Commit Graph

14850 Commits

Author SHA1 Message Date
Martin Diehl ebcf0fa625 Merge remote-tracking branch 'origin/development' into homogenization-respect-fraction 2022-02-14 09:19:49 +01:00
Philip Eisenlohr 1ecbeb6924 Merge branch 'more-material-examples' into 'development'
added and curated example material.yaml files

See merge request damask/DAMASK!521
2022-02-14 05:06:54 +00:00
Test User e210a9873d [skip ci] updated version information after successful test of v3.0.0-alpha5-624-g26979da58 2022-02-14 02:21:46 +01:00
Martin Diehl bba105c2a8 re-fit, documented details 2022-02-13 18:37:34 +01:00
Sharan Roongta 26979da585 Merge branch 'nonlocal-standard-access' into 'development'
Using consistent access pattern

See merge request damask/DAMASK!520
2022-02-13 17:33:35 +00:00
Martin Diehl e3a64ae4ff don't fit close to 0K
cryogenic temperatures are normally not of interest, avoid considering
the strongly curved region below 80K in the fit gives probably better
extrapolation properties for T>300K
2022-02-13 14:57:01 +01:00
Martin Diehl ba16ea21a0 avoid overfitting
there are only 3 data points for C_13, with one close to 0K. Leave this
point out and fit only a 1st order polynomial
2022-02-13 14:48:15 +01:00
Martin Diehl bb6a62c475 more temperature dependent data 2022-02-13 13:49:19 +01:00
Martin Diehl 99c2f58553 ensure that data is read 2022-02-12 22:38:58 +01:00
Martin Diehl 2c05395b88 including test for new data 2022-02-12 22:30:46 +01:00
Martin Diehl 663b84641e needed for a complete set for Sn-beta 2022-02-12 22:29:56 +01:00
Martin Diehl 80f5496ef2 adjustments and improved documentation 2022-02-12 22:20:51 +01:00
Martin Diehl 4d808335de polishing 2022-02-12 18:55:01 +01:00
Martin Diehl cdabdb9882 temperature-dependent thermal conductivity 2022-02-12 16:11:09 +01:00
Martin Diehl 3bdfc29fb2 Parameter set for beta-Sn 2022-02-12 15:42:39 +01:00
Martin Diehl eb0fca9222 generic examples
might help some users to make the connection between old an new names,
good to have examples anyways
2022-02-12 09:08:38 +01:00
Martin Diehl b43695067d Merge remote-tracking branch 'origin/development' into nonlocal-standard-access 2022-02-11 12:53:58 +01:00
Test User 5f7a18c32d [skip ci] updated version information after successful test of v3.0.0-alpha5-608-g3e8d1a60d 2022-02-11 01:09:25 +01:00
Sharan Roongta 3e8d1a60de Merge branch 'no-global-dot-state' into 'development'
No need to store dotState

See merge request damask/DAMASK!519
2022-02-10 21:55:23 +00:00
Martin Diehl 2110690ae4 Merge remote-tracking branch 'origin/development' into no-global-dot-state 2022-02-09 22:53:04 +01:00
Test User 97d17ea50c [skip ci] updated version information after successful test of v3.0.0-alpha5-603-ge0ed668ce 2022-02-09 19:45:43 +01:00
Franz Roters e0ed668ce0 Merge branch 'Fortran-polishing' into 'development'
a number of small improvements

See merge request damask/DAMASK!516
2022-02-09 16:01:00 +00:00
Martin Diehl bd657e6c62 fixed style and corrected copy and paste errors 2022-02-09 12:29:55 +01:00
Test User 81c141e3d3 [skip ci] updated version information after successful test of v3.0.0-alpha5-574-g13783f87f 2022-02-08 17:58:03 +01:00
Philip Eisenlohr 13783f87f2 Merge branch '155_flush-mesh-sta' into 'development'
update sta file after each inc

See merge request damask/DAMASK!518
2022-02-08 13:39:23 +00:00
Martin Diehl 28eda64893 bugfix: change of behavior
fraction needed for calculation of homogenized response
2022-02-08 00:24:06 +01:00
Martin Diehl 345659b0e8 update sta file after each inc 2022-02-07 15:09:26 +01:00
Martin Diehl 739a4b7a26 need to store fraction for proper homogenization 2022-02-07 14:25:03 +01:00
Martin Diehl e3a9adc722 not used 2022-02-07 07:20:15 +01:00
Test User 171193d0d7 [skip ci] updated version information after successful test of v3.0.0-alpha5-571-g1edc8442d 2022-02-07 00:44:17 +01:00
Martin Diehl 2a59251b1d deprecated reporting
crystallite does not exist anymore, information was discretization
related
2022-02-06 22:23:21 +01:00
Martin Diehl a37438ca29 helpful information about the parallel environment 2022-02-06 22:07:13 +01:00
Martin Diehl 1edc8442d5 Merge branch 'update-libraries' into 'development'
new PETSc/openMPI version

See merge request damask/DAMASK!517
2022-02-06 20:32:02 +00:00
Martin Diehl 0cf0112029 simplified 2022-02-06 15:59:46 +01:00
Martin Diehl 9386ba5ef5 allocate not needed 2022-02-06 12:59:41 +01:00
Martin Diehl 519ca6f990 ifort does not allow rename of already imported symbols 2022-02-05 20:00:55 +01:00
Martin Diehl dce0ad9211 new PETSc/openMPI version 2022-02-05 18:40:10 +01:00
Martin Diehl 4ca0ea6af2 avoid linking issues with gfortran+MPI
most likely related to the fact that HDF5 uses the old Fortran
inferface, not MPI_f08 as DAMASK
2022-02-05 18:38:06 +01:00
Martin Diehl 12e7922faf use modern Fortran interface
not possible for HDF5...
2022-02-05 18:37:38 +01:00
Martin Diehl f36db86b3c better debug for gfortran, removing options not needed 2022-02-05 18:24:24 +01:00
Martin Diehl c25c17d0b6 reading the gcc manual
-mtune is implied by -march, -ffast-math is not recommended, and
-mtune=native is save
2022-02-05 10:57:18 +01:00
Martin Diehl 6c032e3ce6 remove deprecated mappings
almost done with having a consistent access pattern

solver
======
grid: x,y,z; mesh: el,ip

homogenization
==============
interface to solver: ce
internal: ho,en

phase
=====
interface to homogenization: co,ce
internal: ph,en
2022-02-05 10:01:55 +01:00
Martin Diehl 5f0a630fa6 remove deprecated phaseAt/phaseMemberAt 2022-02-05 08:24:07 +01:00
Martin Diehl 6d78400f87 the concept of IP/element_ID should not be used at the DAMASK core 2022-02-05 07:29:00 +01:00
Martin Diehl 3c148b5b0e bugfix: openMP variable was not protected 2022-02-04 18:55:59 +01:00
Martin Diehl 3990536f1c consistent order of arguments 2022-02-04 17:42:05 +01:00
Martin Diehl afed13e2ca ip/el not of interest 2022-02-04 13:23:37 +01:00
Martin Diehl 8aed927989 avoid use of co/ip/el at the phase level 2022-02-04 11:28:54 +01:00
Martin Diehl 3a0596a274 use en/ph access 2022-02-04 09:43:27 +01:00
Martin Diehl 2bd10a1261 avoid use of IP/el 2022-02-04 08:40:15 +01:00