Commit Graph

883 Commits

Author SHA1 Message Date
Christoph Kords e4054c116d fixed problem with gnu compiler: allocation of variables in constitutive_nonlocal_stateInit was not safe when not using any nonlocal constitution
put header of debugging output in constitutive_init at the start of the function in order to make debugging easier
2012-10-09 12:34:57 +00:00
Christoph Kords a84e0529c3 make correction of hardening coefficients thread safe 2012-10-05 16:05:51 +00:00
Christoph Kords 40a2e652e7 introduced material parameter "linetension", which indicates how strong the effect of the line tension on the hardening coefficients is 2012-10-05 14:42:41 +00:00
Christoph Kords 7cc6108a04 hardening coefficients for fcc are density dependent (line tension effect, Devincre, Kubin, Hoc; 2006; Physical analyses of crystal plasticity by DD simulations)
fixed bug with thermal annihilation producing negative density in case of very small dipole density and high climb velocity
2012-10-04 18:08:40 +00:00
Martin Diehl 80465c0b49 moved option for UTF-8 encoding to spectral interface as this is now called before prec init.
if UTF-8 encoding is needed for FEM solver (old compilers might not support it), add the same statement to the corresponding interface routine
2012-10-04 14:22:39 +00:00
Martin Diehl e2ea3cdff6 again some changes regarding creation of NaN, ieee-conforming way is not in the complilers yet. 2012-10-02 16:53:03 +00:00
Christoph Kords bce8012c89 random distribution of initial dislocation density now really independent of meshsize 2012-10-02 15:26:58 +00:00
Martin Diehl d5ce49c471 numerics got some protected statements and is now reading in the new keywords for the solver selection in small letters.
spectral solver got cut back facilities + improved output to screen
2012-10-02 15:26:56 +00:00
Christoph Kords 91b7883c2a random distribution of initial dislocation density now independent of mesh size 2012-10-02 13:35:34 +00:00
Christoph Kords 1502a71f0c added possibility to start with an initial random distribution of dislocation segments with specific overall density 2012-10-02 12:57:24 +00:00
Martin Diehl 0bcb8f59db added doxygen comments, some polishing, added "protected" statements where applicable 2012-10-02 12:53:25 +00:00
Martin Diehl 6301787df4 moved the the variable cutBack from FEsolving.f90 (where it was not used at all) to the interface routines to make responsibility of cut back control clear
PLEASE RUN setup_code.py IF YOU DO MARC SIMULATIONS, THE INTERFACE HAS CHANGED
2012-10-02 12:46:58 +00:00
Martin Diehl c8b7da432c set debug_level to be protected as it is read-only for other modules 2012-10-02 09:35:39 +00:00
Martin Diehl 4c7bcb8df9 modified formated integer output and added error number in case maximum number of cutbacks is reached 2012-10-02 09:30:13 +00:00
Franz Roters 9fc46b4950 added /echo/ statements 2012-10-02 08:12:53 +00:00
Christoph Kords b99a846503 new scaling feature in numerics (unitlength) did not scale the reference coordinates in the first place; now this is taken care of in mesh.f90, so scaling should work properly 2012-09-25 16:21:58 +00:00
Christoph Kords d0fd3c03c5 forgot to check in; belongs to rev 1762 2012-09-24 16:22:25 +00:00
Martin Diehl 912277d1ed substituted the call to the flush subroutine with the intrisic flush(6) function 2012-09-24 12:10:28 +00:00
Christoph Kords 8336d0705c new numerics parameter "unitlength" that scales the model size in DAMASK; this enables to use very small models in marc without getting any numerical problems for example with contact which does not seem to work when using very small numbers 2012-09-24 06:13:26 +00:00
Martin Diehl b587bffdd5 added some 'protected' statements to variables that shouldn't be changed by other modules 2012-09-22 16:49:41 +00:00
Krishna Komerla 8ed69170c5 corrected wrong warning complaining about FFTW string when DAMASK_NUM_THREADS undefined 2012-09-14 16:39:42 +00:00
Martin Diehl 1cfc467705 added new cut back parameter for spectral solver and instrumented variables for use with doxygen 2012-09-13 09:48:38 +00:00
Duancheng Ma b9a2890665 fixed bug in loadcase rotation: when not specifying "deg" the rotation was reset to 0,0,0..! 2012-09-06 14:05:28 +00:00
Christoph Kords 29023cea3c minor correction of debugging output 2012-09-05 11:19:46 +00:00
Pratheek Shanthraj 330d71864e fixed bug with stress BC handling 2012-09-05 08:30:15 +00:00
Christoph Kords f153866030 introduced factor to control edge contribution to multiplication;
dislocation density below a single dislocation per IP considered not significant
2012-09-04 16:56:37 +00:00
Martin Diehl 22812c9a91 some minor improvement on precision detection: checking only once (in prec and no longer in math and crystallite), added one more 4/8 switch for LAPACK, as there is no single precision FFTW, stopping compilation for spectral method if FLOAT=4
new function in IO to print integers without leading zeros, implemented it at some places in the new spectral solver (reporting still needs some serious polishing)
updated preprocessing for documentation to handle precision correctly
2012-08-30 20:26:28 +00:00
Martin Diehl 299d9e6bc4 fixed bug in seed initialization that didn't allow to redo calculations that started with a random seed. Now the whole random seed array is set to one value, previously only the first one was reported and the remaining ones were random
removed old random function used by halton
2012-08-30 14:58:30 +00:00
Christoph Kords d80b45c1d9 added relativistic correction of velocity (maximum velocity given by parameter in material.config); probability of thermal activation in velocity law not allowed to be greater than one.
output of creation rate for edge jogs now for own system, not collinear.
check for negative densities in dotState now uses absoluteToleranceRho instead of significantRho.
2012-08-30 07:33:13 +00:00
Martin Diehl 8e3b547cbd changed numerics.f90 back to the old openmp statement as this doesn't seem to cause the problem and is standard conforming
corrected typo in constitutive_j2.f90 that might cause abaqus to crash
now running 20 tests of abaqus in order to have a decent statistic about the crash behavior
improved abaqus_v6.env
2012-08-29 16:16:10 +00:00
Martin Diehl 84e3f94424 added flush for easier debugging 2012-08-29 15:23:43 +00:00
Martin Diehl d83150be1b now capturing "terminallyIll" for basic solution, should end in a automatic cutback of time steps for the spectral solver 2012-08-29 05:50:42 +00:00
Martin Diehl 3106b8ce0c corrected definition of integer type for gfortran 2012-08-29 05:19:35 +00:00
Martin Diehl d089c12947 abaqus seems to have similar problems with the openmp lib as marc (use module vs. include file), i hope this fixes the crashes 2012-08-28 19:48:38 +00:00
Martin Diehl 5e9e8497e6 new solver is now compiling without a PETSc installation, however only the plain basic solver is available then.
also removed reporting of PETSc related variables in the case it is not installed/found
2012-08-28 19:19:47 +00:00
Martin Diehl 0f64289d75 fixed bug causing trouble with ifort 11 (abaqus) 2012-08-28 19:10:54 +00:00
Martin Diehl 0959ff3299 substituted hand written matrix inversion by LAPACK version with precision selection.
also introduced check for inversion into DAMASK_spectral_Utilities.f90 for the stress BC calculation. This part is further improved by using 5% of the reference stiffness to avoid trouble in the fully plastic regime (where the stiffness is underestimated)

Test for Marc 2010 is updated because the new inversion give slightly different results near 0 (order of e-13)
2012-08-28 16:59:45 +00:00
Martin Diehl 73349d02f5 merged precision info into the file prec.f90 and removed prec_single.f90
precision information is now parsed as a makro, defined by the compiler, eg. -DFLOAT=8 for 8 byte long floats or -- in case no values is given -- for the FEM wrapper by the interface files.

Please don't forget to run setup_code.py  !!!!!!!!!!!

abaqus_v6.env is adjusted to specify the standard precision (float=8, int=4) and got some extra compilation options, some deprecated warning supressors are removed

Optional Marc modification will follow that allow automatic selection of suitable precision
2012-08-28 16:08:17 +00:00
Christoph Kords f3e7b3cec8 added separate output of dipole formation rate for edge and screw 2012-08-27 15:57:31 +00:00
Christoph Kords aa380dcb08 added separate output of dipole formation rate for edge and screw 2012-08-27 15:57:22 +00:00
Martin Diehl efd1b513cf fixed bug in divergenceFDM 2012-08-27 15:43:17 +00:00
Christoph Kords 9214da4465 added missing labels to list of available outputs 2012-08-27 12:41:57 +00:00
Martin Diehl 96ba5ecae4 moved some more 'mesh related' functions for post processing from math.f90 to mesh.f90
f2py functions remaining in math.f90 now uses assumed size arrays in order to have simpler interfaces. This is only working with python 2.7!
changed python pre- and postprocessing scripts.
If you encounter any problems whith core modules, try to remove the old core.so in the lib/damask
2012-08-27 08:04:47 +00:00
Martin Diehl 55a5112f36 added comments for doxygen documentation 2012-08-25 11:46:36 +00:00
Martin Diehl e335222bd0 added constitutive none to abaqus files 2012-08-24 19:21:39 +00:00
Martin Diehl 405c3765bd fixed bug in fiber texture component caused non-even distribution by correctly getting numbers of the halton sequence 2012-08-24 13:27:55 +00:00
Christoph Kords 3cd5fa90e8 corrected dislocation multiplication term for special case of zero density 2012-08-24 11:36:46 +00:00
Christoph Kords 4f67d04c69 new parameter "significantRho" for nonlocal constitutive law ; density below this value will hardly contribute to dislocation glide or any dislocation reaction ; old parameter "absoluteToleranceRho" is now used only for its initial purpose, namely the absolute tolerance in the state integration 2012-08-23 05:48:21 +00:00
Christoph Kords 222aed9f60 derivative of velocity with respect to resolved stress was flawed; now much better convergence of stress integration for nonlocal constitutive law 2012-08-21 14:40:01 +00:00
Christoph Kords ad7381cfdd maximum relative step length in stress integration cannot decrease below 1
intermediate tensor "A" is calculated only once before the Lp loop in "integrateStress"
2012-08-21 08:53:36 +00:00
Martin Diehl 35dffd52c1 now using spectral_quit (like old spectal solver, needed because of f2py) 2012-08-20 13:22:34 +00:00
Martin Diehl b96df9987e fixed reading/writing of integer arrays with function for real arrays 2012-08-16 14:55:23 +00:00
Martin Diehl 453c6031a7 added functions for reading values of integer data type to binary file, corrected comment on old versions which are for real (pReal) only 2012-08-16 11:57:15 +00:00
Christoph Kords b2aacf9ca4 rates in constitutive_results are taken directly from last converged step and not calculated again; added output of rates for annihilation of screws and deposition of edge jogs on collinear system 2012-08-16 11:03:22 +00:00
Christoph Kords bd754dbefd corrected debug output of evolution rates; added possibility to change the safety factor for the CFL flux condition via the material.config file; updated the example material.config due to recent changes in nonlocal constitutive 2012-08-16 09:13:38 +00:00
Martin Diehl 0434ef3daa some comments to be seen in documentation 2012-08-15 13:38:38 +00:00
Pratheek Shanthraj c2c31a0a59 added SolverBasicPETSC module to the new FFT solver (solves the basic scheme using PETSc when mysolver = basicpetsc in numerics.config)
some bug fixes
2012-08-14 16:58:23 +00:00
Christoph Kords f5e7d576f1 introduced annihilation of screw dipoles; so far no thermal activation, but immediate annihilation; each annihilated screw dipole leaves behind an edge jog of same length as the dipole height on the collinear system 2012-08-14 12:26:20 +00:00
Christoph Kords c1c5941733 stressAndItsTangent:
when winding forward to last substep in increment, also do the calculation if this substep is below "subStepMinCryst";
output of "wind forward" and "cutback" info only for crystallites that are still "todo"

integrateStress:
maximum component in Lp determines absolute convergence criterium:
aTol = max(maxLpComp * rTol_fromConfig , aTol_fromConfig)
this ensures that small values in Lp do not spoil the convergence, similar to the effect of the relevantStrain parameter before (not needed anymore in the stress integration)
2012-08-14 12:07:59 +00:00
Christoph Kords eae9a34c6b corrected debugging output: extreme values of returned stress and jacobian belong to cpfem debugging, not homogenization 2012-08-14 11:48:43 +00:00
Pratheek Shanthraj 259eb7850e more work on array ordering in new solver. (now working but not tested) 2012-08-10 17:01:58 +00:00
Martin Diehl cd0da03ebc changed comments to doxygen style 2012-08-10 15:58:17 +00:00
Krishna Komerla 08c7be7d15 adaptive regrid now working, updates F and F_lastInc based on mapping. 2012-08-10 15:48:27 +00:00
Martin Diehl b324a98014 changed order of most arrays to fortran-fast, whole new solver still work in progress 2012-08-09 13:04:56 +00:00
Martin Diehl fe4d4d9525 changed comments in prec and IO to be read by doxygen, fine tuned output of doxygen and added precompilation for documentation 2012-08-09 11:01:53 +00:00
Pratheek Shanthraj d0933dad7b added filter option to the spectral solver to mitigate spurious oscillations due to gibb's phenomenon. activate by setting myfilter in config file appropriately (currently only 'none' and 'cosine' options coded). more cleaning up of AL code 2012-08-07 17:23:13 +00:00
Pratheek Shanthraj 925915e30d some cleaning up 2012-08-07 12:02:57 +00:00
Pratheek Shanthraj 32f8c9c6ea moved petsc option string to numerics and added new numerics parameters to config file 2012-08-06 17:27:53 +00:00
Martin Diehl 93658c72db set auto values back to auto 2012-08-06 12:44:07 +00:00
Martin Diehl 7e3a837640 moved calculation and output of geometry related data to mesh.f90, moved output of command line related information to DAMASK_spectral_interface.f90.
improved new solver structure (use with make SOLVER=NEW)
2012-08-06 12:43:05 +00:00
Christoph Kords a48d180f8c allow prefactor for self-diffusion to be equal to zero 2012-08-06 09:03:33 +00:00
Pratheek Shanthraj e2a2621235 updates for AL version of spectral solver 2012-08-06 08:53:12 +00:00
Christoph Kords e8df3678aa added possibility to assign the transmissivity of grain boundaries a fixed value by use of the keyword "grainboundaryTransmissivity" in the material.config; grain boundaries are identified as interfaces between areas of different material_texture 2012-08-03 14:32:49 +00:00
Martin Diehl 948d9c03d0 new version of modular solver structure 2012-08-03 09:25:48 +00:00
Mahesh Balasubramaniam 3ffba037d4 Reading of euler angles from the loadcase corrected. 2012-08-02 17:52:07 +00:00
Mahesh Balasubramaniam 740357172a Reading of Euler angles from the loadcase corrected. 2012-08-02 17:46:50 +00:00
Martin Diehl ee1bde0cd7 enabling regridding more than once by introducing deallocation of arrays
added J2 test (stub from Taymour)
2012-07-31 15:37:49 +00:00
Martin Diehl 5a89c783d4 deallocating already allocated arrays in case of regridding/restarting (i.e. when calling init more than once) 2012-07-31 14:00:15 +00:00
Martin Diehl 991a7bbd2d reordered initialization for spectral method, corrected bug of deformation BC parsing when prescribing velocity gradient resulting in wrong average deformation 2012-07-30 15:51:48 +00:00
Martin Diehl d4163dd16f further work on modularization, basic scheme is now calculating the same results as DAMASK_spectral.f90 2012-07-30 14:06:22 +00:00
Pratheek Shanthraj c341ddd855 more modularization…. 2012-07-26 13:58:47 +00:00
Martin Diehl 4ed68bb4ae next round in modularization 2012-07-25 14:01:39 +00:00
Martin Diehl e1faad8bcf next round in modularizzation of solvers 2012-07-24 17:07:10 +00:00
Philip Eisenlohr 882c44a61d changed the majority of debugging output to level "extensive" 2012-07-24 15:29:23 +00:00
Christoph Kords 15c5131874 corrected formulation of maximum height of screw dislocation dipoles 2012-07-24 14:50:11 +00:00
Martin Diehl 9c0a161ec0 in case of regridding, undeformed configuration is written out correctly. Restart improve by reading in additional data from converged step. 2012-07-24 12:21:41 +00:00
Christoph Kords c4c00f04f4 no dipole formation by stress decrease;
dipole dissociation rate proportional to "deltaDipoleLimit / oldDipoleLimit", not "deltaDipoleLimit / newDipoleLimit"
2012-07-24 06:57:37 +00:00
Martin Diehl 3d59fec305 further modularisation of spectral solver (only for basic scheme so far) 2012-07-23 10:12:31 +00:00
Martin Diehl bd9e81fbec intermediate, not working state of new solver structure 2012-07-20 15:33:13 +00:00
Martin Diehl ad3f9d8050 removed old standalone AL solver and introduced new structure for solver zoo 2012-07-19 17:24:56 +00:00
Martin Diehl 7d4ff278cb worked on the restart capabilities 2012-07-19 14:16:59 +00:00
Martin Diehl 13caf2d389 made linear shape reconstruction working again, pretty similar results like corrected FFT reconstruction 2012-07-18 18:39:59 +00:00
Martin Diehl a22163c2ae reverted unwanted commit of Makefile 2012-07-18 12:34:46 +00:00
Martin Diehl 95d292b286 2012-07-18 12:31:07 +00:00
Philip Eisenlohr 7c6fc121fd condensed error reporting for constitutive_XYZ_init
removed erroneous check for structure>3
2012-07-17 17:36:24 +00:00
Philip Eisenlohr 0fdd43b54b minor clarification of file content and its use 2012-07-05 10:02:20 +00:00
Philip Eisenlohr 4d09ef0648 changed variable name "debug_what" to "debug_level" 2012-07-05 09:54:50 +00:00
Philip Eisenlohr b69f446caa added constitutive_none
added wrongly deleted "endif" statements
removed tmglib and refblas from linker command for lapack (Koen??)
xxxROOT is changed by setup_code unless commented-out... So had to delete '#' again.
2012-07-03 13:59:38 +00:00
Philip Eisenlohr aeb1e18268 passing of multiple make options possible now 2012-07-03 13:57:05 +00:00
Philip Eisenlohr 7f10ab0996 corrected to consistent naming: "IMKL"
restored xxxROOT to commented-out auto entries.
commented-out currently unused PETSC parts.
added "refblas" and "tmglib" to LAPACK library inclusion (seems to be necessary since 3.2.1).
2012-07-03 12:36:54 +00:00