Commit Graph

3751 Commits

Author SHA1 Message Date
Martin Diehl e4fe152810 no public parameters 2020-02-28 21:44:40 +01:00
Martin Diehl 3aec4f91f4 WIP: get rid of global variables from lattice 2020-02-28 19:46:18 +01:00
Martin Diehl 0fbba60c91 do not rely on public variables 2020-02-28 19:35:53 +01:00
Martin Diehl 15712d7ebb last remaining outputID enums removed 2020-02-28 11:06:21 +01:00
Martin Diehl 11d456bcd7 no need for enums
no performance difference measurable but less complicated code without
them
2020-02-28 10:58:11 +01:00
Martin Diehl 991d0fe020 polishing/unifying 2020-02-28 10:40:17 +01:00
Martin Diehl cf0f5f0fee polishing 2020-02-28 10:04:38 +01:00
Martin Diehl 4c17963cd6 cleavage systems should reflect lattice symmetry
also {100} cleavage planes need investigation
2020-02-26 19:11:33 +01:00
Martin Diehl c9b9c9103b 2 space indentation 2020-02-26 18:49:20 +01:00
Martin Diehl 73491f3be9 simplified and unified style 2020-02-26 18:37:17 +01:00
Martin Diehl 7e30c10e82 internal functions need no prefix and are located at the end 2020-02-26 18:02:47 +01:00
Martin Diehl 33dc44e512 2 space indentation 2020-02-26 17:55:19 +01:00
Martin Diehl eacf0cc894 does not makes sense to have cleavage planes for isotropic
behavior can be recovered by using 'real' crystal structures and
suitable parameter (easiest for fcc/bcc)
2020-02-26 17:50:29 +01:00
Martin Diehl 1d77af66c0 preparing removal of initializeStructure 2020-02-26 07:23:29 +01:00
Martin Diehl 839443bc85 better (generic) name where possible 2020-02-26 07:06:25 +01:00
Martin Diehl cbcb7dca5d cleaning 2020-02-26 06:12:45 +01:00
Martin Diehl 82dee9db0e matching names 2020-02-25 17:53:15 +01:00
Martin Diehl 48604292e2 Merge remote-tracking branch 'origin/development' into MiscImprovements 2020-02-25 17:33:39 +01:00
Martin Diehl 4889e75e52 clearer structure 2020-02-25 17:32:49 +01:00
Martin Diehl 2c952c3410 these variables can be at leat write protected 2020-02-25 09:50:21 +01:00
Martin Diehl 7d7eff0d94 crystallite should be responsible of crystallite variables 2020-02-25 09:42:07 +01:00
Sharan Roongta a2e8e5b13b Merge branch 'simple-output-handling' into development 2020-02-23 19:38:13 +01:00
Martin Diehl 49de01787d variables not used 2020-02-23 16:38:57 +01:00
Martin Diehl 605e976915 I don't like loops
use language features and helper functions for shorter code
2020-02-23 09:45:19 +01:00
Martin Diehl 7d6c0dc5f4 is only needed during initialization 2020-02-22 11:42:06 +01:00
Martin Diehl 2cf89b1fdd bugfix: output dataset was too large in case of Ngrains>1
material_phaseAt is defined per constituent/grain/component => no need
to multiply with homogenization_maxNgrains
2020-02-22 11:28:03 +01:00
Martin Diehl bedcd0ad8c sanity check for homogenization
number of (constituent) per microstructure need to match Nconstituents
 in homogenization.
2020-02-22 11:14:11 +01:00
Martin Diehl 62898a70a0 use automated LHS allocation 2020-02-21 23:40:29 +01:00
Martin Diehl f72b856a18 no reason for critical
will always (and only) set to .true.
2020-02-21 23:37:35 +01:00
Martin Diehl 402c282e68 better names
backport form dadf5-usability
2020-02-21 13:27:41 +01:00
Martin Diehl 6a90796618 bugfix: wrong string for comparison 2020-02-21 09:42:56 +01:00
Martin Diehl a2e710c89c alinged for better readability 2020-02-21 08:45:11 +01:00
Martin Diehl c9c78aa90d do not store invFp and invFi for all points
requires to explicitly calculate inverse of Fp and Fi for the tangent
calculation. Hence, classical tradeoff between memory consumption and
runtime.
2020-02-21 08:41:08 +01:00
Martin Diehl 1a0f4b185f Merge branch 'development' into simple-output-handling 2020-02-20 22:18:58 +01:00
Martin Diehl ab88ffd28e Merge branch 'MiscImprovements' into development 2020-02-20 22:15:02 +01:00
Martin Diehl d108d76a61 was never read
probably it was optimized away by the compiler, still confusing
2020-02-20 15:08:32 +01:00
Sharan Roongta ef4b7437f3 Input arguments of a function to be declared first. 2020-02-20 14:01:26 +01:00
Martin Diehl dc7e7e5bcc less writing, same functionality 2020-02-14 23:21:58 +01:00
Martin Diehl 420d9bd036 no enums for thermal
better readable, less line of code
2020-02-14 22:50:30 +01:00
Martin Diehl 7311d50df7 final enum removal for plastic laws 2020-02-14 21:41:13 +01:00
Martin Diehl a8e2ee0a86 [skip ci] is read only for other modules 2020-02-14 21:31:03 +01:00
Martin Diehl b1780e71c8 style unification, no enums for output 2020-02-14 09:23:09 +01:00
Martin Diehl 8d6c82e704 no need for enums
they just complicate the code, any performance gain should be negligible
2020-02-14 09:00:14 +01:00
Martin Diehl 486385978c no need for outputID
just adds overhead, one string comparison per output and increment is
computationally not an issue

also unified to PEP recommendation of function description
2020-02-14 08:39:29 +01:00
Martin Diehl 6adb116712 [skip ci] whitespace adjustments 2020-02-14 06:24:17 +01:00
Martin Diehl 4f7bbb323e not needed 2020-02-13 18:43:20 +01:00
Martin Diehl 64e86666c6 also set initial det(Fp)=0
Marc element lib test failed otherwise for type 117
2020-02-13 17:10:27 +01:00
Martin Diehl 0f70a19266 Fp matters, not Fp^-1
mathematically absolutely equivalent, but numerically not. Sometikes makes a
huge difference in convergence behavior, even though abs(det(Fp)-1) is
in the order of 1e-15
2020-02-13 14:48:32 +01:00
Martin Diehl fc82ec9b1b tiny deviations from det(Fp) = 1 cause convergence problems 2020-02-13 09:18:49 +01:00
Martin Diehl fa903c6f35 not needed anymore 2020-02-12 20:50:09 +01:00
Martin Diehl b861ad11c1 tiny differences between orientation conversions result in more
iterations

Seen so far only for plasticityDetectChanges test (confirmed for dislotwin and
phenopowerlaw).
The max difference between the entries of the rotation matrix from
orientation0%asMatrix() and eu2om(Eulers)/eu2om(orientation0%asEulers) is
1e-15. This is the ratio of km/atom radius! Still, the number of
iterations is consistently higher.
Results are the same. I believe this is a strange coincidence where one
particular orientation causes problems. The current version recovers almost the 'good' behavior
of math_EulerToR(Eulers)
2020-02-12 20:49:02 +01:00
Martin Diehl 8770613e9c better readable 2020-02-12 06:26:22 +01:00
Martin Diehl ab475b7c6b need 'error return'
revert from change in 5b72110d
2020-02-12 06:02:37 +01:00
Martin Diehl 08174a119f consistent name 2020-02-11 17:50:07 +01:00
Martin Diehl 5b72110d0a simplified 2020-02-11 17:47:48 +01:00
Martin Diehl e212f91fac print statements prevents reading code
first re-structure and clean, than re-implement where useful
2020-02-11 17:41:30 +01:00
Martin Diehl 6463fcdabd consistent names 2020-02-11 17:36:43 +01:00
Martin Diehl c2c84d698f Merge remote-tracking branch 'origin/development' into MiscImprovements 2020-02-11 17:11:43 +01:00
Franz Roters 81ae66860a Merge remote-tracking branch 'remotes/origin/explicitNonlocal' into development 2020-02-11 10:32:53 +01:00
Martin Diehl a306e473ef use rhoSgl0 (converged situation) 2020-02-11 05:41:10 +01:00
Martin Diehl cd76172d74 debugging PETSc 2020-02-08 09:17:44 +01:00
Martin Diehl 187b3603d3 using new names 2020-02-08 09:08:52 +01:00
Martin Diehl 8f2e345ab4 polishing 2020-02-08 08:19:06 +01:00
Martin Diehl 4c4c052e73 slowly getting newer PETSc versions to work 2020-02-08 07:03:18 +01:00
Martin Diehl 5456ee98f4 still needed (new section was created) 2020-02-08 06:59:37 +01:00
Martin Diehl 984370d7d1 not needed 2020-02-07 18:34:00 +01:00
Martin Diehl e932b386b9 Merge branch 'development' into MiscImprovements 2020-02-07 17:11:01 +01:00
Martin Diehl 5d4d1dcf9a all nonlocal parts are fully explicit
i.e. they are based on converged (partioned0) states
2020-02-07 12:41:01 +01:00
Martin Diehl f854dc27e9 explicit dotState for nonlocal
all flux related quantities are calculated based on the converged
quantities
2020-02-07 12:23:22 +01:00
Martin Diehl 4f4c6c5949 using converged dislocation velocity (from last subinc) 2020-02-07 12:01:54 +01:00
Martin Diehl c7e3ac28f6 preparing data handling for explicit forward of flux 2020-02-07 11:44:03 +01:00
Martin Diehl 1ceba73d31 adopting to PETSc >3.10
thanks to Matthew Knepley from the PETSc team
2020-02-07 09:10:08 +01:00
Martin Diehl 98e5713ce5 Merge branch 'development' into noAbaqus 2020-02-06 18:33:13 +01:00
Franz Roters 47109b903b Merge branch 'plasticity-submodule' into 'development'
Plasticity submodule

See merge request damask/DAMASK!120
2020-02-06 10:13:48 +01:00
Martin Diehl cab000f4b4 not used 2020-02-04 23:52:10 +01:00
Martin Diehl 13ce372684 not used 2020-02-04 23:45:34 +01:00
Martin Diehl 2d74a83dad cleaning 2020-02-03 23:48:09 +01:00
Martin Diehl 9e131c0110 rank 0 takes care of statistics file 2020-02-03 23:09:46 +01:00
Martin Diehl e9dad64f2b use central functionality 2020-02-03 23:01:08 +01:00
Martin Diehl 7bdfd05749 simplified 2020-02-03 22:44:57 +01:00
Martin Diehl c6579f8890 [skip ci] unified 2020-02-03 22:41:52 +01:00
Martin Diehl 1ad79883b4 not needed 2020-02-03 22:33:56 +01:00
Martin Diehl 0ce0bb2d85 better understandable 2020-02-03 21:39:00 +01:00
Martin Diehl 54589a9c56 crystallite does not exist any more 2020-02-02 20:37:05 +01:00
Martin Diehl 588525611b also report correctly negative seeds 2020-02-01 09:04:02 +01:00
Martin Diehl 796fd9a774 natural order 2020-01-31 21:43:45 +01:00
Martin Diehl 042d09a730 names from paper 2020-01-31 21:43:12 +01:00
Martin Diehl 55e53536f2 fixing indentation
always 2 spaces, not 1 for the first level
2020-01-31 21:37:18 +01:00
Martin Diehl 26496976c8 not used anymore 2020-01-31 21:19:15 +01:00
Martin Diehl 0d96c728fe better readable 2020-01-31 07:02:24 +01:00
Martin Diehl 3791c50468 better readable 2020-01-31 06:55:26 +01:00
Martin Diehl f5f397cb70 better readable 2020-01-31 06:52:11 +01:00
Martin Diehl 6ce4ce523a Merge branch 'MiscImprovements' of magit1.mpie.de:/damask/DAMASK into MiscImprovements 2020-01-31 00:13:25 +01:00
Martin Diehl 269d65005b use nomenclature from the DAMASK paper 2020-01-31 00:07:23 +01:00
Martin Diehl 0b8ff64884 store mapping MARC/FEM2DAMASK mapping
do not calculate the mapping for elements and nodes per call on
the fly, rather store it. Not memory efficient in the case that numbers
are not consequtive (order does not matter, but missing nodes/elements
would waste some 2 integers per missing number). However, this seem to cause
problems anyway when range indicators like '1 to 10' are used.
2020-01-30 23:39:59 +01:00
Martin Diehl d54b8714e1 avoid invalid error access 2020-01-29 23:42:50 +01:00
Martin Diehl c2cdcb17f7 wrong string 2020-01-29 23:04:15 +01:00
Martin Diehl 59fe9d06b0 shortening 2020-01-29 22:53:19 +01:00
Martin Diehl 9690f170e1 4 space indentation 2020-01-29 22:44:42 +01:00
Martin Diehl f5bd544b36 [skip ci] was too general 2020-01-29 18:15:49 +01:00
Martin Diehl 9c138c87f0 not needed 2020-01-29 14:57:12 +01:00
Martin Diehl 64be6a277d it's the surface, not the edge 2020-01-29 14:48:15 +01:00
Martin Diehl b938f1a98d polishing
* constants in CAPITALS
* more tests
* 'forall' is deprecated in Fortran 2018
2020-01-29 14:01:14 +01:00
Martin Diehl 348a91d503 Merge branch 'MiscImprovements' of magit1.mpie.de:/damask/DAMASK into MiscImprovements 2020-01-29 13:17:58 +01:00
Martin Diehl 3f96c12e06 avoid code duplication 2020-01-29 11:09:57 +01:00
Martin Diehl 49bfdcecab avoid accessing non-existing chunks
note that Fortran does not shortcut logical expressions, hence the new
function
2020-01-29 09:13:55 +01:00
Martin Diehl b8263519ca ignore empty lines 2020-01-29 08:00:28 +01:00
Martin Diehl 7b0850f929 only read relevant lines 2020-01-29 00:10:05 +01:00
Martin Diehl 57db134c6d polishing 2020-01-28 23:44:07 +01:00
Martin Diehl 5d1f68bf93 Merge branch 'fix-elem-7-57' into noAbaqus 2020-01-27 19:27:53 +01:00
Martin Diehl 6636f56cab Merge remote-tracking branch 'origin/development' into fix-elem-7-57 2020-01-27 19:23:35 +01:00
Martin Diehl fb5e57aa1a WIP: implementing static map for Marc->DAMASK (elem/nodes) 2020-01-26 23:12:48 +01:00
Martin Diehl d2a3fd3ac8 not needed to parse in nElem 2020-01-26 22:51:06 +01:00
Martin Diehl f044b8c42f explain data layout 2020-01-26 21:58:36 +01:00
Martin Diehl 0a1bac6787 flush helps to detect errors 2020-01-26 21:50:43 +01:00
Martin Diehl f546ffb3be polishing 2020-01-26 21:22:55 +01:00
Martin Diehl 79aeea052f does not exist anymore (is not needed) 2020-01-26 21:07:21 +01:00
Martin Diehl f8c5dbea71 typo (MSC.Marc did not compile) 2020-01-26 21:02:32 +01:00
Martin Diehl cda1f4acab more tests
failed unitTests report consistently with "internal error"
2020-01-26 20:53:13 +01:00
Martin Diehl a4134b4552 doing some internal checks
trivial, but better safe then sorry
2020-01-26 20:24:09 +01:00
Martin Diehl 830b05005f read file only once 2020-01-26 19:56:30 +01:00
Martin Diehl 62865e779d polishing 2020-01-26 18:31:56 +01:00
Martin Diehl a6e979ae1f simplified parsing of strings, floats, and ints
invalid characters for interpretation as float and int now raise error,
no warning
requesting invalid chunk now raises error, no warning
2020-01-26 18:23:23 +01:00
Martin Diehl 0eba4e39cc trying to make the whole procedure understandable 2020-01-26 14:18:16 +01:00
Martin Diehl 81fba131f6 variable string length 2020-01-26 13:28:12 +01:00
Martin Diehl decf9371ea avoid issues with unsufficient length of strings 2020-01-26 13:18:29 +01:00
Martin Diehl 3b8dd17e5b avoiding hard-coded constants 2020-01-26 12:25:45 +01:00
Martin Diehl fe22b84d5c maximum path length is 4096 2020-01-26 12:19:36 +01:00
Martin Diehl 9c7f6811a2 use default string length 2020-01-26 12:17:59 +01:00
Martin Diehl 1be37de993 not used (defaults are given in the respective modules) 2020-01-26 11:46:14 +01:00
Martin Diehl 24a8d7ed29 256 (pStringLen) might not be sufficient for file operations 2020-01-26 11:40:25 +01:00
Martin Diehl 9a0d8db23e [skip ci] replacement is done 2020-01-26 10:53:24 +01:00
Martin Diehl ffea69955e polishing and testing
element 11/12 (7/57 for MSC.Marc) have the same geometry type, i.e. both
are a hexahedral with 8 integration points/cells
Type 11 is linear (8 nodes), type 12 quadradic with reduced integration (20 nodes).
The modified definition ensures that the cell nodes 9-20 of element 11
are in the same order as the real nodes 9-20 of element 12. Real nodes
1-8 (corners) and 21-27 needed no modification.

Notes:
 * Documentation on https://damask.mpie.de/Documentation/ElementType is now outdated.
 * Element defition in MSC.Marc manual volume B (2001 version) is
   confusing because element numbering is sometimes clowise and
   sometimes counterclockwise. The latter one seems to be correct
2020-01-26 09:24:32 +01:00
Martin Diehl b16f4155d4 cell definition follows correct order for 11/12 (7/57 in MSC.Marc) 2020-01-26 09:06:45 +01:00
Martin Diehl 7671e257bd reorder elem 11 (Marc 7) to match 12 (Marc 57) 2020-01-26 08:17:59 +01:00
Martin Diehl 2100742a31 better have no support then untested support 2020-01-26 08:17:25 +01:00
Martin Diehl 13107abd39 not working and significat efforts needed to test it 2020-01-26 07:44:22 +01:00
Martin Diehl 8a2a9d3861 avoid direct file operations 2020-01-25 13:30:42 +01:00
Martin Diehl a2e4160e61 read file only once 2020-01-25 10:58:04 +01:00
Martin Diehl ddeebc189a [skip ci] documenting further use 2020-01-25 09:31:27 +01:00
Martin Diehl e532641015 dependency on element not needed for homogeneous meshes 2020-01-25 09:24:42 +01:00
Martin Diehl 624ede8177 clear separation between solver and DAMASK 2020-01-25 09:12:09 +01:00
Martin Diehl bdae2a40cc independent of IO 2020-01-25 08:56:39 +01:00
Martin Diehl bfe8585903 Merge branch 'development' into MiscImprovements 2020-01-24 20:08:14 +01:00
Martin Diehl 5fae924e88 Merge branch 'MiscImprovements' of magit1.mpie.de:/damask/DAMASK into MiscImprovements 2020-01-24 19:58:57 +01:00
Sharan Roongta 3d6ec6955f Merge branch 'PGI-support' into development 2020-01-24 12:24:38 +01:00
Martin Diehl b807406a70 avoid public variables 2020-01-23 14:08:14 +01:00
Martin Diehl f0ad18102d preparing to clean FEsolving
should not have solver dependent functionality
2020-01-23 13:49:12 +01:00
Martin Diehl bd67d2bb6a new mappings have clear name, not (1,2) 2020-01-23 13:16:45 +01:00
Martin Diehl 7f66d4e975 avoid fixed string length
solved issues with wrong trim and is more robust
2020-01-23 11:21:42 +01:00
Martin Diehl 7273f1461c avoid fixed string length where possible 2020-01-23 09:35:41 +01:00
Martin Diehl 1bfd8a8c21 continuousIntValues is very specific for Marc
define where it is used
2020-01-23 08:37:03 +01:00
Martin Diehl 246187865e more flexibility 2020-01-23 08:19:21 +01:00
Martin Diehl cc67b1bd3b automatic length determination for more flexibility 2020-01-23 07:29:38 +01:00
Martin Diehl d28b18267b polishing 2020-01-23 07:19:44 +01:00
Martin Diehl 2c942de45d do no rely on IO functions
should become part of the marc specific code
2020-01-22 08:55:39 +01:00
Martin Diehl 0c4790d468 solver specific, should not be reported here 2020-01-22 08:24:55 +01:00
Martin Diehl d27aac0970 clearer structure 2020-01-21 19:33:22 +01:00
Martin Diehl 0ef0db586f Merge branch 'MiscImprovements' of magit1.mpie.de:/damask/DAMASK into MiscImprovements 2020-01-21 19:24:30 +01:00
Martin Diehl 91d25ec897 rename in PETSc function 2020-01-21 18:18:27 +01:00
Martin Diehl ad2520bec1 compiles with PETSc > 3.10
but does not run
2020-01-21 15:27:11 +01:00
Martin Diehl 8ef3985da7 debug info 2020-01-21 14:58:35 +01:00
Martin Diehl 1857a5e58a skip empty lines (i.e. blank line at the end) 2020-01-21 11:45:11 +01:00
Martin Diehl 9b4f773a0b work around for bug in Intel 2020-01-21 08:43:16 +01:00
Martin Diehl 1a31ff82bb avoid code duplication 2020-01-21 07:46:32 +01:00
Martin Diehl a18057ba4d use central functionality for file IO 2020-01-21 07:37:04 +01:00
Martin Diehl 2e38582824 no need for additional variables 2020-01-21 07:08:02 +01:00
Martin Diehl 47e5b0077a fixed typo 2020-01-21 06:53:32 +01:00
Martin Diehl 843676fb10 grouping variables for better readability 2020-01-21 06:10:19 +01:00
Martin Diehl db96ee0fc2 cleaning 2020-01-20 23:46:48 +01:00
Martin Diehl 80ae2f5f6b no need for public variables 2020-01-20 23:39:24 +01:00
Martin Diehl 4d673866b8 bugfix: copy and paste error 2020-01-20 23:31:51 +01:00
Martin Diehl b98ecccf73 better readable 2020-01-20 21:06:08 +01:00
Martin Diehl 56ab4f723d polishing 2020-01-20 20:36:21 +01:00
Franz Roters 701a9b18cc Merge remote-tracking branch 'remotes/origin/marc-improvements' into development 2020-01-18 12:21:24 +01:00
Martin Diehl d722c6db4a clear separation between OO and imperative arguments 2020-01-14 11:52:22 +01:00
Martin Diehl 9d1c1fdb92 enforce Re(q) > 0 2020-01-14 11:33:18 +01:00
Martin Diehl 27bc23c2e1 missing renames
wondering how this has passed the syntax check earlier
2020-01-14 07:55:18 +01:00
Martin Diehl e70c56701f not needed 2020-01-13 21:09:25 +01:00
Martin Diehl cad6fc7843 Merge branch 'development' into plasticity-submodule 2020-01-13 20:57:12 +01:00
Martin Diehl 544ff9b6ee gfortran rejects (Intel seems fine)
assume a bug, see https://gcc.gnu.org/bugzilla/show_bug.cgi?id=93251
2020-01-13 16:11:36 +01:00
Martin Diehl bd4db68a12 support for non QUAD cell type 2020-01-13 10:03:13 +01:00
Martin Diehl 0cf27a8229 indicate parameters and report vtk type 2020-01-13 10:02:23 +01:00
Martin Diehl a025edd09f Merge branch 'MoreImprovements' into PGI-support 2020-01-13 01:44:45 +01:00
Martin Diehl 2d294aba23 need to store cell nodes, not elem nodes 2020-01-12 18:32:20 +01:00
Martin Diehl ac0fa2fce9 no need for separate allocation 2020-01-12 16:50:36 +01:00
Martin Diehl eb7bd41acd no need for special functions 2020-01-12 16:08:38 +01:00
Martin Diehl fb8494e2b8 write out nodal displacements
does not work: Not updated and wrong size
2020-01-12 15:42:08 +01:00
Martin Diehl 9d1543c9cc functionality was used only once 2020-01-12 01:54:38 +01:00
Martin Diehl 8aa13a55ce enable handling of connectivity that spreads over multiple lines
same code works also for old style tables, probably some flexibility
regarding non-CP elements is lacking ..
2020-01-12 00:58:12 +01:00
Martin Diehl 46cb787934 avoid HDF5 error when creating link twice 2020-01-12 00:55:00 +01:00
Martin Diehl 5bc1c98da7 use 0-based indexing for worldrank 2020-01-12 00:49:03 +01:00
Martin Diehl ddd8027b8a autodetect string length 2020-01-12 00:10:42 +01:00
Martin Diehl 3938f34978 Merge branch 'MiscImprovements' into MoreImprovements 2020-01-11 22:37:41 +01:00
Martin Diehl 2d9c25f8e5 Merge branch 'development' into MiscImprovements 2020-01-11 20:34:35 +01:00
Martin Diehl d4535dadb4 use American english 2020-01-11 20:33:29 +01:00
Martin Diehl ac112d2d36 tolerance needed for optimized code 2020-01-11 13:55:56 +01:00
Martin Diehl e762cb4dfd issue with gfortran < 9
the false branch of merge seems to be evaluated which results in a
signaling NaN
2020-01-11 12:36:35 +01:00
Martin Diehl 842666cc20 no overlap with Marc's code 2020-01-11 11:25:50 +01:00
Martin Diehl 3a6819f548 check for invalid operations 2020-01-11 05:19:15 +01:00
Martin Diehl f028519597 some facts from wikipedia as tests 2020-01-11 04:59:38 +01:00
Martin Diehl de95ca5906 inverse of a quaternion 2020-01-11 04:15:51 +01:00
Martin Diehl 115716b8c2 polishing/use existing functions 2020-01-11 03:58:12 +01:00
Martin Diehl c7180c3295 some more tests for quaternion operations 2020-01-11 03:50:17 +01:00
Martin Diehl aefd401e8c this is a quaternion class
it is meant to represent any quaternion, not only unit
quaternions/rotations that follow a specific convention. Need to check
in rotations.f90 where the homomorph should happen
2020-01-11 03:11:45 +01:00
Martin Diehl 79cafebffe following https://www.python.org/dev/peps/pep-0257/ 2020-01-11 03:08:39 +01:00
Philip Eisenlohr 3a08a8bbe2 always using intrinsic init when assigning quaternions as output variables 2020-01-10 12:16:18 -05:00
Martin Diehl 115a2552f8 4 newer versions are out 2020-01-10 03:19:39 +01:00
Martin Diehl 87c7a5d5a3 polishing 2020-01-10 02:11:19 +01:00
Martin Diehl 8f43f05437 stronger encapsulation 2020-01-10 01:45:00 +01:00
Martin Diehl 0771411cd8 group similar operations 2020-01-10 01:33:03 +01:00
Martin Diehl 7d2012f492 no need to exclude small values
no danger of division by zero
2020-01-10 01:29:35 +01:00
Martin Diehl 70e23fea93 polishing 2020-01-10 01:28:32 +01:00
Martin Diehl bd6f2a6b5c consistent string length 2020-01-04 19:01:36 +01:00
Martin Diehl 6b6ad52355 use variable string as return (no need for trim) 2020-01-04 18:53:55 +01:00
Martin Diehl 3999c0b630 is not used anymore (and IO_fixedXXXvalue seem to be superfluous) 2020-01-04 17:29:25 +01:00
Martin Diehl bd5f963260 polishing 2020-01-04 16:54:07 +01:00
Martin Diehl 0898cc2605 PGI has problems with forall in this case 2020-01-04 03:18:51 +01:00
Martin Diehl d2a9946f83 PGI compiler has problems with norm2 or dEq 2020-01-04 01:54:19 +01:00
Martin Diehl 00e14b9861 PGI does not allow sum in init for parameter 2020-01-04 01:04:20 +01:00
Martin Diehl e1b35be23a not used anymore 2020-01-03 15:41:46 +01:00
Martin Diehl 326e3d0824 polishing 2020-01-03 14:02:14 +01:00
Martin Diehl 886e111064 not needed 2020-01-03 13:53:23 +01:00
Martin Diehl 2975e46ca1 not needed 2020-01-03 13:52:06 +01:00
Martin Diehl 4ebd89c040 shape is known (no need for automatic allocation) 2020-01-03 13:47:04 +01:00
Martin Diehl a6ddbbd70c cleaning 2020-01-03 12:40:25 +01:00
Martin Diehl d81dc01ce0 we consider indvidual systems, not families 2020-01-03 12:14:20 +01:00
Martin Diehl e1168c09b9 use specialized functions 2020-01-02 21:28:34 +01:00
Martin Diehl c919237998 one loop is enough 2020-01-02 21:02:37 +01:00
Martin Diehl f633c67fe4 polishing 2020-01-02 20:49:02 +01:00
Martin Diehl 1ad8464821 not needed
object-oriented mesh did not work out nicely
2020-01-02 20:38:40 +01:00
Martin Diehl 6a0593bf9e everything is anyway public 2020-01-02 19:47:48 +01:00
Martin Diehl e0110c676e avoid long lines 2020-01-02 18:44:51 +01:00
Martin Diehl 27a6d1d682 private functions do not need a prefix 2020-01-02 15:14:12 +01:00
Martin Diehl ce08571cd8 documentation was outdated 2020-01-02 13:39:52 +01:00
Martin Diehl d4d419b713 better readable 2019-12-30 06:48:55 +01:00
Martin Diehl f9fcaca60b aliases are just confusing 2019-12-26 15:24:51 +01:00
Martin Diehl af0a4c5d26 unused 2019-12-26 15:24:37 +01:00
Martin Diehl be319c5a83 single source of truth 2019-12-25 09:24:42 +01:00
Martin Diehl 0d975e7023 polishing
- default string length
- Nslip/Ntwin/Ntrans not stored in state anymore
2019-12-21 12:42:18 +01:00
Martin Diehl 34af10fac1 using default string length 2019-12-21 12:39:54 +01:00
Martin Diehl 127678e2e1 use default string length 2019-12-21 12:28:24 +01:00
Martin Diehl 27483bafbc non-existing value evaluates to 0 or 1 2019-12-21 11:52:33 +01:00
Martin Diehl 747a340599 unified string length 2019-12-21 11:46:12 +01:00
Martin Diehl 83cf062318 better define only once 2019-12-21 11:19:33 +01:00
Martin Diehl ac182ef536 less variable, same style 2019-12-21 11:13:05 +01:00
Martin Diehl 6678770c43 public variables not needed anymore 2019-12-21 10:43:36 +01:00
Martin Diehl 7baf4e7f53 cleaning 2019-12-21 10:37:18 +01:00
Martin Diehl 91ad5092f4 preparing removal of old output data 2019-12-21 10:31:19 +01:00
Martin Diehl 4dc5dac831 was only needed for postResults 2019-12-21 10:20:50 +01:00
Martin Diehl af6973adf6 HDF5 out is always on 2019-12-21 10:13:52 +01:00
Martin Diehl 6425c37f2d use default string length
256 characters are more than enough for string values and keys
2019-12-21 10:07:37 +01:00
Martin Diehl 19a45d9c2b cleaning of source modules:
- offset and instance are only used locally
- output names are needed only temporarly
- HDF5 is always enabled
2019-12-21 07:55:42 +01:00
Martin Diehl 41650cdd11 use standard string length 2019-12-21 07:38:17 +01:00
Martin Diehl b10e862be8 the compiler can do the counting 2019-12-21 07:34:40 +01:00
Martin Diehl f0d3b29b82 Merge branch 'development' into MiscImprovements 2019-12-21 06:53:56 +01:00
Martin Diehl befd4e2adf avoid imports 2019-12-19 07:49:53 +01:00
Martin Diehl f0ad075802 fixed indentation 2019-12-19 00:01:44 +01:00
Martin Diehl 98e606d6f0 correct type 2019-12-19 00:00:00 +01:00
Martin Diehl 4b6388fbb2 always use HDF5 output 2019-12-18 20:05:51 +01:00
Martin Diehl 63fc125398 include origin do DADF5
requires updat of file version
2019-12-13 09:12:07 +01:00
Martin Diehl ee56b82c8a avoid spaces 2019-12-12 23:22:37 +01:00
Martin Diehl a0a99c526b some remaining IntOut format strings 2019-12-11 19:28:31 +01:00
Martin Diehl 9e801928b0 Merge branch 'development' into noPostResults 2019-12-11 09:28:45 +01:00
Martin Diehl 9b67ead62f removed postResults completely 2019-12-11 00:10:02 +01:00
Martin Diehl 8fb8e9be6e write temperature to DADF5 2019-12-10 20:25:19 +01:00
Martin Diehl db91803b80 cleaning 2019-12-10 17:52:37 +01:00
Martin Diehl ac35759c2f not a module subroutine 2019-12-10 17:25:51 +01:00
Martin Diehl 5681e661e2 DADF5-results replaces postResults 2019-12-10 07:31:09 +01:00
Martin Diehl 4be7aa990c HDF5 results output for constitutive damage models 2019-12-10 06:45:00 +01:00
Martin Diehl 5abe27ab60 only locally used 2019-12-09 06:24:37 +01:00
Martin Diehl 1c18086402 not needed anymore 2019-12-09 05:58:27 +01:00
Martin Diehl 07ebd8d1b3 only damage/thermal 'homogenization' postResults is currently needed 2019-12-09 05:48:37 +01:00
Martin Diehl acc252ea5b thermal/damage constitutive (i.e. source) results are not tested 2019-12-09 05:38:15 +01:00
Martin Diehl c2e91ae5e1 copy and paste error, wrong array was set 2019-12-08 20:52:05 +01:00
Martin Diehl b0ce324213 Merge remote-tracking branch 'origin/development' into simple-int-formatting 2019-12-08 20:24:05 +01:00
Martin Diehl fbe2228ade avoid string length mismatch 2019-12-07 20:22:55 +01:00
Vitesh 3e269f0419 Merge branch 'only-use-rotation-class' into 'development'
Only use rotation class

See merge request damask/DAMASK!110
2019-12-07 17:33:34 +01:00
Martin Diehl 4eacc1d16d polishing 2019-12-07 15:45:37 +01:00
Martin Diehl 23944de6de less variables for better readability 2019-12-07 15:20:04 +01:00
Sharan Roongta 5a6111ec69 Merge branch 'incs-no-leading-zero' into 'development'
Incs no leading zero

See merge request damask/DAMASK!108
2019-12-07 11:32:37 +01:00
Martin Diehl 7ecb0245ec simplified (use novel i0 format specifier) 2019-12-07 11:12:46 +01:00
Martin Diehl 137b235bc1 i0 format specifier easier then hand-written IO_intOut
using variable pStringLen allows string assignment without length issues
2019-12-07 11:06:39 +01:00
Martin Diehl 04492eeb0a Merge branch 'almost-no-postResults' into only-use-rotation-class 2019-12-05 19:42:50 +01:00
Martin Diehl 78e96993df Merge branch 'almost-no-postResults' into only-use-rotation-class 2019-12-05 19:41:32 +01:00
Martin Diehl f585e1a553 not used 2019-12-05 11:20:05 +01:00
Martin Diehl ab1f0dc16b submodules allow inter-module communication 2019-12-04 22:31:15 +01:00
Martin Diehl 7d6a57dc17 Merge branch 'only-use-rotation-class' into plasticity-submodule 2019-12-04 19:02:01 +01:00
Martin Diehl cb0d39eee6 not needed anymore 2019-12-04 19:00:56 +01:00
Martin Diehl 58a190ede8 Merge branch 'development' into incs-no-leading-zero 2019-12-04 05:19:38 +01:00
Martin Diehl 93da6d3f63 was not used 2019-12-02 23:07:01 +01:00
Martin Diehl c36a5bdfbb bugfix: calculation of size of postResults was wrong 2019-12-02 23:06:28 +01:00
Martin Diehl 9882c3532a avoid use of low-level HDF5 routines 2019-12-02 22:26:08 +01:00
Martin Diehl 4ee2e551b8 migrating to submodules 2019-12-02 22:15:34 +01:00
Martin Diehl 226b715c46 file names reflect hierarchical structure 2019-12-02 21:38:41 +01:00
Martin Diehl e52a747774 submodules allow inter-module communication 2019-12-02 20:57:18 +01:00
Martin Diehl f5292019e5 use rotation class 2019-12-02 20:23:50 +01:00
Martin Diehl 8a9d3f8d6d avoid code duplication 2019-12-02 20:09:27 +01:00
Martin Diehl 83453d10ef use rotation class for consistent handling of rotations 2019-12-02 16:37:22 +01:00
Martin Diehl be099e38c2 might be of use 2019-12-02 16:22:27 +01:00
Martin Diehl 8189b50509 same functionality but tested 2019-12-02 12:58:23 +01:00
Martin Diehl 2969a53338 not used/needed anymore 2019-12-02 12:54:45 +01:00
Martin Diehl f85ee7d7fb plasticity is postResults-free 2019-12-02 12:39:44 +01:00
Martin Diehl 2b3b26087f consistent names 2019-12-01 20:07:16 +01:00
Martin Diehl 05aa38cc71 using short names 2019-12-01 15:05:49 +01:00
Martin Diehl bb152a171a consistent naming among plasticity laws 2019-12-01 10:32:45 +01:00
Martin Diehl 1cf1da5bcc consistent naming 2019-12-01 09:35:44 +01:00
Martin Diehl 33c090d2ac pointers for better readability 2019-12-01 08:55:24 +01:00
Martin Diehl afad2f2dce short and consistent naming 2019-12-01 08:39:30 +01:00
Martin Diehl df4b642400 polishing 2019-12-01 08:33:04 +01:00
Martin Diehl 07fb915a7e postResults not needed anymore 2019-12-01 08:27:56 +01:00
Martin Diehl c7d675a1e9 not needed anymore 2019-11-30 16:03:18 +01:00
Martin Diehl d93fb12e8c remove extra output
current implementation was not very general, no separation of different
dislocation types.
if output is needed, re-implemenation is straight forward
2019-11-30 14:36:54 +01:00
Martin Diehl 8f77843b0f improved naming
- clearer variable names
- no '-' in attributes
- single source of truth
2019-11-30 09:01:37 +01:00
Martin Diehl dc3fc8f70c do not clutter with leading zeros 2019-11-29 17:00:48 +01:00
Martin Diehl 530f2d3c08 Merge branch 'no-crystallite' into almost-no-postResults 2019-11-25 21:51:15 +01:00
Martin Diehl 67c8d3899d crystallite output fully removed 2019-11-25 08:44:44 +01:00
Martin Diehl 127a29ab1a cleaning 2019-11-24 13:42:19 +01:00
Martin Diehl 97474e05a8 not needed anymore 2019-11-24 11:01:04 +01:00
Martin Diehl e20477099e no crystallite output 2019-11-24 09:46:46 +01:00
Martin Diehl 50b48b8bf7 IP neighbourhood deprecated
trivial for grid and, hence, not written out.
Test for marc/abaqus/mesh would make more sense
2019-11-24 07:54:34 +01:00
Martin Diehl a6a6519678 more local data handling 2019-11-24 07:44:17 +01:00
Martin Diehl bb73a08cf4 better encapsulation
for results operations, do not rely directly on HDF5 module
2019-11-24 07:27:05 +01:00
Martin Diehl 1c10459a5a also use fast operation order 2019-10-30 21:09:17 +01:00
Martin Diehl ffb112b0d8 Merge branch 'development' into DADF5-improvements 2019-10-30 17:16:54 +01:00
Martin Diehl 368d4debda calculate average nodal position directly
no need to average and have second memory access
2019-10-30 14:49:08 +01:00
Martin Diehl 40507846c9 cell displacement are between nodes which start at (0,0,0) 2019-10-30 14:47:42 +01:00
Martin Diehl 1d2d7d1ea3 remove public variables
they make code unreadable and unmaintainable
2019-10-29 23:24:12 +01:00
Martin Diehl 0c6b7e1112 not nice, but working ... 2019-10-29 23:15:02 +01:00
Martin Diehl 402e681cf5 initialization of arrays for fourier transform more reasonable
- padding entries in real data array need to be zero
- all values of the fourier data arrays are explicitly set
2019-10-29 16:18:58 +01:00
Martin Diehl 1ae33cf215 avoid one loop and use filtered frequencies 2019-10-29 09:15:35 +01:00
Martin Diehl f451d19c1e forall is obsolete
some calculation simplified
2019-10-28 21:27:57 +01:00
Martin Diehl c47f516769 do not correct fluctuations 2019-10-28 21:16:43 +01:00
Martin Diehl ed8834e371 maybe we can do some guessing for CPFEM .. 2019-10-28 13:38:30 +01:00
Martin Diehl d1f719d3cf separation of "age" and "forward" not useful 2019-10-28 13:36:36 +01:00
Martin Diehl 8de6fcfc24 unifying names 2019-10-28 13:29:32 +01:00
Martin Diehl ab4a98fb53 make use of HDF5 and structure data 2019-10-28 13:17:05 +01:00
Martin Diehl 10f2c53256 clearly distiguish
- DAMASK as a materialpoint model (CPFEM, not fitting name)
- solver
2019-10-25 08:30:12 +02:00
Martin Diehl 07d8379313 further untangling 2019-10-25 07:55:23 +02:00
Martin Diehl cf8b16c066 better have one function per task
but separating ageing and forward for the solver is not trivial due to
guessing
2019-10-25 07:31:09 +02:00
Martin Diehl eb4cad17b5 avoid public variables 2019-10-25 00:53:48 +02:00
Martin Diehl 378729f5c4 clearer structure 2019-10-25 00:42:59 +02:00
Martin Diehl 9db5cbb667 trying to get rid of a global "restartWrite" variable 2019-10-24 22:50:30 +02:00
Martin Diehl 3d44e7598e works only for MSC.Marc 2019-10-24 13:57:14 +02:00
Martin Diehl 0bc4326618 better have one function per task 2019-10-24 13:46:36 +02:00
Martin Diehl 7c0bb2fdf8 consistent description 2019-10-24 13:37:40 +02:00
Martin Diehl 71def397d5 no need to age before writing restart data 2019-10-24 13:14:40 +02:00
Martin Diehl 176f6028cd CPFE2 writes current variables (like grid solvers) 2019-10-24 13:06:42 +02:00
Martin Diehl c1cf64bf00 was not used/tested 2019-10-24 12:15:22 +02:00
Martin Diehl c0c0831c92 multiple keyword are more confusing then helpful 2019-10-24 06:37:28 +02:00
Martin Diehl 50769b52a5 don't continue if calculation did not converge 2019-10-24 06:32:46 +02:00
Martin Diehl 0483fc7b3f small functions with one task are better 2019-10-24 06:16:42 +02:00
Martin Diehl 534073358e arguments are better than public variables 2019-10-23 23:06:47 +02:00
Martin Diehl 67228b46a6 modularize 2019-10-23 22:50:01 +02:00
Martin Diehl 52190382ac cleaning 2019-10-23 22:42:46 +02:00
Martin Diehl dfe65e406d restart for commercial FE solvers untested
better no code than unreliable code. If functionality is needed,
implement it without the use of publicly writeable variables
2019-10-23 22:13:31 +02:00
Martin Diehl 8a4a5a8bef Merge remote-tracking branch 'origin/development' into age-separately-2 2019-10-23 22:05:30 +02:00
Martin Diehl e1d820bff1 does not support restart 2019-10-23 22:04:50 +02:00
Martin Diehl 60a19c020d cleaning 2019-10-23 21:17:56 +02:00
Martin Diehl ac0149e55e not needed (is initialized to 0) 2019-10-21 11:48:35 +02:00
Martin Diehl 0b4605361b plotv only needed for postResults 2019-10-20 19:23:50 +02:00
Martin Diehl 872c85112f bugfix, Lp not available anymore for crystallite 2019-10-20 14:02:12 +02:00
Martin Diehl b96bd71b09 postResults not needed anymore 2019-10-20 13:24:47 +02:00
Martin Diehl f93336b072 postResults for isotropic not needed anymore 2019-10-20 13:21:51 +02:00
Martin Diehl 11993a3ad1 phasing out crystallite output
some outputs are still needed for a few remaining tests.
2019-10-20 12:03:08 +02:00
Martin Diehl fe94718bcd avoid accessing null-pointer 2019-10-20 10:32:14 +02:00
Martin Diehl 65eb4e364f phasing out postResults 2019-10-19 23:14:17 +02:00
Martin Diehl 603973e963 correct output for multipe integration points 2019-10-19 19:55:00 +02:00
Martin Diehl 3de605d782 better name 2019-10-19 16:06:01 +02:00
Martin Diehl 1253c6abf1 Merge remote-tracking branch 'origin/development' into labeled-systems 2019-10-18 19:31:08 +02:00
Sharan Roongta 2c0264191e typo! 2019-10-18 17:13:19 +02:00
Martin Diehl de912c22b4 Merge branch 'development' into HDF5-spectral-displacements 2019-10-18 12:54:12 +02:00
Franz Roters fea6c268a8 Merge branch 'nonlocal-again-with-Marc' into 'development'
Nonlocal again with marc

See merge request damask/DAMASK!99
2019-10-18 11:30:15 +02:00
Franz Roters 7ddb724861 [skip ci] corrected wrongly copied comment 2019-10-18 11:27:37 +02:00
Sharan Roongta cebbfc906d Merge branch 'hex-reorder-2ndtry' into development 2019-10-17 14:58:43 +02:00
Martin Diehl b9027e3257 checking size of unallocated array does not work 2019-10-17 08:40:05 +02:00
Martin Diehl 88df7f2957 store cell normal directions 2019-10-17 07:48:57 +02:00
Martin Diehl b386dc73b2 enable to non-transposed tensor data
usually, we store per data per cell, i.e. len(shape(x)) == 3 means x is
a tensor.
Due to the use of transposed tensors (due to column-major storage order
in Fortran), we usually want to store the transpose of (3x3) tensors.
Now the default can be changed
2019-10-17 07:46:20 +02:00
Martin Diehl 008f717c08 avoid reading from file 2019-10-17 06:10:00 +02:00
Martin Diehl 2b68c108f0 read from memory, not from file 2019-10-17 05:54:08 +02:00
Martin Diehl f33a99d125 polishing 2019-10-17 00:21:48 +02:00
Martin Diehl 3f481e1cea corrected volume calculation and write to DADF5.
follows https://www.osti.gov/servlets/purl/632793/
2019-10-16 22:00:25 +02:00
Martin Diehl 9b5545229f leftover comment ... 2019-10-16 21:13:43 +02:00
Martin Diehl 95ecc05cb0 better test ... 2019-10-16 21:13:26 +02:00
Martin Diehl 0ae0e23325 volume calculation was wrong
could result in negative volumes
2019-10-16 20:56:31 +02:00
Martin Diehl dbe15f88f2 bugfix: forgot to read file
first draft of nonlocal functions for area normal, area, and volume
2019-10-16 17:19:19 +02:00
Martin Diehl 4e213514bd cleaning 2019-10-16 13:04:20 +02:00
Martin Diehl 3a1c4f95c3 some polishing 2019-10-16 08:40:27 +02:00
Martin Diehl 3abb549eab better encapsulation
inputRead fully parses the input file and gives back the required data
2019-10-16 04:45:38 +02:00
Martin Diehl 0f77d2efdb consistent use of subroutines
clearly reveal input(out) arguments
2019-10-16 04:22:21 +02:00
Martin Diehl ffb4b2a455 theMesh is not useful
maybe a shared mesh class becomes useful when Abaqus and PETSc mesh
require similar functionality
elem type can be reported directly
2019-10-16 03:57:51 +02:00
Martin Diehl 1d70d9b6ae mesh type not very beneficial 2019-10-15 21:58:49 +02:00
Martin Diehl c4db2841ab further cleaning 2019-10-15 14:16:03 +02:00
Martin Diehl aab19af131 consistent use of subroutines, not functions.
grouping file reading into meta function
2019-10-15 12:54:46 +02:00
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 9ee709d214 polishing 2019-10-14 15:09:16 +02:00
Martin Diehl 1726d95a56 wrong macro was defined 2019-10-14 14:39:53 +02:00
Martin Diehl dcbd7624dd array order was wrong 2019-10-14 11:25:48 +02:00
Martin Diehl 57af822396 better readable 2019-10-14 10:36:59 +02:00
Martin Diehl 57fef8fa57 consistent naming 2019-10-14 10:08:35 +02:00
Martin Diehl fae4546cfd polishing 2019-10-14 09:37:31 +02:00
Martin Diehl 513b1906f6 bugfixes:
cell definition was not stored correctly due to wrong indexing
2019-10-14 08:23:21 +02:00
Martin Diehl c41d8eb257 use new data structure to calculate cell node coordinates 2019-10-13 23:34:03 +02:00
Martin Diehl 2b65c888c4 avoid public variables 2019-10-13 22:16:42 +02:00
Martin Diehl 33e639426a polishing 2019-10-13 21:45:08 +02:00
Martin Diehl d03efade06 better calculate nodes later 2019-10-13 21:09:49 +02:00
Martin Diehl 369cae5332 no public variables 2019-10-13 20:52:49 +02:00
Martin Diehl 6456f9891b avoid public variables 2019-10-13 20:34:20 +02:00
Martin Diehl c2a8701940 further removal of deprecated stuff 2019-10-13 19:55:25 +02:00
Martin Diehl 4999aa4e14 more cleaning 2019-10-13 19:41:55 +02:00
Martin Diehl e0cb1a87cd cleaning 2019-10-13 19:22:57 +02:00
Martin Diehl e3b16639bf native integer needs to match
otherwise, results are wrong. Therefore, we need to use our own HDF5
library since MSC provides one for 4 byte integers
2019-10-13 18:20:54 +02:00
Martin Diehl 004abc2d4e cell node definition needs to be stored 2019-10-13 13:28:04 +02:00
Martin Diehl ed1d06d6f1 make functions independent of file state 2019-10-13 11:53:35 +02:00
Martin Diehl 9ea91b84e8 easier to read and without file access 2019-10-13 11:48:27 +02:00
Martin Diehl 680ed535d7 avoid file operations and line labels 2019-10-13 10:42:34 +02:00
Martin Diehl d6b6096007 avoid global variables 2019-10-12 22:40:00 +02:00
Martin Diehl 7611513bb8 strange indentation 2019-10-12 22:18:55 +02:00
Martin Diehl 4c9bc326f6 better read file only once 2019-10-12 21:58:26 +02:00
Martin Diehl e6d25bfdab almost no shared functionality 2019-10-12 19:24:03 +02:00
Martin Diehl d8d99f3694 geometry folder needs to be created earlier 2019-10-12 16:39:44 +02:00
Martin Diehl fabab08936 did not run without HDF5 support 2019-10-12 16:25:59 +02:00
Martin Diehl 8cebf8a10d needed 2019-10-12 15:50:10 +02:00
Martin Diehl 734e6ef15f writing initial coordinates to DADF5 2019-10-12 15:03:26 +02:00
Franz Roters e85e13b380 [skip ci] only corrections to comments made 2019-10-11 15:21:29 +02:00
Martin Diehl bf35589d66 DOI was pointint to the correction 2019-10-11 12:31:46 +02:00
Martin Diehl b502300ffc get labels of slip and twin systems
this info is for HDF5 output
2019-10-10 13:11:02 +02:00
Martin Diehl 1d51443607 polishing/unifying names 2019-10-10 12:26:45 +02:00
Martin Diehl 02d7ead3ab better readable 2019-10-10 12:10:13 +02:00
Martin Diehl cf0e279d93 labels were not used
better use automated labeling of all systems
2019-10-10 10:48:55 +02:00
Martin Diehl a2a05158f2 not existing anymore 2019-10-09 01:32:19 +02:00
Martin Diehl df3bb7c559 cleaning 2019-10-08 23:53:16 +02:00
Martin Diehl 90c03d94d1 further separation for clearer structure 2019-10-08 19:08:29 +02:00
Martin Diehl b647245e39 general polishing 2019-10-08 18:52:34 +02:00
Martin Diehl 7d438d3868 not needed 2019-10-08 17:37:30 +02:00
Martin Diehl 040cd3e35d no public variables 2019-10-08 17:26:02 +02:00
Martin Diehl 16fd608da6 more reasonable name 2019-10-08 17:12:53 +02:00
Martin Diehl 098f2903ea not used anymore 2019-10-08 17:04:27 +02:00
Martin Diehl 5e79c360e9 no need for double definition 2019-10-08 10:03:03 +02:00
Martin Diehl 04272f88d5 untangling
- avoid public variables
- openMP in initialization hardly useful
- structure of init should reflect tasks:
1) reading
2) discretization
3) nonlocal stuff
2019-10-08 09:30:32 +02:00
Martin Diehl 795939c989 tests for re-ordered systems + new PETSc 3.11 2019-10-07 20:23:17 +02:00
Martin Diehl 2d7293726c more useful order 2019-10-07 18:04:29 +02:00
Martin Diehl 7f403ad50e avoid global variables 2019-10-05 20:23:33 +02:00
Martin Diehl 18b8e71f69 polishing 2019-10-05 20:09:01 +02:00
Martin Diehl 1d35699884 ip volume is only needed by plastic nonlocal 2019-10-05 19:46:08 +02:00
Martin Diehl 076aa3f72b not needed 2019-10-05 17:37:14 +02:00
Martin Diehl 019f0556e6 better have explicit arguments 2019-10-05 17:18:21 +02:00
Martin Diehl 0b29d08109 bump to DADF5 v0.3
contains displacements (for grid solver)
2019-10-03 19:02:17 +02:00
Martin Diehl fd3f8e2cc7 fixed precision even if compiler flag is not set 2019-09-29 15:59:10 -07:00
Martin Diehl d47dff9dd8 typo 2019-09-29 14:18:21 -07:00
Martin Diehl ad75ebd973 polishing 2019-09-29 11:26:57 -07:00
Martin Diehl 56c0f30687 tried to send to much data 2019-09-29 10:34:55 -07:00
Martin Diehl 8e5fd7c5e8 nodal discplacements for MPI
needs improvement with respect to readability and placement of origin
2019-09-29 10:04:07 -07:00
Martin Diehl e04b074f3c easier to read 2019-09-28 18:32:17 -07:00
Martin Diehl c71374a3f3 do not write nodes shared over several processes
- probably useful only for grid solver, FEM have connectivity matrix
anyway
- name could be improved (in fact, the index is the last not-shared
node)
2019-09-28 18:08:15 -07:00
Martin Diehl 3206ee04bc nodal displacements for grid solver
currently for non-MPI only
2019-09-27 20:38:02 -07:00
Martin Diehl 5ba6b6c244 name reflects planned functionality:
should update node and cell center coordinates
2019-09-27 15:02:36 -07:00
Martin Diehl cc54139dae no need for being compatible 2019-09-27 14:54:02 -07:00
Martin Diehl fc6b603e3d names reflect functionality 2019-09-27 14:48:51 -07:00
Martin Diehl e311c913b8 avoid public variable without write protection 2019-09-27 14:44:28 -07:00
Martin Diehl 13c62b890b module name should reflect file name 2019-09-27 14:34:34 -07:00
Martin Diehl 032b65fe65 not needed 2019-09-27 14:33:56 -07:00
Martin Diehl 8fd9341e39 not needed 2019-09-27 14:23:19 -07:00
Martin Diehl 114f21e8f7 setter for current nodal coordinates 2019-09-27 14:07:34 -07:00
Martin Diehl 2bb6f74de9 use new data structure 2019-09-27 14:07:03 -07:00
Martin Diehl 2e63affe47 [skip ci] better to read 2019-09-25 12:48:16 -07:00
Martin Diehl 9ebd91312a avoid size(xxx) of unallocated xxx 2019-09-25 12:21:57 -07:00
Martin Diehl fc090a1960 [skip ci] indentation only 2019-09-25 12:05:37 -07:00
Martin Diehl 116f43f401 [skip ci] indentation hick-up 2019-09-23 22:15:13 -07:00
Martin Diehl ffcb7a0a24 aim of the calculation clearer
don't know if brackets are honored here
2019-09-23 09:31:14 -07:00
Martin Diehl da041f43bc floating point arithmetic refinement
Intel 18.4 could not detect 0.0
2019-09-23 09:29:38 -07:00
Martin Diehl 96811f77ca not used 2019-09-23 06:50:25 -07:00
Martin Diehl 0620eae797 less code 2019-09-23 06:48:39 -07:00
Martin Diehl 611cc9bcae preprocessor does not allow spaces 2019-09-23 06:48:20 -07:00
Martin Diehl 48e0a7ad97 no floating point comparison for equality 2019-09-23 06:35:02 -07:00
Martin Diehl b8204015f5 wrong type (math_range returns integers) 2019-09-23 06:29:32 -07:00
Martin Diehl 02fef16b38 used only by MARC/Abaqus 2019-09-23 06:28:10 -07:00
Martin Diehl 78344c01ac avoid floating point comparison 2019-09-23 05:37:36 -07:00
Martin Diehl da15ff85f3 tests now operational 2019-09-23 00:11:45 -07:00
Martin Diehl 285dab4451 self consistent solutions 2019-09-22 23:53:56 -07:00
Martin Diehl bbb2441cc2 preparing more tests 2019-09-22 22:08:19 -07:00
Martin Diehl 0655ef2c90 small precision adjustments required
one in a Mio might have degenerated precision...
Also now finally testing core functionality
2019-09-22 21:58:18 -07:00
Martin Diehl c1398e5fa4 more robust agains overflow + tests 2019-09-22 21:41:00 -07:00
Martin Diehl 40099fd581 typo 2019-09-22 17:46:37 -07:00
Martin Diehl 9fd65b0617 need to relax tolerance for case 3 2019-09-22 16:57:16 -07:00
Martin Diehl d1566aa5bf GNU 8 has issues with IEEE_infinite
errors occur when running aggressively optimized code. GNU 9.1 seems to
be ok
2019-09-22 16:05:41 -07:00
Martin Diehl c0210659b6 statUnit was not opened, stat file was written to STDERR 2019-09-22 15:56:37 -07:00
Martin Diehl 26bdcd64b9 this might resolve the occasional MPI restart test failuers 2019-09-22 15:34:05 -07:00
Martin Diehl 4ff292ba70 IEEE infinite causes problems with older GNU 2019-09-22 14:46:27 -07:00
Martin Diehl 171a93ca30 also small negative values cause problems
Logic differs from the original formulation now
2019-09-22 14:17:17 -07:00
Martin Diehl 6b5b0fae22 mixed up real and aimag part in quaternion
+ some tests
2019-09-22 12:10:39 -07:00
Martin Diehl 25c9bb1cd7 testing some corner cases 2019-09-22 11:29:34 -07:00
Martin Diehl 62174a8978 testing all conversions
using norm(Delta q) ensures that the quality of the conversion is
tested, not the numerical properties of any orientation representation.
2019-09-22 11:15:27 -07:00
Martin Diehl 6e5b9ca665 unused variables 2019-09-22 08:54:59 -07:00
Martin Diehl 77011a5dba this fix restores the previous behavior of dislotwin
very strange behavior in plasticity_detect changes for dislotwin. This
fix restores the old behavior with respect to number of iterations.
Using orientation%fromMatrix() results in much more iterations and an
increase in runtime for the test from approx 6 min to 40 min. Results
still match in the end. Also, crystallite_Fp0 differs by approx 1e-15
only between the two methods.
I assume that something is wrong with either dislotwin or the
state/stress integration
2019-09-22 07:46:30 -07:00
Martin Diehl de632ec85c better names 2019-09-22 07:22:24 -07:00
Martin Diehl 372536d57e unit test for rotation class 2019-09-22 06:53:03 -07:00
Martin Diehl 5fa1ecb170 determinant calculations give slightly different results 2019-09-22 06:41:55 -07:00
Martin Diehl 30afaf2a95 bugfic: Blocksize parameter was too small 2019-09-21 23:45:54 -07:00
Martin Diehl 51bd67fa29 findloc is in gfortran 9.1 2019-09-21 23:03:53 -07:00
Martin Diehl 25d91c79af larger block size seems favorable 2019-09-21 23:03:27 -07:00
Martin Diehl 8b908fb350 some more testing 2019-09-21 21:25:55 -07:00
Martin Diehl a963f1d2c3 better explicit 2019-09-21 09:16:58 -07:00
Martin Diehl f5caee8026 issue now clearer 2019-09-21 08:23:56 -07:00
Martin Diehl 7ef4aca170 vectorized
there seems to be a conflict in the definition of the projection for
edge and screw.
Nonlocal uses the transpose compared to dislotwin/disloUCLA.
2019-09-21 08:21:39 -07:00
Martin Diehl 8013dec45f safer 2019-09-21 07:14:45 -07:00
Martin Diehl 7837a6dc01 not used ...
... and equivalentStress33 seemed wrong
... and equivalentStrain33 was confusing
2019-09-20 18:45:54 -07:00
Martin Diehl a17046cfdf full merger 2019-09-20 18:44:23 -07:00
Martin Diehl a16af9a7ad single source of truth 2019-09-20 18:33:12 -07:00
Martin Diehl 97127f9034 following standard: Output first 2019-09-20 18:28:46 -07:00
Martin Diehl 53283d5c01 using newer interface 2019-09-20 18:20:33 -07:00
Martin Diehl 09c1150e3c more error checking 2019-09-20 18:16:08 -07:00
Martin Diehl c1d1c83088 better check input data 2019-09-20 17:49:55 -07:00
Martin Diehl a8b72c3f53 even better to read 2019-09-20 17:42:55 -07:00
Martin Diehl 7fe3e3b406 easier to read 2019-09-20 17:38:57 -07:00
Martin Diehl 44125f3f09 convenience function for symmetric 4th order tensors
unfortunately, array size does not qualify to distinguish generics
2019-09-20 17:36:37 -07:00
Martin Diehl ad83c8541d same names as in python 2019-09-20 17:18:09 -07:00
Martin Diehl 7e6265b128 make use of consistency checks 2019-09-20 16:52:55 -07:00
Martin Diehl ef4204da14 Merge branch 'MiscImprovements' of magit1.mpie.de:/damask/DAMASK into MiscImprovements 2019-09-20 16:48:50 -07:00
Martin Diehl 6c0e92d5c1 functionality to rotate 4-tensor 2019-09-20 16:47:44 -07:00
Martin Diehl 4dfb1f6450 next try for MARC 2019 2019-09-21 01:07:04 +02:00
Martin Diehl 93c8aa8f75 bugfix: used uninitialized vector 2019-09-21 00:08:14 +02:00
Martin Diehl 7ff106a1fc better readable 2019-09-20 08:45:23 -07:00
Martin Diehl d69d57221d consistent type handling and stronger encapsulation
components of quaternion are private now
qu is an array, not a quaterion (as in the python module). conceptually
cleaner because eu,ax,om, etc. are also plain array
2019-09-20 08:36:16 -07:00
Martin Diehl 0b6620bfb7 Merge branch 'development' into MiscImprovements
F***ing commits to development!
2019-09-20 07:40:52 -07:00
Martin Diehl 42fba28fa1 getting rid of conversions with unclear behavior 2019-09-20 07:37:58 -07:00
Martin Diehl 76eaa9855f correct type (pReal) 2019-09-20 06:57:39 -07:00
Martin Diehl 47fe5b9c15 Merge branch 'MiscImprovements' of magit1.mpie.de:/damask/DAMASK into MiscImprovements 2019-09-20 06:54:23 -07:00
Martin Diehl 052ee10fcb sanity checks as in python class 2019-09-20 06:53:49 -07:00
Martin Diehl e8ed25d361 messages were not used anymore 2019-09-20 06:40:21 -07:00
Martin Diehl 23dba41a09 absolutely not needed
the solvers report when they are initialized
2019-09-20 05:41:12 -07:00
Martin Diehl c75609f8f0 Marc 2019 does not work with HDF5
Seems that Marc 2019 brings its own HDF5. Basically good news, but
should be resolved in a separate branch
2019-09-20 14:23:06 +02:00
Philip Eisenlohr 31f39fac82 [skip ci] fixed confusion about n in Li tangent: prm%n was meant but forall index n was used! 2019-09-20 08:05:15 -04:00
Martin Diehl 27732b1c0d better use rotation class functionality 2019-09-19 23:32:19 -07:00
Martin Diehl a70779965c some helper functions for further transition 2019-09-19 22:50:30 -07:00
Martin Diehl 01561a2bae polishing 2019-09-19 22:07:02 -07:00
Martin Diehl d11f401c67 removed unused variables and correct type casting
I don't believe that n is correct here ...
2019-09-19 19:53:00 -07:00
Martin Diehl 792dda866d rotation class has consistent set of conversions
crytallite_oriention0 was essentially a copy of material_EulerAngles
2019-09-19 19:42:28 -07:00
Martin Diehl a94c104c75 using texture class 2019-09-19 19:14:37 -07:00
Martin Diehl 5d0a67e5dc texture class replaces manual conversions 2019-09-19 18:25:51 -07:00
Martin Diehl e48059d6f1 correct name 2019-09-19 16:56:43 -07:00
Martin Diehl 08d2cdcb25 forall is deprecated in Fortran 2018 2019-09-19 14:24:13 -07:00
Martin Diehl b41d6182a5 safe use of optional argument 2019-09-19 14:20:02 -07:00
Martin Diehl f6c616c84b consistent orientation/quaternion handling is in own submodule 2019-09-19 13:59:18 -07:00
Martin Diehl 7fa979f800 removed unused function
were based on/used for deprecated orientation handling
2019-09-19 13:51:37 -07:00
Martin Diehl be0d961954 cleaning 2019-09-19 13:40:03 -07:00
Martin Diehl e82fdbcdfa use more appropriate name 2019-09-19 13:39:22 -07:00
Martin Diehl ddff2cb6e7 newer versions of PGI provide norm2
https://www.pgroup.com/resources/docs/19.7/x86/pgi-release-notes/index.htm#what-is-new-197
2019-09-19 13:38:45 -07:00
Martin Diehl f1d29da056 does not work anymore
dump functions were removed from IO, migrate to HDF5 if needed
2019-09-19 13:07:18 -07:00
Martin Diehl 5ab8f55f21 [skip ci] fixed indentation 2019-09-19 12:58:51 -07:00
Martin Diehl d0579bb674 data layout and names as discussed with Karo and Philip 2019-09-19 12:48:04 -07:00
Martin Diehl 5f1934bacb adopting indentation 2019-09-19 11:40:59 -07:00
Martin Diehl 34e0dd1c64 polishing 2019-09-19 11:00:41 -07:00
Franz Roters 2aaa5ff8e7 Merge branch 'Dislotwin-climb2' into 'development'
Dislotwin climb2

See merge request damask/DAMASK!94
2019-09-19 11:19:05 +02:00
Franz Roters d6e93367eb [skip ci] clarified comment 2019-09-19 11:17:23 +02:00
Philip Eisenlohr b06c5bd686 Merge branch 'even-more-HDF5-postprocessing' into development 2019-09-18 21:14:19 -04:00
Franz Roters 036794e7d3 support for Marc2019 2019-09-17 15:53:49 +02:00
Martin Diehl 462bb07efd Merge branch 'development' into even-more-HDF5-postprocessing 2019-09-11 16:29:44 -07:00
Martin Diehl 15e796d599 Merge branch 'development' into Dislotwin-climb2 2019-09-11 12:06:29 -07:00
Eureka Pai Kulyadi ca760f9ca1 added text lines 2019-09-06 15:47:02 -04:00
Eureka Pai Kulyadi cf37f8d405 added some lines to help while debugging 2019-09-06 15:45:49 -04:00
Eureka Pai Kulyadi 836172028d modified plastic_isotropic_LiAndItsTangent to behave correctly 2019-09-06 15:44:38 -04:00
Vitesh Shah fbf82fbca8 Referencing 2019-09-05 09:42:45 +02:00
Martin Diehl 7ce098c75c small polishing 2019-09-04 14:52:44 -07:00
Martin Diehl 2fc66cff5b better readable 2019-09-04 14:30:26 -07:00
Martin Diehl dba49fe387 parameter was not read
thanks to Vitesh for reporting
2019-09-04 07:18:41 -07:00
Vitesh Shah be5e68249f Conflicts resolved 2019-08-20 14:29:11 +02:00
Vitesh Shah b854e7ee08 Decision based on possibility of partials 2019-08-20 13:54:51 +02:00
Vitesh Shah c71b060c48 Improved syntax for binary switches 2019-08-20 10:56:36 +02:00
Martin Diehl d2affaa414 clearer logic 2019-08-16 14:10:12 -07:00
Martin Diehl 38755cb30d polishing 2019-08-16 13:56:52 -07:00
Vitesh Shah 50b372d9f1 ClimbSwitch introduced 2019-08-16 15:57:11 +02:00
Vitesh Shah 5dfd13b759 documenting new variables 2019-08-16 15:07:19 +02:00
Vitesh Shah 5a72f513c7 SFE not equal to zero 2019-08-15 13:56:59 +02:00
Vitesh Shah 310d262e9f nearest neighbour number is 12 for fcc 2019-08-15 13:55:12 +02:00
Vitesh Shah 860ef2f256 Corrected the calculation of sigma_cl 2019-08-01 15:29:32 +02:00
Vitesh Shah d40e4a3800 SFE at 0K can be negative as well 2019-07-30 10:53:19 +02:00
Vitesh Shah f786fcd5f1 Better name for climb stress 2019-07-27 11:07:36 +02:00
Martin Diehl 7ccc097406 for testing output of materialpoint results 2019-07-15 17:08:18 -07:00
Martin Diehl fa6e88970c avoid empty entries 2019-07-15 13:53:34 -07:00
Martin Diehl eeb5f45e88 adopted from Viteshs branch 2019-07-05 22:55:08 -07:00
Martin Diehl 4340c558d7 named as in DAMASK paper 2019-07-05 22:26:51 -07:00
Martin Diehl 5ff4664b6d polishing 2019-06-30 22:09:51 -07:00
Martin Diehl 619c67cc19 fixed array access 2019-06-30 01:29:36 +02:00
Martin Diehl 7ad343c9b6 polishing 2019-06-29 15:06:47 -07:00
Martin Diehl a04be84719 avoid uninitialized array 2019-06-29 10:26:29 -07:00
Martin Diehl bf8ac403f1 polishing, Part II 2019-06-29 10:15:17 -07:00
Martin Diehl c6c1d2ab8d polishing 2019-06-29 10:01:18 -07:00
Martin Diehl 4b10522bee catch user inputs that result in division by zero 2019-06-28 17:52:38 -07:00
Martin Diehl a88baf93b2 avoid division (mod) by zero 2019-06-28 17:09:27 -07:00
Martin Diehl 1d2a7d0917 fixed copy and paste errors 2019-06-28 16:51:03 -07:00
Martin Diehl b7ac91480a safe for DEBUG=ON and N_tr=N_tw=0 2019-06-28 16:35:31 -07:00
Martin Diehl 02744406e8 was not used 2019-06-16 02:11:09 +02:00
Martin Diehl 860a6d5d49 copy and paste error 2019-06-15 22:37:31 +02:00
Martin Diehl 43a17a17a2 clearer logic, no outdated comments 2019-06-15 20:49:48 +02:00
Martin Diehl e30478127d cleaned 2019-06-15 20:42:16 +02:00
Martin Diehl 2c4f1eb173 adjusting indentation 2019-06-15 20:37:53 +02:00
Martin Diehl 6370dd1a43 white space adjustments 2019-06-15 18:27:38 +02:00
Martin Diehl f54a6cdc3b white space adjustments 2019-06-15 16:42:16 +02:00
Martin Diehl 4256f67919 polishing 2019-06-15 16:21:37 +02:00
Martin Diehl 25d02c2f19 most of the functionality is only relevant for commercial FEM 2019-06-15 16:21:04 +02:00
Martin Diehl 0c52262e4a white space adjustments 2019-06-15 15:44:15 +02:00
Martin Diehl 9f35267470 not needed 2019-06-15 15:43:43 +02:00
Martin Diehl 85e6885ea7 white space adjustments 2019-06-15 15:41:37 +02:00
Martin Diehl 3de3ebdd43 documentation was missing 2019-06-15 15:40:43 +02:00
Martin Diehl 82bb887cdf white space adjustments 2019-06-15 15:40:22 +02:00
Martin Diehl 856ef15184 moved (back) to a better place 2019-06-15 15:37:13 +02:00
Martin Diehl 57a0d33293 consistent names 2019-06-15 14:33:20 +02:00
Martin Diehl 8c5d0a5591 populateGrains and material_phase not needed 2019-06-15 14:10:45 +02:00
Martin Diehl 937a84231f material_phase is deprecated 2019-06-15 13:57:24 +02:00
Martin Diehl 72298205a7 Merge branch 'MiscImprovements' of magit1.mpie.de:/damask/DAMASK into MiscImprovements 2019-06-14 17:24:44 +02:00
Martin Diehl b720d2b2d7 all keys are small letters 2019-06-14 17:24:26 +02:00
Martin Diehl 84b60259bf apparently not needed 2019-06-14 10:08:04 +02:00
Martin Diehl 3f87a87a4e wrong counting
currently quite ugly, but planned changes for state structure will give
overcome this
2019-06-14 10:05:39 +02:00
Martin Diehl 083fdb13b4 material_phaseAt and material_phaseMemberAt substitute material_phase 2019-06-14 09:37:01 +02:00
Martin Diehl 59cb70198e phasememberAt not needed anymore 2019-06-14 09:17:05 +02:00
Martin Diehl 9c4f92a01c substitute phasememberAt with material_phaseMemberAt
need to be clear where a global variable is defined
2019-06-14 09:09:16 +02:00
Martin Diehl 7a878cab3a phaseAt(c,i,e) substituted by material_phaseAt(c,e) 2019-06-14 09:02:28 +02:00
Martin Diehl 7a76740c31 using new names 2019-06-14 08:51:23 +02:00
Martin Diehl 0f531d5dee clearer name 2019-06-14 08:42:12 +02:00
Martin Diehl 84c69e0f6e output names follow variable names 2019-06-13 23:23:11 +02:00
Martin Diehl 47e0d83562 taking care of compiler hints 2019-06-13 22:24:51 +02:00
Martin Diehl 47df2b581e does not exist anymore 2019-06-13 19:09:49 +02:00
Martin Diehl 4651bfdb90 [skip ci] clearer logic 2019-06-13 09:59:37 +02:00
Martin Diehl c7513b010b use definition from element 2019-06-13 09:13:03 +02:00
Martin Diehl 17761c1864 better use function arguments 2019-06-13 07:38:19 +02:00
Martin Diehl 42beb5c227 same label everywhere 2019-06-13 07:25:26 +02:00
Martin Diehl 78d604df7d cleaning 2019-06-13 07:06:01 +02:00
Martin Diehl e117ffbc0c cleaning 2019-06-13 00:39:35 +02:00
Martin Diehl 2d52560b6d unused 2019-06-13 00:05:29 +02:00
Martin Diehl ee8678d606 better readable 2019-06-13 00:01:38 +02:00
Martin Diehl b49feea5e9 polishing 2019-06-12 23:31:46 +02:00
Martin Diehl b1d06eced2 not used 2019-06-12 21:13:21 +02:00
Martin Diehl 0a5dc6d503 HDF5 is not always available 2019-06-12 19:59:17 +02:00
Martin Diehl 8564aa51d1 was missing 2019-06-12 19:57:48 +02:00
Martin Diehl 9a9e99739e Merge branch 'marc-mesh-simplification' of magit1.mpie.de:/damask/DAMASK into marc-mesh-simplification 2019-06-12 19:56:57 +02:00
Martin Diehl ac493adc5c commenting and discussing with Franz 2019-06-12 19:11:29 +02:00
Martin Diehl ecda57e29a using rotation class (where possible)
differences between backward rotation need to be investigated
2019-06-12 15:58:21 +02:00
Martin Diehl 648f899838 clearer (and possibly faster) logic 2019-06-12 15:58:21 +02:00
Martin Diehl 1b595b4864 initialize from Eulers (common case) 2019-06-12 15:58:21 +02:00
Martin Diehl 04a6054047 no need to transfer data via global variables 2019-06-12 15:58:21 +02:00
Martin Diehl a6c0f500ff simplifying 2019-06-12 15:58:21 +02:00
Martin Diehl ab4026e707 pInt not needed 2019-06-11 16:34:07 +02:00
Martin Diehl 9379d1884e further cleaning 2019-06-11 16:16:10 +02:00
Martin Diehl ceecea418e no frills 2019-06-11 15:36:04 +02:00
Martin Diehl 8956f7f6da pInt not needed 2019-06-11 14:52:27 +02:00
Martin Diehl 82ab1f5e10 sorted for better readability 2019-06-11 14:29:10 +02:00
Martin Diehl f2be94ed5f function better suited for single return value
use correct shapes (1D list) for return value
2019-06-11 14:15:10 +02:00
Martin Diehl b2409d6998 cleaning 2019-06-11 13:34:55 +02:00
Martin Diehl 9dfe71aa06 better readable 2019-06-10 09:42:23 +02:00
Martin Diehl c8f3808dab pInt not needed 2019-06-09 16:30:30 +02:00
Martin Diehl f6379e1f0e cleaning 2019-06-09 16:27:05 +02:00
Martin Diehl 676c772a98 many variables do not need to be public anymore 2019-06-08 12:02:52 +02:00
Martin Diehl 54cc3786f5 currently not used
needs extension to MPI situations to calculate displacement for HDF5 out
2019-06-08 11:16:47 +02:00
Martin Diehl d6d5f4e66f polishing 2019-06-08 11:15:01 +02:00
Martin Diehl aeb57b2fb6 better readable 2019-06-08 10:38:10 +02:00
Martin Diehl cb3ce1edd3 removing leftovers from populate grains 2019-06-07 13:39:40 +02:00
Martin Diehl deda700be1 simplified 2019-06-07 12:21:12 +02:00
Martin Diehl 86a720be8c ensure memory release 2019-06-07 12:19:36 +02:00
Martin Diehl ca97c3db18 connectivity is not needed 2019-06-07 10:34:02 +02:00
Martin Diehl 33ed1fa06c further removal of mesh quantities 2019-06-07 10:33:49 +02:00
Martin Diehl f22fcc7271 further removal of mesh 2019-06-07 10:20:56 +02:00
Martin Diehl 52f036e062 fixed outdated comment 2019-06-07 08:19:24 +02:00
Martin Diehl 4025951dc1 missing use caused compilation error 2019-06-07 08:17:26 +02:00
Martin Diehl b77ce718cf mesh_element/theMesh deprecated 2019-06-07 07:49:45 +02:00
Martin Diehl c7703d7aaf preprocessor statements need to start at column 0 2019-06-07 07:45:54 +02:00
Martin Diehl 042ff7e491 microstructure is only a property of the discretization
will be used only by material.f90 once crystallite is removed
2019-06-07 07:44:34 +02:00
Martin Diehl ab06fac379 line too long 2019-06-07 07:41:12 +02:00
Martin Diehl 1e368012b5 now providing all quantities required by plastic_nonlocal 2019-06-07 07:38:48 +02:00
Martin Diehl 2a35a78d93 phase out mesh_elem and theMesh 2019-06-07 07:38:48 +02:00
Martin Diehl d07cdf85de initialize correctly 2019-06-07 06:07:00 +02:00
Martin Diehl 9aeb1a9da1 PETSc-FEM solver needs to initialize discretization module 2019-06-07 00:20:35 +02:00
Martin Diehl 57547b5aa6 cleaned 2019-06-07 00:04:20 +02:00
Martin Diehl 87bc95e6fb IPvolume is only needed for nonlocal 2019-06-06 23:17:02 +02:00
Martin Diehl 9ab6147de8 bugfix: wrong number of IPs 2019-06-06 23:00:40 +02:00
Martin Diehl cfc1dcf04b mesh_elem and theMesh are deprecated 2019-06-06 22:49:17 +02:00
Martin Diehl 0720da29fb mesh_element is deprecated 2019-06-06 21:14:37 +02:00
Martin Diehl f0adcc665c discretization contains now all information to substitute mesh
only plastic_nonlocal needs extra information
2019-06-06 20:54:19 +02:00
Martin Diehl 14da4f8e43 easier to store positions than displacement 2019-06-06 18:28:10 +02:00
Martin Diehl e4c1102bdb names consistent with marc connectivity 2019-06-06 14:05:04 +02:00
Martin Diehl a4cce1bf61 new module "discretization"
should replace the part of mesh that is not only needed by
plastic_nonlocal
2019-06-06 13:59:16 +02:00
Martin Diehl 00189554cd correct style 2019-06-06 13:22:46 +02:00
Martin Diehl c0964dfd88 disable coordinate update for the moment 2019-06-06 13:13:22 +02:00
Martin Diehl 73d41ffaf7 less global variables 2019-06-06 13:08:10 +02:00
Martin Diehl 9e8bc7d9b1 better names 2019-06-06 11:08:58 +02:00
Martin Diehl eb8c41b3b5 cleaning 2019-06-06 10:43:08 +02:00
Martin Diehl 2f40f7a727 separating 2019-06-06 08:34:01 +02:00
Martin Diehl b127dcf44e separating mesh and nonlocal related geometry 2019-06-06 08:19:29 +02:00
Martin Diehl a3304db1ce no clutter 2019-06-06 08:16:36 +02:00
Martin Diehl 402502d6cd prepare cleaning 2019-06-06 08:16:07 +02:00
Martin Diehl 6a8cea90d5 simpler way to calculate IP neighborhood 2019-06-06 07:37:37 +02:00
Martin Diehl d13d6549af polishing 2019-06-05 20:29:14 +02:00
Martin Diehl 4b6ff59e49 make public variables visible 2019-06-05 20:18:19 +02:00
Martin Diehl 3990284b63 sorting face definitions of each cell 2019-06-05 18:57:03 +02:00
Martin Diehl df7d8b1043 not needed 2019-06-05 18:57:03 +02:00
Martin Diehl efac905fb2 less module wide variables 2019-06-05 18:57:03 +02:00
Martin Diehl 9b37c62e15 mesh_element is deprecated (meaningless name) 2019-06-05 10:05:59 +02:00
Martin Diehl 64ae894e5e leaner code 2019-06-05 10:02:55 +02:00
Martin Diehl 4b57722446 initial ideas for simplification of IP neighborhood determination
much easier for one type of element
2019-06-05 08:22:34 +02:00
Martin Diehl 3c46296941 cleaning 2019-06-05 00:36:25 +02:00
Martin Diehl 6bd380bcfd using (partly) the cell new cell node definition 2019-06-04 22:02:54 +02:00
Martin Diehl d0602513ac write out and calculate cell and element connectivity 2019-06-04 21:30:51 +02:00
Martin Diehl 04ee252be7 Merge branch 'development' into marc-mesh-simplification 2019-06-04 20:29:01 +02:00
Martin Diehl 96cb2a8fb8 mesh needs HDF5+results for connectivity 2019-06-04 20:22:53 +02:00
Martin Diehl f51599eda7 easier to read 2019-06-04 19:13:01 +02:00
Martin Diehl 7bfc25ba23 Merge branch 'development' into marc-mesh-simplification 2019-06-04 18:59:17 +02:00
Martin Diehl 951134d13f not needed 2019-06-04 12:06:16 +02:00
Martin Diehl d4392dc1bd one implicit none is enough 2019-05-30 23:58:59 +02:00
Martin Diehl ce9d6a5077 Merge branch 'development' into grid-mesh-cleanup 2019-05-30 23:52:37 +02:00
Martin Diehl 305c72584f Merge branch 'development' into test_PETSc_pointer 2019-05-30 17:31:51 +02:00
Martin Diehl 358272eb2e not needed, better readable without 2019-05-28 12:29:46 +02:00
Martin Diehl a5c6e4b17c do not clutter the code with use statements 2019-05-28 12:06:21 +02:00
Martin Diehl 0db4264265 cleaning 2019-05-28 09:28:15 +02:00
Martin Diehl 6283ffa024 Merge branch 'development' into cleaning-pInt-use 2019-05-28 09:19:43 +02:00
Martin Diehl b35465b591 gamma_slip_ID should be used to write result 2019-05-20 19:08:56 +02:00
Martin Diehl 2d366f8aca no clue where or when this was used 2019-05-18 23:20:22 +02:00
Martin Diehl 2ccfc9f6da simpler to use variables directly 2019-05-18 23:10:40 +02:00
Martin Diehl 93827b8809 not needed 2019-05-18 23:03:02 +02:00
Martin Diehl c4f07a9ad9 need to correct tensor order 2019-05-18 22:03:59 +02:00
Martin Diehl 1de0c7e652 wrong name 2019-05-18 22:03:59 +02:00
Martin Diehl 60c2a5fc06 loop (forall) over integration points wrong
this was done for each integration point, but this was not detected for
the forall loop
2019-05-18 22:03:59 +02:00
Martin Diehl 86205f5081 gfortran complaints about repeated dimension attribute
we need to decide whether we want to repeat the declaration of the
interface or not
2019-05-18 09:54:16 +02:00
Martin Diehl 34bcd38240 cleanup 2019-05-18 07:43:41 +02:00
Martin Diehl 2258bfb221 RGC as submodule
submodules inherit use-associated entities and implicit none/private
statements
2019-05-18 07:23:46 +02:00
Martin Diehl ed8af98d69 don't clutter with use statements 2019-05-18 06:54:45 +02:00
Martin Diehl 3db32102a3 algorithm to split elements into cells
- finds all shared nodes
- needs polishing
2019-05-17 13:22:52 +02:00
Martin Diehl c6b5d45944 cleaning 2019-05-17 12:43:42 +02:00
Martin Diehl 7ac0013271 more consistent private/public declarations 2019-05-17 05:24:36 +00:00
Martin Diehl 7b620e3ce9 [skip ci] consistent with rest of the module 2019-05-17 06:49:25 +02:00
Martin Diehl dce4775c17 removal of RGC out led to undefined variable 2019-05-17 06:36:30 +02:00
Martin Diehl 3df9a8d58c focus on the physics 2019-05-16 23:14:47 +02:00
Martin Diehl 01e3b646c2 don't clutter the code with useless stuff
we only need to be more strict about prefixing
functions/subroutines/variables to see in which module they reside
2019-05-16 22:56:48 +02:00
Martin Diehl 028bdcff22 less compiler complaints 2019-05-16 22:24:42 +02:00
Martin Diehl 6df563624d type needed for postResults 2019-05-16 21:57:20 +02:00
Martin Diehl f8b335a3a4 loop (forall) over integration points wrong
this was done for each integration point, but this was not detected for
the forall loop
2019-05-16 18:24:54 +02:00
Martin Diehl 39a75c2015 phasing out postResults
starting with RGC because it is rarely used and removing it here allows
to go ahead with the submodule structure for homogenization
2019-05-16 10:23:23 +02:00
Martin Diehl 789420c9d6 Merge branch 'no-pInt-implicitNone' into 'development'
No pInt and implicit none

See merge request damask/DAMASK!81
2019-05-15 21:40:13 +02:00
Franz Roters d29967d8b2 Merge remote-tracking branch 'remotes/origin/improve-Lp-guessing' into development 2019-05-15 08:10:46 +02:00
Martin Diehl 346c7c4a7f one implicit none is enough 2019-05-14 23:12:32 +02:00
Martin Diehl 51e19048f7 pInt not needed anymore 2019-05-14 22:52:33 +02:00
Philip Eisenlohr 9249b7f4af improved column alignment of indices such as (g,i,e) 2019-05-14 19:52:48 +02:00
Philip Eisenlohr f3d8b960fd included Li in list of protected quantities for fake cutback 2019-05-14 19:46:25 +02:00
Martin Diehl 0dbc6fb435 usage example 2019-05-14 11:52:28 +02:00
Martin Diehl 4bce087d3d separating functionality (stub only)
- mesh (initialization depends on type of solver) only provides
information about number of elements, IPs and writes out displacements
- new module (will get setter functions for solver specific
initialization) will provide information that is only used by the
nonlocal model
2019-05-14 11:42:00 +02:00
Martin Diehl 3be5c6a5bc Merge remote-tracking branch 'origin/development' into grid-mesh-cleanup 2019-05-14 11:13:09 +02:00
Martin Diehl a8b9b5d1c9 homogenizationAt array had wrong shape for MPI (too large) 2019-05-14 08:11:23 +02:00
Vitesh 387c45d0f4 Merge branch 'MiscImprovements' into 'development'
Misc improvements

See merge request damask/DAMASK!79
2019-05-14 07:32:57 +02:00
Martin Diehl 8dea95879c specific for nonlocal, can be calculated during post processing 2019-05-14 07:22:29 +02:00
Martin Diehl c9f1f8756d better name/not needed 2019-05-14 06:06:01 +02:00
Martin Diehl cac472c506 cleaning
more complex initialization will be used by FEM solvers only
2019-05-14 00:13:43 +02:00
Martin Diehl c8794af3bb better readable 2019-05-13 23:18:02 +02:00
Martin Diehl fb49acdb97 more explicit 2019-05-13 22:54:18 +02:00
Martin Diehl 4c148f1a07 not needed 2019-05-13 22:15:29 +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
Franz Roters 89dbe1ad03 [skip ci] mismatch tensor is dimensionless 2019-05-13 17:33:45 +02:00
Martin Diehl df01a3ff36 only for internal use 2019-05-13 00:00:14 +02:00
Martin Diehl 344e6ca51a IP volume is trivial for spectral solver 2019-05-12 23:56:44 +02:00
Martin Diehl 6e96a57781 write all outputs to HDF5
not 100% sure about the units
2019-05-12 15:14:29 +02:00
Martin Diehl 7d5f5afe01 further cleaning 2019-05-12 13:11:30 +02:00
Martin Diehl f0f8be7840 not used 2019-05-12 10:05:40 +02:00
Martin Diehl 8286a289df try to directly allocate pointers 2019-05-12 09:52:56 +02:00
Martin Diehl 7f0008c4a3 not used at the moment 2019-05-12 09:37:59 +02:00
Martin Diehl b3f429165d use cascaded use statements 2019-05-11 12:10:23 +02:00
Martin Diehl d76a360fa7 use cascaded include (math provides prec) 2019-05-11 11:58:54 +02:00
Martin Diehl 436dae8dd5 cleaning 2019-05-11 11:52:05 +02:00
Martin Diehl 90440b50b7 prec provides IEEE module 2019-05-11 11:19:06 +02:00
Martin Diehl 93ded62e32 better readable 2019-05-10 16:38:47 +02:00
Martin Diehl 6e98dd83fb was accicently removed 2019-05-10 16:00:53 +02:00
Martin Diehl 70b7cbea7c does not exist anymore 2019-05-10 15:47:27 +02:00
Martin Diehl b8c8c4ade6 follow numpy naming convention 2019-05-10 15:19:00 +02:00
Martin Diehl 1cf6cc217d one implicit none is enough 2019-05-10 15:12:40 +02:00
Martin Diehl 811fc5c30c don't put implementation details in function name 2019-05-10 15:03:54 +02:00
Martin Diehl c81a90350c not needed anymore 2019-05-10 15:00:48 +02:00
Martin Diehl dc57f6aba0 better use transpose 2019-05-10 14:53:22 +02:00
Martin Diehl e25b4d6f17 math for quaterion / orientation have own classes 2019-05-10 14:52:01 +02:00
Martin Diehl ecb520e6f0 Merge branch 'development' into improve-Lp-guessing 2019-05-10 08:12:58 +02:00
Martin Diehl f3a02a8e6b simplified 2019-05-09 08:33:12 +02:00
Martin Diehl 72110d509c one implicit none is enough 2019-05-09 08:30:03 +02:00
Martin Diehl 23cf134d6c cleaning 2 2019-05-08 22:41:09 +02:00
Martin Diehl c191336045 cleaning 2019-05-08 22:26:14 +02:00
Martin Diehl 6c02d71019 Merge branch 'development' into MiscImprovements 2019-05-08 22:19:12 +02:00
Vitesh Shah 9b698cbdf5 correct description of subroutines 2019-05-08 17:56:20 +02:00
Vitesh Shah 1060b13c1f Corrected the comment 2019-05-08 16:50:46 +02:00
Martin Diehl 77856159f0 Merge branch 'development' into No-Populate-Grains-3 2019-05-07 19:59:40 +02:00
Martin Diehl f3c77cde87 Merge branch 'development' into MiscImprovements 2019-05-06 16:16:39 +02:00
Martin Diehl 39cc9e35ae Merge branch 'development' into orientation_with_averaging 2019-05-05 22:12:09 +02:00
Martin Diehl f873d84e5c enable HDF5 out for non-MPI 2019-05-05 15:40:27 +02:00
Martin Diehl 4a0584fe25 commercial FEM solvers write results to HDF5 2019-05-05 12:06:55 +02:00
Martin Diehl 11eb5a62b8 removed complex population of grains
- more explicit material.config
- simulation results do not depend on random number/compiler
- more suitable for phase field simulations with changing constituents
2019-05-04 22:07:10 +02:00
Martin Diehl 8c1f8fbef9 cleaning 2019-05-04 19:26:53 +02:00
Martin Diehl d5f80c7f6d Merge branch 'development' into MiscImprovements 2019-05-04 18:16:09 +02:00
Martin Diehl 21a36b5a7d errors better visible 2019-05-04 17:47:52 +02:00
Martin Diehl 464a2e217e not needed 2019-05-04 17:18:05 +02:00
Martin Diehl bf4c5741b9 cleaning 2019-05-04 14:41:00 +02:00
Martin Diehl ebf01dee4f store grid/size at geometry group
as outlined in the DAMASK results paper
2019-05-03 06:46:22 +02:00
Martin Diehl a881205561 CLI options not used to control PETSc 2019-05-03 06:21:43 +02:00
Martin Diehl 434813e6e5 use unique IDs among all models 2019-04-30 23:06:16 +02:00
Martin Diehl 2f27c64c39 homogenization output active 2019-04-30 23:05:21 +02:00
Martin Diehl badfba8c6f simplify includes
following python suggestions to include only once at the top of a module
2019-04-30 22:53:32 +02:00
Martin Diehl eb7db3acbd trying to use variables as in the DAMASK paper 2019-04-30 22:47:49 +02:00
Martin Diehl 8a9baf6d78 preparing output of mech_homog to HDF5 2019-04-30 18:45:38 +02:00
Martin Diehl 5a0e408d59 Merge branch 'development' into SolverRestart-in-HDF5 2019-04-30 17:07:45 +02:00
Martin Diehl 4eef54f4d2 Merge branch 'development' into improve-Lp-guessing 2019-04-30 10:43:47 +02:00
Martin Diehl 9703d04a7d grid/mesh for mesh needs rename
keep the old naming/location for the moment consistently for all solvers
2019-04-30 06:31:03 +02:00
Martin Diehl b8bf329a74 Merge branch 'development' into MiscImprovements 2019-04-30 00:02:35 +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 f628c80542 not supported anymore 2019-04-29 12:17:33 +02:00
Martin Diehl 39e6cedfb4 more direct and readable 2019-04-29 11:15:23 +02:00
Martin Diehl 477478f66c source code structure reflects build targets 2019-04-29 10:43:49 +02:00
Martin Diehl b4a21e8d40 fix for older cmake
looks ok
2019-04-26 18:07:43 +02:00
Martin Diehl b63a6c7034 cleaner code that also works with older cmake 2019-04-26 17:39:21 +02:00
Martin Diehl 7104bc9934 allow standard CMAKE way of setting install directory
- DAMASK_BIN in config has no effect anymore
2019-04-25 07:08:32 +02:00
Kieran David Nehil-Puleo d8b310e78b Changed Guessing Scheme 2019-04-18 11:13:51 -04:00
Martin Diehl ce1bb589c7 complicated use statements confuse CMake
probably we should adopt a similar "use" policy in Fortran as
recommended for Python "import" and have all imports at the beginning
https://www.python.org/dev/peps/pep-0008/
2019-04-18 15:30:54 +02:00
Martin Diehl 7c771647ad adjustments for easier access to output data 2019-04-18 11:55:50 +02:00
Martin Diehl fdd5b93e7c avoid FPE exceptions 2019-04-17 15:19:41 +02:00
Martin Diehl a6e6db0559 more stable/robust conversions 2019-04-17 12:52:48 +02:00
Martin Diehl 5d23a61fb0 same order as in the python module
... and only one "implicit none"
2019-04-16 22:17:56 +02:00
Martin Diehl ed8270d432 need to read reference stiffness 2019-04-16 14:53:36 +02:00
Martin Diehl d0a4cbf8d5 one implicit none is enough 2019-04-15 16:41:54 +02:00
Martin Diehl 8f58f1348e _pInt not needed 2019-04-15 16:19:30 +02:00
Martin Diehl 19dfefc2f4 fixed deadlock in grid_mech_FEM 2019-04-15 16:16:14 +02:00
Martin Diehl 4793f964f8 unified style 2019-04-15 15:53:46 +02:00
Martin Diehl 18f9deef1a fixed deadlock 2019-04-15 15:27:58 +02:00
Martin Diehl 1e2766cda6 not needed 2019-04-13 15:37:34 +02:00
Martin Diehl c4784e6673 better readable 2019-04-13 15:34:51 +02:00
Martin Diehl 89679147e8 leaner group structure, centrally handled 2019-04-13 09:47:56 +02:00
Martin Diehl 1036c76ae0 to transpose already when constructing the interaction matrix 2019-04-13 00:46:27 +02:00
Martin Diehl ffdd3955a3 implicit none is not needed 2019-04-13 00:44:00 +02:00
Martin Diehl 0335207956 complex orientation initialization conflicts with phase field
- easier to do as pre processing (python)
- ensures same solution independently of random number
2019-04-13 00:37:51 +02:00
Vitesh Shah a59c5c30c9 some cleanup 2019-04-11 18:48:28 +02:00
Vitesh Shah 057bee92af adding C_ref to HDF5 file doesnt work 2019-04-11 18:43:20 +02:00
Vitesh Shah a5b3fa565f Some incorrect variable names fixed 2019-04-11 18:36:28 +02:00
Vitesh Shah 8609c959df grid_mech_polarisation works 2019-04-11 15:51:34 +02:00
Martin Diehl 12efa108d6 store grid and size
store it temporarly at "mappings", later on they will be attached to the
(no yet existing) coordinates
2019-04-11 15:44:34 +02:00
Martin Diehl 3c8d96c54c enable more complex attributes 2019-04-11 15:44:08 +02:00
Martin Diehl 8e295cbadf no need to create type for native data types 2019-04-11 12:48:39 +02:00
Martin Diehl 52555d8c3c key words don't contain small letters
moved more variables from numerics to crystallite
2019-04-11 11:27:03 +02:00
Martin Diehl 8f7239b75d repetition not needed
- implicit none at the beginning of the module is enough
2019-04-11 07:35:58 +02:00
Martin Diehl 67eb39255a keep connected data together
- avoids dependencies
- easier to read and modify
2019-04-11 07:24:04 +02:00
Martin Diehl 8d90cfb600 unused variables 2019-04-11 06:46:31 +02:00
Franz Roters da034f971c Merge branch 'HDF5-out-3' into 'development'
Hdf5 out 3

See merge request damask/DAMASK!70
2019-04-10 20:39:37 +02:00
Vitesh Shah 1852f580ad grid_mech_FEM works 2019-04-10 18:19:10 +02:00
Martin Diehl 5989075009 working for grid_mech_spectral_basic 2019-04-10 13:23:57 +02:00
Martin Diehl c2cb8e2033 HDF5/results need rotation 2019-04-07 17:46:35 +02:00
Martin Diehl c3925b3497 small polishing 2019-04-07 14:47:21 +02:00
Martin Diehl 0b70f01e04 polishing 2019-04-07 14:28:08 +02:00
Martin Diehl 2fa8691335 prefix is added centrally already 2019-04-07 14:26:01 +02:00
Martin Diehl 7d0ebc4ded implicit none only needed once per module 2019-04-07 14:24:46 +02:00
Martin Diehl b2e293057a write rotation to results file 2019-04-07 14:02:24 +02:00
Martin Diehl d6d3f7aad7 write rotation as quaternion to HDF5 in named type 2019-04-07 13:26:23 +02:00
Martin Diehl 0b2c6c69c2 number ID as prefix to section names
enables unique and consistent section names for output
2019-04-07 13:20:44 +02:00
Martin Diehl 5075e1c2fb constituent (ex crystallite) results are stored in HDF5
currently, not the best code but new structure for crystallite data will
fix that
output of orientations still missing
2019-04-06 12:08:25 +02:00
Martin Diehl 1aed224c3b numerically more stable
avoids division by zero
2019-04-06 12:08:25 +02:00
Martin Diehl bfb6ad557f WIP: crystallite HDF5 results
will be stored according to the phase sections
2019-04-06 12:08:25 +02:00
Martin Diehl 7af3e70061 no pInt 2019-04-06 12:08:25 +02:00
Martin Diehl ab5a29b559 explicit import
for some reasons, ifort does not resolve the specific subroutine for the
writeDataset interace otherwise
2019-04-06 08:01:10 +00:00
Martin Diehl 6553fe815e proper indentation 2019-04-06 07:56:47 +00:00
Martin Diehl b52d5ab20b some more outputs
mainly done by Vitesh, copied it from other branch
2019-04-05 22:23:02 +02:00
Martin Diehl ccaea6b9d9 Merge branch 'development' into HDF5-out-3 2019-04-05 21:50:19 +02:00
Martin Diehl 72b30729bb submodule for homogenization
first draft, RGC not included because of name clash with isostrain
2019-04-05 21:46:00 +02:00
Martin Diehl 489a24afd8 consistent names 2019-04-05 20:58:56 +02:00
Martin Diehl 148440c16e consistent indentation 2019-04-05 20:51:57 +02:00
Martin Diehl 4aa52fa83f no pInt 2019-04-05 20:45:56 +02:00
Martin Diehl adebbcf5df preprocessor statements confuse cmake 2019-04-05 20:14:01 +02:00
Martin Diehl 7c30be47b0 mapping for materialpoint/homogenization
HDF5 file writing active for MSC.Marc/Abaqus (optional)
2019-04-05 16:53:41 +02:00
Martin Diehl 049cd96bbf introduced constituent mapping
this mapping will be used to find for a given location in the mesh the
constituent (phase/crystallite) results
2019-04-05 14:02:24 +02:00
Martin Diehl 63e6d60949 [skip sc] wip: implementing mapping for HDF5 2019-04-04 16:33:12 +02:00
Martin Diehl 953acf9c71 introducing new mappings 2019-04-04 13:25:29 +02:00
Martin Diehl 280a11c4bc avoid checking of unitialized variables 2019-04-04 11:49:23 +02:00
Martin Diehl bc4b79a3a2 writing results out
credits to Vitesh
2019-04-04 10:04:44 +02:00
Martin Diehl 811883df28 avoid error for empty datasets 2019-04-04 10:03:52 +02:00
Martin Diehl 658befa1a1 no pInt and some renames 2019-04-04 09:12:57 +02:00
Martin Diehl 4cac2448d4 writing more results out 2019-04-04 07:52:36 +02:00
Martin Diehl d0b1db1966 use consistent pre processor macro 2019-04-04 07:42:59 +02:00
Martin Diehl 19b1bc5e76 consistent use of keyword 2019-04-03 21:43:00 +00:00
Martin Diehl 5f462729c7 was .or., i.e. should be max not min 2019-04-03 21:42:30 +00:00
Martin Diehl 43bf51da67 copy and paste error in installation target of FEM 2019-04-03 20:23:46 +02:00
Martin Diehl f4c507942a let cmake do the work 2019-04-03 18:38:46 +02:00
Martin Diehl bdaa703d37 forall is deprecated, do concurrent not yet established 2019-04-03 18:26:43 +02:00
Martin Diehl b0f9444175 correct types (PGI complained) 2019-04-03 16:25:58 +00:00
Martin Diehl 453eb538f7 preparing for PGI compiler 2019-04-03 16:24:15 +00:00
Martin Diehl 43ead134d2 using correct comparison
-MIN is the minimum version that works
-MAX is the maximum version that works
2019-04-03 14:49:16 +02:00
Martin Diehl 9759d3d041 forall is deprecated
- performance-wise, there should be no difference for the small loops we
have
- still, the on-liner syntax was much nicer
2019-04-03 13:25:01 +02:00
Martin Diehl 4724e42b7f fixed indentation 2019-04-03 13:11:18 +02:00
Martin Diehl 3887d5631a handling of PGI compiler was to cumbersome 2019-04-03 13:04:03 +02:00
Martin Diehl e33807aab3 fixed indentation 2019-04-03 12:54:07 +02:00
Martin Diehl 1d31c5c2db pInt not needed 2019-04-03 12:32:30 +02:00
Martin Diehl 48633d887b allow to specify min and max of PETSc separately 2019-04-03 11:53:59 +02:00
Martin Diehl 3a8f48a0f8 easier to adjust to new versions 2019-04-03 08:25:42 +02:00
Martin Diehl 4604e65a42 use matmul instead of hand-written functions
- performance is the same
- leaner code
- matmul works (was buggy a few years ago)
2019-04-03 08:22:04 +02:00
Martin Diehl bcaadac79a simplification in agreeemnt with the paper 2019-04-02 15:39:55 +02:00
Martin Diehl a5827c5ef3 using suitable defaults for damage 2019-03-29 14:26:32 +01:00
Martin Diehl be421f0cf5 use FFTW default flag and constants from include file 2019-03-29 08:48:32 +01:00
Martin Diehl 019d241c67 keyword "spectralsolver" is currently used in the tests
should become grid_mech soon
2019-03-29 08:45:25 +01:00
Martin Diehl 8aee3d7f54 use list from separate module 2019-03-29 08:34:44 +01:00
Martin Diehl 5ffe78ff1f bugfix: strain rate was missing
dot_gamma is per definition positive, abs only confuses the reader
2019-03-28 09:47:03 +01:00
Martin Diehl 32c03d0b9b keyword has not changed (yet) 2019-03-28 09:20:24 +01:00
Martin Diehl 9f2559baf5 allow defaultVal string of variable length 2019-03-28 07:04:48 +01:00
Martin Diehl 4470ecfe4a better have a separate module 2019-03-28 06:52:17 +01:00
Martin Diehl 6996eb36c0 more renames 2019-03-28 06:39:07 +01:00
Martin Diehl daab9263d3 using names from DAMASK paper 2019-03-27 23:09:45 +01:00
Martin Diehl 3700bacccc consistent indentation 2019-03-27 22:42:02 +01:00
Martin Diehl 464375a54e pInt does not add any value 2019-03-27 22:12:31 +01:00
Martin Diehl 454898a235 Merge branch 'development' into MiscImprovements 2019-03-27 19:52:56 +01:00
Franz Roters 1e20e94792 Merge remote-tracking branch 'remotes/origin/Grid-FEM-2' into development 2019-03-27 16:57:20 +01:00
Martin Diehl 1f41549a2c avoid explicit loops 2019-03-27 12:37:48 +01:00
Martin Diehl 6070c0c2b1 f***ing windows always sets executable bit 2019-03-26 21:44:58 +01:00
Martin Diehl 1ff55b6374 not supported by ancient compiler needed for Abaqus 2019-03-26 21:44:25 +01:00
Martin Diehl bff03063e2 simpler logic 2019-03-26 21:44:25 +01:00
Martin Diehl ce2cb16921 better define variables close to their usage 2019-03-26 07:36:55 +01:00
Martin Diehl 49ff1454a9 no need for explicit loops 2019-03-26 06:47:17 +01:00
Martin Diehl 1869f2cdcd string length handling in-line with other functions 2019-03-26 06:27:13 +01:00
Martin Diehl 2feb79833c better use functions than global variables
need to design a test before full migration
2019-03-25 21:54:08 +01:00
Martin Diehl 17455d1dc6 syntax polishing 2019-03-25 19:17:10 +01:00
Martin Diehl 27da4b2b7a pInt not needed 2019-03-25 18:28:07 +01:00
Martin Diehl 761dcb0358 no need for explicit loop 2019-03-25 18:04:53 +01:00
Martin Diehl df32759825 Merge remote-tracking branch 'origin/development' into MiscImprovements 2019-03-25 16:35:32 +01:00
Martin Diehl 0503a80943 avoid the use of global variables
better to define variables where they are used
2019-03-25 15:54:51 +01:00
Martin Diehl 12723d7247 running test (hopefully) 2019-03-25 13:10:56 +01:00
Martin Diehl 010fd0b862 using config_numerics instead of global values 2019-03-25 09:36:59 +01:00
Franz Roters af611d7ca4 Merge branch 'Dislotwin-Names-as-in-paper' into 'development'
Dislotwin names as in paper

See merge request damask/DAMASK!66
2019-03-25 09:16:36 +01:00
Martin Diehl 29fff6b158 fixed reporting and restart 2019-03-25 08:09:09 +01:00
Martin Diehl 19af34e054 cleaned
- no Pint
- consistent indentation
2019-03-24 12:07:51 +01:00
Martin Diehl 293f869fe5 improved signal handling
- possibility to catch SIGTERM
- functions to set SIG(TERM/USR1/USR2) explicitly
2019-03-24 11:59:00 +01:00
Martin Diehl 728dac5a48 separate module for linked list 2019-03-24 11:40:05 +01:00
Martin Diehl dada4e69b6 consistent use of 2 blanks, no pInt 2019-03-24 11:28:20 +01:00
Martin Diehl 320f39925a modernized
- no pInt
- consistent indentation by 2 spaces
- no leftovers from old file parsing
2019-03-24 11:18:59 +01:00
Martin Diehl 0f2013e78a modernized
- no pInt
- consistent 2-blank indentation
- use of parameter structure
2019-03-24 11:01:27 +01:00
Martin Diehl c1d4b64b13 better use intrinsic F2003 features 2019-03-24 10:48:46 +01:00
Martin Diehl 2e164a1ddd need to write out these tensors for restart 2019-03-24 09:51:47 +01:00
Martin Diehl 0fecac4f2a load case rotation works for polarisation solver 2019-03-23 16:47:26 +01:00
Martin Diehl a06be13d49 following structure of mech_spectral_basic 2019-03-23 15:39:28 +01:00
Martin Diehl 7ccb5c1fa3 enables load case rotation feature 2019-03-23 14:25:05 +01:00
Martin Diehl 5a3689770a restart for grid mech FEM now working 2019-03-23 10:46:56 +01:00
Martin Diehl d55a7da592 renaming "spectral" to "grid" 2019-03-23 09:27:58 +01:00
Martin Diehl 593fa24bad remove global variables 2019-03-23 06:53:29 +01:00
Martin Diehl 798c5bb633 initial takeover from older branches 2019-03-23 06:21:18 +01:00
Martin Diehl 72476ae796 internal (private) functions at the end of the module 2019-03-22 16:02:00 +01:00
Franz Roters b8117d4057 LpAndItsTangent called kinetics_twip a second time instead of kinetic_trans 2019-03-22 15:31:29 +01:00
Martin Diehl 5050f21a6e [skip ci] more renames for consistency 2019-03-22 12:28:53 +01:00
Martin Diehl 6966e68403 more renames (following DAMASK paper) 2019-03-22 11:40:52 +01:00
Martin Diehl f50e6fe5ad [skip ci] adjusting to disloUCLA 2019-03-22 11:32:55 +01:00
Martin Diehl 450a0565d3 internal variable names also adjusted 2019-03-22 11:06:08 +01:00
Martin Diehl bd6b7e1854 correct signs (same behavior, but full math) 2019-03-22 10:58:54 +01:00
Martin Diehl c9c9079076 fixed indentation 2019-03-22 10:55:17 +01:00
Martin Diehl fa96042320 correct names for shear rates 2019-03-22 10:49:24 +01:00
Martin Diehl f12b66b409 wrong keyword 2019-03-22 09:26:39 +01:00
Martin Diehl 28caf5ed4d final rename (for the moment) 2019-03-22 06:57:32 +01:00
Martin Diehl 5dc5a25ab3 simplified dotState 2019-03-22 06:48:38 +01:00
Martin Diehl ad563b99a8 Merge branch 'development' into DisloUCLA-Names-as-in-paper 2019-03-21 08:12:36 +01:00
Martin Diehl 17f955d3e8 still renaming 2019-03-21 08:07:09 +01:00
Martin Diehl 25f2d78656 final renames (for the moment) 2019-03-21 00:15:10 +01:00
Martin Diehl 9936b382fd more renames 2019-03-20 21:51:52 +01:00
Martin Diehl 97f6566d98 more renames 2019-03-20 16:52:43 +01:00
Martin Diehl facef25f8e renaming to fit paper and/or disloUCLA 2019-03-20 09:46:49 +01:00
Martin Diehl 349acce9f2 more renames to follow dislotwin and/or paper 2019-03-20 09:38:38 +01:00
Martin Diehl 5f53147e96 wrong assignmen (scalar to vector) 2019-03-19 14:56:36 +01:00
Martin Diehl 8a07ff4617 fixed copy and paste errors 2019-03-19 14:17:06 +01:00
Martin Diehl 98d25ae48a more name adjustments 2019-03-19 07:00:03 +01:00
Martin Diehl 1b53040f5e intermediate results should not be stored 2019-03-19 06:52:06 +01:00
Martin Diehl d22f41eeaa better readable 2019-03-19 06:25:21 +01:00
Martin Diehl d9e497bdd8 prefactors were not used/not mentioned in the paper 2019-03-19 06:21:40 +01:00
Martin Diehl a12417a091 as in dislotwin 2019-03-19 05:46:47 +01:00
Martin Diehl fc997554ba Simplified tangent calculation, thx to Karo 2019-03-18 23:11:28 +01:00
Martin Diehl f9e47a94aa no pInt 2019-03-18 22:57:23 +01:00
Martin Diehl fbc607e14d no pInt 2019-03-18 22:53:24 +01:00
Martin Diehl 7d40d13b4c simplifying 2019-03-18 22:44:54 +01:00
Martin Diehl 5f85a65fe6 shorter name, inline with the paper 2019-03-18 22:37:32 +01:00
Martin Diehl 3eb7f868bf pInt not needed 2019-03-18 22:17:11 +01:00
Martin Diehl 76dee8cb81 renaming according to paper 2019-03-18 22:08:41 +01:00
Martin Diehl 66aa9399a7 don'r rely on halton sequence
not really trustworthy as we saw some pattern for higher dimensional
data
2019-03-17 18:06:41 +01:00
Martin Diehl 6d268b7b37 some polishing 2019-03-17 17:59:01 +01:00
Martin Diehl dac4f5cd22 syntax polishing 2019-03-17 17:02:08 +01:00
Martin Diehl 5f41d6d9b4 no pInt 2019-03-17 13:35:41 +01:00
Martin Diehl d7739fa8f8 no derived quantities in postResults
preparing for HDF5 out
2019-03-17 13:29:58 +01:00
Martin Diehl 52b54ddf23 direct access to state variable 2019-03-17 12:36:15 +01:00
Martin Diehl fa513778c0 array access was wrong
now using the rectified dislocation density from "getRho". This results
in a slightly more conservative sensitivity check
2019-03-17 11:51:26 +01:00
Martin Diehl 730e7d96c0 better readable 2019-03-16 21:58:30 +01:00
Martin Diehl 8f89827573 improved readability 2019-03-16 19:09:22 +01:00
Martin Diehl f079e6f9c0 simpler logic for shortrange stress correction 2019-03-16 16:29:16 +01:00
Martin Diehl 117f4b9625 more functions relying on getRho 2019-03-16 15:46:39 +01:00
Martin Diehl 5da017e79f using new funtionality to get rho 2019-03-16 15:08:50 +01:00
Martin Diehl eb2646ca9c improving readability
- arrays to access specific dislocation types
- function to access and clean rho
2019-03-16 13:13:48 +01:00
Martin Diehl 510c0da02c more systematic names 2019-03-16 08:55:25 +01:00
Martin Diehl a4d7ce48b3 Decided on one DAMASK logo 2019-03-13 22:23:09 +01:00
Martin Diehl cba02d91b9 no need to import pInt 2019-03-13 07:00:20 +01:00
Martin Diehl c7f33f4696 no pInt 2019-03-13 06:46:59 +01:00
Martin Diehl 81cfa31b31 [skip ci] with DAMASK ASCII art 2019-03-13 06:16:31 +01:00
Martin Diehl fb6a6e9db5 [skip ci] corrected year 2019-03-12 22:56:09 +01:00
Martin Diehl 7d23b77ad0 Merge branch 'development' into MiscImprovements 2019-03-12 22:37:53 +01:00
Martin Diehl 7cb2203a38 pInt not needed anymore 2019-03-12 22:29:03 +01:00
Martin Diehl 40fda62efc parsing material.config and debug.config 2019-03-12 22:27:45 +01:00
Martin Diehl 62694eddf8 clearer structure 2019-03-12 21:48:33 +01:00
Martin Diehl 9a38951725 finished renaming: spectral -> grid 2019-03-12 18:56:28 +01:00
Martin Diehl fdc8a848a5 no pInt + same indentation everywhere 2019-03-12 11:36:18 +01:00
Martin Diehl 818338ca93 new label needs new tests, will be done later 2019-03-12 11:17:15 +01:00
Martin Diehl 1ece0a1dfd better readable 2019-03-12 09:36:54 +01:00
Martin Diehl 1df8b22e23 clearer names 2019-03-12 09:28:06 +01:00
Martin Diehl 2353545779 using new names 2019-03-12 06:06:59 +01:00
Martin Diehl c57bfd34e9 no need for long names 2019-03-12 05:53:12 +01:00
Martin Diehl 6495276b81 bugfix: rename from "solution" to "solution_vec" was incomplete 2019-03-12 05:52:13 +01:00
Martin Diehl 643ed89447 not needed anymore 2019-03-12 00:07:44 +01:00
Martin Diehl 2505c02c75 bugfix 2019-03-11 23:55:04 +01:00
Martin Diehl 94cf563141 new name 2019-03-11 23:51:04 +01:00
Martin Diehl 011af1f686 adjusting names 2019-03-11 23:37:06 +01:00
Martin Diehl 23043da98c more sensible names 2019-03-11 23:10:40 +01:00
Martin Diehl 6a82a0a33e proper indentation 2019-03-11 23:04:00 +01:00
Martin Diehl 1fb1032127 no pInt 2019-03-11 22:58:11 +01:00
Martin Diehl 18fe8c34ee fortran fast storage of interaction matrices 2019-03-11 22:41:59 +01:00
Martin Diehl 0cdcc4de11 no pInt any more 2019-03-11 17:35:08 +01:00
Martin Diehl f203add899 not needed 2019-03-10 12:58:07 +01:00
Martin Diehl 340617ab65 unifying notation 2019-03-10 12:05:52 +01:00
Martin Diehl 550b6510a5 better name 2019-03-10 12:05:52 +01:00
Martin Diehl c8f426a875 use variables from mesh object 2019-03-10 12:05:52 +01:00
Martin Diehl 927f947c2a better readable 2019-03-10 10:05:47 +01:00
Martin Diehl 8661d6e82f PGI complaines, forall is deprecated anyway 2019-03-10 10:05:47 +01:00
Martin Diehl 11662033c3 seems to cause problems with PGI as well 2019-03-10 10:05:47 +01:00
Martin Diehl 60f4f9f39c norm2 for PGI 2019-03-10 10:05:47 +01:00
Martin Diehl 05b4dd1973 correct type casting 2019-03-10 10:05:47 +01:00
Martin Diehl 714c9b1ecb PGI does not no "do concurrent" (yet) 2019-03-10 10:05:47 +01:00
Martin Diehl 388e661433 use explicitly pReal 2019-03-10 10:05:47 +01:00
Martin Diehl 0118fefe6e wrong type 2019-03-10 10:05:47 +01:00
Martin Diehl 96c4599dc7 norm2 is (yet) not available in PGI 2019-03-10 10:05:47 +01:00
Martin Diehl 34660599a1 dummy HDF5 output for all plasticity laws 2019-03-09 20:43:31 +01:00
Martin Diehl 7643d66654 bugfix, avoid error 2019-03-09 16:22:57 +00:00
Martin Diehl 55d55a156b following numpy syntax 2019-03-09 16:19:56 +00:00
Martin Diehl 121bafd989 required for HDF5 output 2019-03-09 15:55:25 +00:00
Martin Diehl 22a3596561 simplified, trying to get rid of all public variables 2019-03-09 15:12:59 +01:00
Martin Diehl c74f453486 public variables not needed anymore 2019-03-09 15:12:59 +01:00
Martin Diehl 1bf31598c5 avoid usage of lattice variables 2019-03-09 15:12:59 +01:00
Martin Diehl eba763cf38 not needed anymore 2019-03-09 15:12:59 +01:00
Martin Diehl f0d03a41ba fracture modes are calculated differently 2019-03-09 15:12:59 +01:00
Martin Diehl 7bfd7a42ea empty file needs special case for Ifort 2019-03-09 13:43:56 +01:00
Martin Diehl 383e1befd5 polishing and extending citations 2019-03-09 11:11:40 +01:00
Martin Diehl 1ba27cf62d same reporting style, more error checks 2019-03-09 11:11:40 +01:00
Martin Diehl 6f3771f6c4 Allreduce better suited than Bcast 2019-03-09 11:11:40 +01:00
Martin Diehl 66e6a6ec68 cleaning 2019-03-09 11:11:40 +01:00
Martin Diehl 0d08659b2a general cleaning 2019-03-09 11:11:40 +01:00
Martin Diehl 2394880741 Tstar renamed to S (following the DAMASK paper) 2019-03-09 11:11:40 +01:00
Martin Diehl 02c7b1056a use central functionality
IO function reads numerics.config and debug.config
2019-03-09 11:11:40 +01:00
Martin Diehl ae5ea87ab1 cleaning 2019-03-09 11:11:40 +01:00
Martin Diehl 2621689843 correct initialization 2019-03-09 08:01:20 +01:00
Martin Diehl af707c671c improved IO functionality
- naming for file opening follows python
- damage modules do not read from file any more
2019-03-08 23:16:56 +01:00
Martin Diehl 48cfc35996 polishing 2019-03-08 23:16:35 +01:00
Martin Diehl 09a7427193 temporarly disabled restart 2019-03-08 23:16:08 +01:00
Martin Diehl 363a95d5b7 not needed 2019-03-08 19:07:19 +01:00
Martin Diehl 67dcb6d2d6 not needed 2019-03-08 19:07:19 +01:00
Martin Diehl 622372bd64 where within forall does not work with PGI 2019-03-08 19:07:19 +01:00
Martin Diehl 0f6bf38299 unused functionality 2019-03-08 19:07:19 +01:00
Martin Diehl ce0e84f418 was not used anymore 2019-03-08 19:07:19 +01:00
Martin Diehl de330517eb rank not supported by older compiler/older dialects 2019-03-08 07:42:13 +01:00
Martin Diehl 3b1328163c cleaned 2019-03-07 23:19:39 +01:00
Martin Diehl de6fd605ee is not used anywhere else 2019-03-07 22:47:45 +01:00
Martin Diehl a4cdbab7cf not needed 2019-03-07 22:44:33 +01:00
Martin Diehl 4a636dbd99 not used at all 2019-03-07 22:41:07 +01:00
Martin Diehl 8224797e75 simplified 2019-03-07 22:31:54 +01:00
Martin Diehl f0eeb3d9b4 using naming convention of numpy 2019-03-07 22:22:49 +01:00
Martin Diehl 9e05b2fcf0 using new name 2019-03-07 22:20:38 +01:00
Martin Diehl b03208bc69 unused function 2019-03-07 22:19:08 +01:00
Martin Diehl 3b8b83fbd9 FLOAT is not defined anymore 2019-03-07 22:18:29 +01:00
Martin Diehl a80b57c96b forgotten during removal of vacancy/porosity/hydrogen 2019-03-07 20:51:14 +01:00
Martin Diehl 215598ade9 consistent formatting: always indent by 2 spaces 2019-03-07 20:39:33 +01:00
Martin Diehl 81b971374b no need to use pInt 2019-03-07 19:34:27 +01:00
Martin Diehl 98843587e5 Merge branch 'FWBW-default-2' into development 2019-03-07 18:37:58 +01:00
Martin Diehl d17c1a6d17 comment was wrong 2019-03-07 18:37:22 +01:00
Martin Diehl 7a083c4098 [skip ci] more general names and procedure 2019-03-07 11:02:27 +01:00
Martin Diehl 4ee484b6e7 correct scaling for fluctuations 2019-03-07 07:14:45 +01:00
Martin Diehl 21bbba1575 cleaning 2019-03-07 07:09:00 +01:00
Martin Diehl ae3de821b4 bugfix: synchronizatopm of dPdF_min and dPdF_max was not correct
-before: using componenwise min/max among different processors
-now:    identify the processor that holds the minimum/maximum of the
norm
2019-03-07 07:01:09 +01:00
Martin Diehl ccb62da24a kind-ID does not need to coincide with the number of bytes 2019-03-06 16:33:39 +01:00
Martin Diehl a965c46025 improved functions for floating point comparison
- less stric tolerance for comparison to zero
- better readable
- avoid "merge" on optional arguments (not safe)
- "equal" and "notEqual" are now symmetric (assignment of <= and < is
arbitrary)
2019-03-06 15:57:42 +01:00
Martin Diehl 51f8b1961f simplify integer precision handling
essentially, it should be ok to always use the default integer (which is
32 bit unless using MSC.Marc) and use 64 bit integer only for special cases where an overflow
could happen
2019-03-06 15:52:52 +01:00
Martin Diehl 05eb80d38c pLongInt was not used 2019-03-06 15:49:31 +01:00
Martin Diehl c9e7311b42 no need to use pInt here 2019-03-06 15:47:48 +01:00
Martin Diehl 977f61452b compiler-independent defintion of real and integer kinds
real(8) does not neccessarily mean a real with 8 byte (but for gfortran
and ifort it does)
2019-03-06 15:25:47 +01:00
Franz Roters 19da2b911d flux subroutine for Abaqus
related comments
2019-02-27 09:23:05 +01:00
Martin Diehl b7ee4318b7 copy and paste error 2019-02-27 07:22:59 +01:00
Philip Eisenlohr 6e9b745ca1 shorterned line to avoid compile time truncation warning 2019-02-26 21:22:14 -05:00
Philip Eisenlohr ff5ac56cfb shortened too long lines 2019-02-26 15:31:47 -05:00
Philip Eisenlohr cfb2770b93 merged and added correction to FreeSurface.config example 2019-02-26 13:56:49 -05:00
Philip Eisenlohr cb9543dff7 more elaborate debug labelling 2019-02-26 13:47:46 -05:00
Martin Diehl 56e2c1264b Merge branch 'development' into New-Thermal 2019-02-26 07:54:45 +01:00
Martin Diehl 6fab99bca5 Merge branch 'development' of magit1.mpie.de:damask/DAMASK into development 2019-02-25 20:10:38 +01:00
Martin Diehl d83847446d Merge branch '32_NewStyleNonlocal-4' into development 2019-02-25 20:06:20 +01:00
Martin Diehl 7115382729 not used anymore 2019-02-24 10:08:09 +01:00
Martin Diehl 7903e2b65f dependencies got mixed up 2019-02-23 11:31:53 +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 b1bb68d523 cleaning 2019-02-22 21:07:00 +01:00
Martin Diehl ad0ed4fdec bugfix: wrong state was allocated 2019-02-22 21:06:37 +01:00
Martin Diehl 194824fd0f WIP: cleaned
no file reading
getting rid of a number of obsolete dependencies
2019-02-22 20:37:41 +01:00
Martin Diehl e7268ce109 simpler structure:
- do not read file
- use function for allocation
- do not constantly convert (3,3) <-> (6)
2019-02-22 15:37:42 +01:00
Martin Diehl af4ea76006 using central allocation facilities 2019-02-22 15:21:48 +01:00
Martin Diehl aa2bd4fc4c Merge branch 'development' into New-Thermal 2019-02-22 10:17:34 +01:00
Martin Diehl db9016d146 avoid repeated loops 2019-02-22 10:02:43 +01:00
Martin Diehl 4d45038358 better readable 2019-02-22 09:21:04 +01:00
Martin Diehl 5e369aa220 avoid use of new variables in deprecated code 2019-02-22 08:32:12 +01:00
Martin Diehl beb73c7882 not needed 2019-02-22 07:37:08 +01:00
Martin Diehl da8a1d5973 leaner interface 2019-02-21 21:32:22 +01:00
Martin Diehl 6938864c4b pointers allow easier access to state variables 2019-02-21 20:37:49 +01:00
Martin Diehl d686384d17 let lattice.f90 do the job 2019-02-21 19:18:06 +01:00
Martin Diehl 21d0ef2fb5 use microstructure/dependent state
introduced only partly, otherwise the uncommon calling sequence in nonlocal leads
to a change in behavior
2019-02-21 05:55:03 +01:00
Martin Diehl cb2d2b02dc re-ordered and cleaned 2019-02-21 00:24:35 +01:00
Martin Diehl 3fa699ad22 indices were mixed up 2019-02-20 20:17:55 +01:00
Martin Diehl 2d51c0595b don't parse material.config any more 2019-02-20 19:03:20 +01:00
Martin Diehl 6f135ea632 no random-multiplication anymore
from our current understanding, the implementation of random nucleation
was strongly dependent on the numerical method and the time stepping
2019-02-20 17:58:11 +01:00
Martin Diehl 871ba90654 initialization can be done internally 2019-02-20 17:50:26 +01:00
Martin Diehl eb394b3139 same name in all models 2019-02-20 14:54:26 +01:00
Martin Diehl 838faca819 using structure for output
avoids waste of memory in case of multiple instances
avoids explicit dependence on ip and el
2019-02-20 13:32:08 +01:00
Martin Diehl e6e019e48a transition to param structure 2019-02-20 09:13:50 +01:00
Martin Diehl d29b37f517 provide slip system components as functions 2019-02-20 07:53:34 +01:00
Martin Diehl a896ed91f8 simplified/not needed 2019-02-20 07:33:19 +01:00
Martin Diehl d0b0e3be3b simplified 2019-02-20 00:41:44 +01:00
Martin Diehl 649750a1c9 let lattice to the work 2019-02-19 23:55:59 +01:00
Martin Diehl e8ac2d0d97 limiting inter-module dependencies 2019-02-19 10:47:12 +01:00
Martin Diehl 41899f6d33 using more parameters from smart structure 2019-02-19 10:31:14 +01:00
Martin Diehl 6bcd4a77d2 complex pointer structure for state 2019-02-19 09:43:48 +01:00
Martin Diehl 1a5711e246 using more parameters from parameter structure 2019-02-18 22:55:31 +01:00
Martin Diehl ae9d8e4e8d cleaning 2019-02-18 10:28:08 +01:00
Martin Diehl 435dce220c move stress conversion one level up
should be totally avoided
2019-02-18 07:24:56 +01:00
Martin Diehl 8a30441a52 Merge branch 'development' into 32_NewStyleNonlocal-3 2019-02-18 07:14:11 +01:00
Martin Diehl 690fef6f06 avoid publicly avaialbe data, rather provide setters and getters 2019-02-17 20:38:57 +01:00
Martin Diehl 44e41465d0 use functions from lattice to calculate slip systems
don't rely on internal coding for collinear systems
2019-02-17 17:56:01 +01:00
Martin Diehl c4b3ac3afb slip system definition for bcc still needed 2019-02-17 17:04:26 +01:00
Martin Diehl d3e6430b94 only used internally 2019-02-17 14:30:58 +01:00
Martin Diehl 553b1c7743 stress tensor was accidentally still converted 2019-02-17 13:16:00 +01:00
Martin Diehl 7ad866b90f not needed any more 2019-02-17 12:16:12 +01:00
Martin Diehl cf32e7d1f5 use parameter structure and avoid conversion 33<->6 2019-02-17 12:15:46 +01:00
Franz Roters 530f4f2804 Merge branch 'New-Damage' into 'development'
New damage

See merge request damask/DAMASK!59
2019-02-17 10:09:46 +01:00
Franz Roters db9d5c898a [skip ci] typo 2019-02-17 10:08:02 +01:00
Martin Diehl 0f319e2cf6 fixed state size and output size 2019-02-16 23:18:53 +01:00
Martin Diehl c7abe55944 was not needed 2019-02-16 22:09:06 +01:00
Martin Diehl 2584f85760 parameters are stored in parameter structure 2019-02-16 18:38:13 +01:00
Martin Diehl 0ba8ebff1e Merge remote-tracking branch 'origin/development' into 32_NewStyleNonlocal-3 2019-02-16 18:12:38 +01:00
Martin Diehl 63e2ea7d8f was not use (anymore) 2019-02-16 12:49:28 +01:00
Martin Diehl 77d60be127 avoid superfluous reporting 2019-02-16 11:30:56 +01:00
Martin Diehl efe9823e62 clearer logic for preprocessor statements 2019-02-16 10:43:02 +01:00
Martin Diehl af83427e8c Merge branch 'development' into 53-separate-mesh-for-different-solvers-3 2019-02-16 10:25:42 +01:00
Martin Diehl 61032b5fd8 wrong jump position
probably a copy and paste error
2019-02-16 10:24:12 +01:00
Martin Diehl 9a3921ea84 ifdef statements grouped together
unless they belong to a group of functions, like opening files or
interpreting lines
2019-02-16 10:20:53 +01:00
Martin Diehl 0fd5476883 doxygen interprets comment as doc string 2019-02-16 06:42:08 +01:00
Martin Diehl afdaac47af avoid disturbing reporting 2019-02-15 22:54:38 +01:00
Martin Diehl d78bf18483 simplified output 2019-02-15 07:25:25 +01:00
Martin Diehl 1567b0ee94 was not used 2019-02-15 07:03:52 +01:00
Martin Diehl bc0bc06aea polishing 2019-02-13 10:16:06 +01:00
Martin Diehl 5b0cdf294d delta state is needed
not sure if the offset handling is correct
2019-02-13 10:11:25 +01:00
Martin Diehl dc6f18c3f8 cleaning 2019-02-13 10:03:28 +01:00
Martin Diehl d366651873 file reading not required anymore 2019-02-13 09:57:12 +01:00
Martin Diehl 47a9d88a15 read vector-parameters 2019-02-13 09:19:37 +01:00
Martin Diehl 3ca34c8f80 simplified 2019-02-13 09:09:30 +01:00
Martin Diehl a421525d15 preparing storage of output parameters 2019-02-13 08:06:22 +01:00
Martin Diehl f34c10a477 sdot_0 already available as parameter 2019-02-13 07:36:36 +01:00
Martin Diehl b3e705e628 polishing, fixed typo 2019-02-13 07:34:16 +01:00
Martin Diehl aa8d218ce7 was never used 2019-02-13 07:28:28 +01:00
Martin Diehl 6a0d739d48 use parameters from param structure 2019-02-13 07:24:48 +01:00
Martin Diehl 61baa66c38 avoid code duplication 2019-02-13 07:22:37 +01:00
Martin Diehl 9574dfae2d avoiding repeated reading of material.config 2019-02-13 07:04:13 +01:00
Martin Diehl 55cef533f1 conversion 3x3-matrix <-> 6-vector not helpful 2019-02-13 00:00:07 +01:00
Martin Diehl 01fe7a9731 Merge branch 'development' into New-Damage 2019-02-12 23:37:39 +01:00
Martin Diehl c9fc7ea982 cleaning
trying to find logic with less dependencies on the various
mappings
2019-02-12 23:35:22 +01:00
Martin Diehl 69d53ed869 determining output size was overly complicated
general cleaning
2019-02-12 23:20:24 +01:00
Martin Diehl be7f740e65 Merge branch 'development' into New-Thermal 2019-02-12 22:52:21 +01:00
Arko Jyoti Bhattacharjee 1a471bcd8a signal handling implemented
allows to trigger action in running simulation, i.e. writing restart or results
2019-02-11 18:46:14 +01:00
Martin Diehl 87f3e3f621 more flexible and user friendly 2019-02-11 10:08:34 +01:00
Martin Diehl af28e9cdd9 not needed anymore 2019-02-09 17:23:56 +01:00
Martin Diehl c4eef520fc initialize all variables 2019-02-09 17:21:11 +01:00
Martin Diehl 09859f1b12 wrong variable rename (was forgotten) 2019-02-09 16:53:05 +01:00
Martin Diehl de26e41684 some first steps to support debugging with the PGI compiler
norm2 and sum for initialization are not supported yet, need fixes
2019-02-09 15:02:07 +00:00
Martin Diehl 8167f09ec6 using functions as far as possible 2019-02-09 12:01:31 +01:00
Martin Diehl 5d9c3fcf27 finalize for write 2019-02-09 09:44:41 +01:00
Martin Diehl 73749dd788 merged also finalization 2019-02-09 09:38:49 +01:00
Martin Diehl d934f2b141 also modularize write 2019-02-09 09:03:31 +01:00
Martin Diehl c668260c37 avoiding code duplication 2019-02-09 08:05:29 +01:00
Martin Diehl 36662f8419 more generic formulation (works for all dimensions) 2019-02-09 07:50:33 +01:00
Martin Diehl 542ab946cc [skip ci] not needed 2019-02-04 19:05:02 +01:00
Martin Diehl 3f61c97ded don't support non-DAMASK materials 2019-02-04 18:58:36 +01:00
Martin Diehl 453f4556e5 bracket was missing 2019-02-04 00:12:27 +01:00
Martin Diehl 5320803842 bugfix: valid range for unit quaternion range is [-1,+1] 2019-02-04 00:06:38 +01:00
Martin Diehl a57aa7985a wrong name 2019-02-03 18:11:16 +01:00
Martin Diehl 59dd9b16e1 cleaning 2019-02-03 16:40:15 +01:00
Martin Diehl b0b1ea3b84 input argument not needed any more 2019-02-03 14:23:32 +01:00
Martin Diehl ec23fca057 it's a property of the element, not of the mesh 2019-02-03 14:22:06 +01:00
Martin Diehl 2d0c74d7d9 implicit dependencies made explicit 2019-02-03 14:22:06 +01:00
Martin Diehl 2aba6faf40 cleaning and making dependencies clear 2019-02-03 14:22:06 +01:00
Martin Diehl 91992debf2 Marc now works also with the module
reason, why it did NOT work earlier still not clear
2019-02-03 13:30:04 +01:00
Martin Diehl b9f93d5460 is now a subfunction 2019-02-03 11:22:23 +01:00
Martin Diehl d605adc92e avoid the use of global variables to make dependencies clear 2019-02-03 11:12:23 +01:00
Martin Diehl f45ba0ff5b functions specific for MSC.Marc and/or Abaqus
these functions are very specific for the input files and might be
better located in the respective mesh module
2019-02-03 08:27:20 +01:00
Martin Diehl 2c7553653b only used by MSC.Marc 2019-02-03 08:11:19 +01:00
Martin Diehl 40ad1aef2f was not used 2019-02-03 08:07:58 +01:00
Martin Diehl a92937a7e3 grid does reading in of geometry independently 2019-02-03 08:06:53 +01:00
Martin Diehl 1eb30f3ae7 re-ordered according to calling sequence 2019-02-02 20:49:15 +01:00
Martin Diehl bb135463c4 using data from theMesh instead of local variables 2019-02-02 20:45:19 +01:00
Martin Diehl 35c37ef9dc forgotten format specifier 2019-02-02 17:39:31 +01:00
Martin Diehl abedb5c3db ordered according to calling sequence 2019-02-02 17:24:18 +01:00
Martin Diehl 16cb9ebed9 no need to read homogenization info extra
but currently, it is not very elegant
2019-02-02 17:24:18 +01:00
Martin Diehl d51a379376 avoid jump labels 2019-02-02 17:24:18 +01:00
Martin Diehl 819ec40b44 clearer order:
1) parse file
2) set up element
3) set up mesh
2019-02-02 17:24:18 +01:00
Martin Diehl 07cca77fce left over jump marks 2019-02-02 17:19:12 +01:00
Martin Diehl 3edbfc1cb5 bugfix:
infinite loop for geom file without new line at end
also, a lot of cleaning
2019-02-02 15:10:35 +01:00
Martin Diehl 933136ec1e nNodes form element is used already 2019-02-02 13:10:21 +01:00
Martin Diehl b514bf78a5 avoiding duplicated variables 2019-02-02 12:31:07 +01:00
Martin Diehl 4f2a3d7f55 unused variables 2019-02-02 12:23:53 +01:00
Martin Diehl dcd16dda70 variables from mesh object 2019-02-02 12:15:05 +01:00
Martin Diehl 326cbd0398 Merge branch 'development' into 53-separate-mesh-for-different-solvers-3 2019-02-02 11:52:06 +01:00
Martin Diehl 8962635136 use new elem/mesh variables 2019-02-02 11:50:07 +01:00
Martin Diehl 94a24e45ee bugfixes:
theMesh%Nelems need to be set (using an intermediate function until a
routine does that)
spectral.geom file can have "N+n to N" (backwards counting)
2019-02-02 11:46:38 +01:00
Martin Diehl 3a5a50cb03 use variables from theMesh 2019-02-02 10:53:55 +01:00
Martin Diehl 7a8d98d135 using theMesh (object oriented mesh description) 2019-02-02 10:35:10 +01:00
Martin Diehl f0b5b9fd59 unused variable 2019-02-02 10:34:38 +01:00
Martin Diehl e17278a926 using new mesh structure (initial test) 2019-02-02 10:11:18 +01:00
Martin Diehl 9975048f29 better avoid jump marks: Abaqus, Part 2 2019-02-02 09:56:11 +01:00
Martin Diehl 5810dce618 better avoid jump marks 2019-02-02 09:29:58 +01:00
Martin Diehl 4a28284058 only parse geom file once 2019-02-02 09:18:01 +01:00
Martin Diehl 3d750e7933 overwriting of init did not work 2019-02-01 21:56:38 +01:00
Martin Diehl 9a4e9e62b6 using new rotation class 2019-02-01 20:28:51 +01:00
Martin Diehl 08009079ff avoiding numerical errors (if quaternion norm is > 1.)
use consistently "self" instead of "this"
function for misorientation
2019-02-01 20:27:29 +01:00
Martin Diehl feb87c7db8 same name as in the python module 2019-02-01 19:09:17 +01:00
Martin Diehl 407f94082f no need for orientation class at the moment
implement only if we need symmetry aware operations
2019-02-01 16:52:42 +01:00
Martin Diehl 8e0556fe3e [skip ci] nicer reporting 2019-02-01 12:43:14 +01:00
Martin Diehl 614a8d694c re-implement mesh reporting later on in mesh_base 2019-02-01 12:28:18 +01:00
Martin Diehl 5f8b110f63 initialize mesh and element 2019-02-01 12:24:23 +01:00
Martin Diehl b87a09a466 not needed 2019-02-01 11:22:06 +01:00
Martin Diehl 06f67ce500 orientations module was not compiled but is needed now 2019-02-01 10:24:10 +01:00
Martin Diehl 11a509970b some comments 2019-02-01 10:17:20 +01:00
Martin Diehl 9d25d677e6 using new orientation class
not sure if transpose is needed for initialization
2019-02-01 10:11:46 +01:00
Martin Diehl 53a95ea84f cleaned and documented 2019-02-01 10:01:54 +01:00
Martin Diehl 17a682e883 P/epsijk parameter has nothing to do with precision 2019-02-01 08:53:57 +01:00
Martin Diehl 8a2689da0a documentation was for a lot of things that are not in here
setting constants without truncation
2019-02-01 08:52:38 +01:00
Martin Diehl a260bd2d2b Merge branch 'development' into 10-consistent-orientation-conversions 2019-02-01 07:33:52 +01:00
Martin Diehl 721af0a9a9 plastic_nonlocal still has confusing state handling 2019-02-01 07:06:19 +01:00
Martin Diehl b9c834f86a missing use from IO 2019-01-31 17:01:26 +01:00
Martin Diehl ccb320fa6e central function for less depencies 2019-01-31 14:00:26 +01:00
Martin Diehl a3e61c82dc Merge branch 'development' into 32_NewStyleNonlocal-3 2019-01-31 12:42:35 +01:00
Martin Diehl bcd9908a88 all variables/functions were not used 2019-01-31 12:23:23 +01:00
Martin Diehl fbd8912237 Merge branch 'development' into 53-separate-mesh-for-different-solvers-3 2019-01-31 11:41:45 +01:00
Martin Diehl 6b66563be7 Merge branch '46-simplification-of-crystallite-f90-NEW5' into development 2019-01-31 11:40:23 +01:00
Martin Diehl 615b166992 removed unused stuff 2019-01-31 11:39:28 +01:00
Martin Diehl beb0ca01eb define functions where needed
only use solver specific element names
2019-01-31 11:29:56 +01:00
Martin Diehl aabd98bee9 no need to repeat the same code 2019-01-31 09:14:02 +01:00
Martin Diehl cbeb3dcff0 use the same formulation for convergence every where 2019-01-31 09:12:44 +01:00
Martin Diehl 5eaeb37ea4 just polishing 2019-01-31 06:04:49 +01:00
Martin Diehl 3b13a1af63 calculated convergence criteria wrongly 2019-01-30 17:04:58 +01:00
Martin Diehl e1c2747393 logic error for nonlocal 2019-01-30 16:06:14 +01:00
Martin Diehl fe88e5bf9c [skip ci] cleaning 2019-01-30 14:52:12 +01:00
Martin Diehl 1d88057ce4 avoid superflous variables 2019-01-30 13:24:35 +01:00
Martin Diehl 64b89484d2 logic better visible 2019-01-30 13:19:05 +01:00
Martin Diehl 39e766bba0 improved readability 2019-01-30 12:36:02 +01:00
Martin Diehl 3dd21177a0 no need to store relative residual pointwise 2019-01-30 11:28:41 +01:00
Martin Diehl fd069a96cd unifying name 2019-01-30 10:51:24 +01:00