cd5407b08b
removed all math functions only for double precision by the more flexible counterpart, e.g. "dsqrt --> sqrt", "dsin --> sin". Should not cause any harm, as long as "implicit none" is used.
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Now it is possible to compile a single precision spectral solver/crystal plasticity by replacing mesh.f90 and prec.f90 with mesh_single.f90 and prec_single.f90.
For the spectral method, just call "make precision=single" instead of "make". Use "make clean" evertime you switch precision
2011-02-25 09:25:53 +00:00
2f503f5cdb
added "Lp" as crystallite output
2011-02-25 08:15:26 +00:00
e022810e66
fixed problem in internal stress calculation for periodic neighborhood
2011-02-25 08:10:11 +00:00
f525c02ded
added single precision libraries for FFTW
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First try of implement single precision crystal plasticity, not working yet.
polishing text about geometry construction.
polishing postResults, still having problems concerning machines without MSC installation
2011-02-24 18:39:57 +00:00
e49e5e13af
* in flux calculation: take care of special case for single element model
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* do not overwrite "constitutive_nonlocal_rhoDotFlux" when doing a state perturbation, so we can use it for output
2011-02-24 10:01:41 +00:00
8aef9b1c13
check for twin nodes only in direction of the surface normal. this solves a problem with models of single element thickness and periodic fluxes.
2011-02-24 09:26:30 +00:00
fed53a7e60
in subroutine "mesh_marc_get_mpieOptions": need at least one additional string after keywords "$mpie" and "periodic", not two as it used to be
2011-02-23 12:33:51 +00:00
430966eb20
sorry, forgot to commit the numerics.f90, too
2011-02-23 12:30:52 +00:00
96d3682d5e
* new global integer variable "numerics_integrationMode" (1 indicating integration of central solution, 2 indicating integration of perturbed state)
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* combined "integrator" and "integratorStiffness" in new global variable "numerics_integrator"
2011-02-23 08:29:51 +00:00
d835380bc0
* "constitutive_nonlocal_flux" is set to zero in "constitutive_nonlocal_dotState", not in "constitutive_nonlocal_microstructure"
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* dislocation flux and internal stress calculation now consistent with new definition of slip system lattice according to paper (polarity of screws inverted)
2011-02-23 08:08:06 +00:00
3c944e79fa
did some things Philip told me to do (postResults for spectral files is now working without MSC installation)
2011-02-22 16:18:47 +00:00
003b0def46
fixed a stupido error
2011-02-22 16:06:24 +00:00
333445be8b
changed meshing routine from python to fortran (f2py)
2011-02-22 16:00:22 +00:00
2dc3b35725
no need anymore for msc python interface when dealing with spectralOut files
2011-02-22 15:57:27 +00:00
8a5e28d5a6
now using fft reconstruction in 3Dvisualize, linear python code for reconstruction is removed
2011-02-21 21:03:21 +00:00
c399a06c97
tried to implement an inverse reconstruction, meaning to calculate an average deformation gradient from the 8 cornes of a node in reference and current configuration. Not working yet.
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polishing, mainly in fft reconstruction.
added fftw library file and fortran file for type specification
added folder references with literature for visualization/geometry reconstruction
2011-02-21 16:30:18 +00:00
8dd1a694a3
extended IO to cope with different name for solverJob and Model
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polishing, added error codes
added FFTW library files
2011-02-21 14:37:38 +00:00
34336bc659
fixed bug when no argument was supplied
2011-02-18 09:02:29 +00:00
b21c153761
restructured constitutive_nonlocal_compatibility and incorporated the "surfaceTransmissivity" in the compatibility calculation
2011-02-16 16:38:18 +00:00
24d33bf2ff
* added a new material parameter "surfaceTransmissivity" (default value 1.0) which allows to change the transmissivity of the material surface between 0 and 1
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* now complaining when encountering an unknown nonlocal parameter in material.config
* use same error ID for all material parameters out of bounds
* symmetric flux calculation in side dotState can now be omitted (because of new treatment of periodicity)
* switching back to "local flux balance" (add leaving and entering fluxes at central MP, don't touch neighbor) instead of "flux distribution" (subtract leaving fluxes from central MP and add them at neighboring MP). This has the advantage that there is almost no need for CRITICAL statements in parallelization, so hopefully this results in some speed up.
2011-02-16 16:35:38 +00:00
8f626c8989
Now able to have real periodicity for fluxes (fluxes leaving the model on one side enter on the other side).
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To enable this feature one has to add the following somewhere in the marc input file:
$mpie periodic x y z
for having periodicity in all directions
$mpie periodic z x
for having periodicity in x and z direction
etc.
Note that this only works for regular meshes!!!
2011-02-16 16:23:08 +00:00
89ed6f5f66
Did not compile. Fixed missing ,
2011-02-15 12:29:01 +00:00
c39e04644b
Sorting of hex slip-systems done in update 659 was missing. Included again.
2011-02-15 12:21:54 +00:00
438bf95105
added ft-based reconstruction of deformed configuration to postprocessingMath.f90 and postprocessingMath.pyf
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also added function to calculate average of tensor
some polishing in mpie_spectral.f90, added sanity check to see im resolution is power of 2
2011-02-14 17:21:31 +00:00
cdeb786721
added default path of ACML
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BLAS now also works on msuws2
2011-02-14 15:03:45 +00:00
bf2082a15b
marc run scripts now link against ACML (AMD Core Math Library) to enable use of BLAS routines
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ACML has certainly to be installed first (currently on msuws1 only) and is included for this purpose
2011-02-14 14:25:16 +00:00
874d5067c7
switches drawing of servo links temporarily off to speed up processing.
2011-02-11 11:29:58 +00:00
171f5375f1
shearrate output now with sign (no |abs| as before)
2011-02-11 10:19:41 +00:00
3d7fad6ba9
mpie_spectral.f90: changed fourier transormation, now using the advanced interface to do the tranformation both ways with just one call. now also using the same variable for pk-stress in both domains and the change of deformation gradient in both domains.
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postprocessing: renamed name of python/f2py modul from "reconstruct" to "postprocessingMath", added some numerical operations to use for postprocessing.
2011-02-09 17:47:28 +00:00
803e1a8c05
In order to help preventing further memory leaks all array sections now have an explicit instead of assumed shape, e.g. Fe(1:3,1:3) instead of Fe(:,:).
2011-02-09 13:12:46 +00:00
65ae7de42b
fixed bug for missing file name
2011-02-09 09:18:21 +00:00
466ced911e
* check convergence for nonlocals also in stiffness calculation mode
2011-02-09 08:39:07 +00:00
921967c2ba
* found memory leak in nonlocal model! "constitutive_nonlocal_rhoDotFlux" has to have upper index bound of 10 for second dimension, not 8.
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* need to recalculate dislocation velocity in postResults, otherwise we take values of last perturbed state! So the following outputs were up to now showing the perturbed state: shearrate, dislocation velocity, all density rates!
2011-02-09 08:28:47 +00:00
17a6c0e59b
enhanced comment on dislocation kinetics
2011-02-08 12:48:50 +00:00
6731659aa4
added hint that extreme values of stress and tangent belong to previous cycle
2011-02-08 12:43:30 +00:00
0a30fb739a
now reporting extreme values of stress and tangent, that were returned to marc, in output file
2011-02-08 10:25:51 +00:00
7a7ca1aab7
mpie_spectral and mpie_interface: changed workingdir from pathToLoadFile to pathToGeomFile
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mpie_spectral and numerics: added switch to prevent pre calculation of gamma_hat. slower, but saves memory
3Dvisualize: started to add support for gmsh (not fully working yet)
reconstruct: new version of f2py/Fortran subroutines for output of results from spectral method
2011-02-07 14:35:42 +00:00
faba13f7fd
* now able to introduce some scatter in the initial single dislocation density (only for nonlocal model!) ; setting the parameter "rhoSglScatter" to a positive value generates a gauss distribution for the dislocation density with standard deviation equal to "rhoSglScatter"
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* dislocation stress calculation is only done for nonlocal constitution ("/nonlocal/" keyword is present in material.config)
2011-02-04 15:41:32 +00:00
6511b4b5a2
added possibility to select predefined colorscheme from config file
2011-02-04 09:36:26 +00:00
b362755457
grain orientation shuffling was skipped for /elemhomo/. no clue why, now dropped...
2011-02-03 17:25:58 +00:00
05350d573e
fixed a bug in new --sort
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--separation option now keeps data point location as intact as meaningful after applying averaging
2011-02-01 18:32:20 +00:00
669893b397
binary \n will not longer cause problems
2011-02-01 18:25:40 +00:00
9d2b1aa942
specified line endings and activated $Id$
2011-02-01 16:43:58 +00:00
14d3d0ba99
less output but can now handle 'n/a' in data files without crashing
2011-02-01 16:43:00 +00:00
ebf201e89c
sorry---wrong file version uploaded before.
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now correct: added "--sort" option extending the existing sorting according due to "--separation". This is, for instance, useful for separating /elementhomogeneous/ results by element and later listing the results along x,y,z...
slight improvement in file-error reporting
2011-02-01 13:24:19 +00:00
958c51fc26
added "--sort" option extending the existing sorting according due to "--separation". This is, for instance, useful for separating /elementhomogeneous/ results by element and later listing the results along x,y,z...
2011-02-01 13:13:05 +00:00
d6edb64929
produce VTK visualizations from postResults files
2011-02-01 10:48:44 +00:00
fec2c14a4e
removed hard-coded tolerances from mpie_spectral and put them to numerics/IO
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removed storage of full cauchy stres field from mpie_spectral.f90, only average is stored now
added cauchy stress and von mises equivalent calculation to spectral post.
2011-01-31 17:07:42 +00:00
b72d75ed05
corrected indices in flux density output
2011-01-28 12:49:58 +00:00
0cf1404db0
changed from element 117 (hexahedral with reduced integration) to element 7 (hexahedral with full integration). one-IP elements give trouble in the ping-pong scheme by being frequently/always outdated. this is likely connected to their finite element technology such that even high stiffness values do not prevent the solver from altering displacements in subsequent cycles. remedy is to go for full integration combined with /elementhomogeneous/ phase...
2011-01-27 14:32:29 +00:00
Martin Diehl