00
Martin Diehl 018709bfcf error stop better suited for internal errors 
error stop gives full stack trace, which is very helpful for debugging.
 2020-11-11 10:19:47 +01:00
Martin Diehl 2923f639da not needed 
inverse mapping is computed in python
 2020-11-11 10:16:38 +01:00
Martin Diehl 8429a9d695 Merge remote-tracking branch 'origin/development' into modularize-mech 2020-11-11 07:04:23 +01:00
Martin Diehl 5926f84851 WIP: refactoring Orientation=Symmetry+Rotation, Lattice=subclass of Sym, and Crystal=Lattice+Rotation 2020-11-09 21:20:56 +01:00
Sharan Roongta 8007c47b48 Merge branch 'development' into modularize-mech 2020-11-08 15:43:30 +01:00
Martin Diehl 03a68248b5 polishing 2020-11-06 13:25:00 +01:00
Martin Diehl bbaeeb02da Merge remote-tracking branch 'origin/misc-improvements' into h5py3 2020-11-06 13:19:47 +01:00
Martin Diehl 10b8a04d89 no need for fixed-length string 2020-11-06 00:59:12 +01:00
Martin Diehl 9cd2c19a20 no need for fixed length 2020-11-06 00:50:27 +01:00
Martin Diehl e649fb195f update to use variable-length strings 2020-11-05 22:34:41 +01:00