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
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
bb6a62c475
more temperature dependent data
2022-02-13 13:49:19 +01:00
99c2f58553
ensure that data is read
2022-02-12 22:38:58 +01:00
2c05395b88
including test for new data
2022-02-12 22:30:46 +01:00
663b84641e
needed for a complete set for Sn-beta
2022-02-12 22:29:56 +01:00
80f5496ef2
adjustments and improved documentation
2022-02-12 22:20:51 +01:00
4d808335de
polishing
2022-02-12 18:55:01 +01:00
cdabdb9882
temperature-dependent thermal conductivity
2022-02-12 16:11:09 +01:00
3bdfc29fb2
Parameter set for beta-Sn
2022-02-12 15:42:39 +01:00
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
5f7a18c32d
[skip ci] updated version information after successful test of v3.0.0-alpha5-608-g3e8d1a60d
2022-02-11 01:09:25 +01:00
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
2110690ae4
Merge remote-tracking branch 'origin/development' into no-global-dot-state
2022-02-09 22:53:04 +01:00
97d17ea50c
[skip ci] updated version information after successful test of v3.0.0-alpha5-603-ge0ed668ce
2022-02-09 19:45:43 +01:00
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
bd657e6c62
fixed style and corrected copy and paste errors
2022-02-09 12:29:55 +01:00
81c141e3d3
[skip ci] updated version information after successful test of v3.0.0-alpha5-574-g13783f87f
2022-02-08 17:58:03 +01:00
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
345659b0e8
update sta file after each inc
2022-02-07 15:09:26 +01:00
e3a9adc722
not used
2022-02-07 07:20:15 +01:00
171193d0d7
[skip ci] updated version information after successful test of v3.0.0-alpha5-571-g1edc8442d
2022-02-07 00:44:17 +01:00
2a59251b1d
deprecated reporting
...
crystallite does not exist anymore, information was discretization
related
2022-02-06 22:23:21 +01:00
a37438ca29
helpful information about the parallel environment
2022-02-06 22:07:13 +01:00
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
0cf0112029
simplified
2022-02-06 15:59:46 +01:00
519ca6f990
ifort does not allow rename of already imported symbols
2022-02-05 20:00:55 +01:00
dce0ad9211
new PETSc/openMPI version
2022-02-05 18:40:10 +01:00
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
12e7922faf
use modern Fortran interface
...
not possible for HDF5...
2022-02-05 18:37:38 +01:00
f36db86b3c
better debug for gfortran, removing options not needed
2022-02-05 18:24:24 +01:00
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
ce1eb4f59e
no need to store dot state
...
saves memory and flow is easier to understand
2022-02-03 23:40:25 +01:00
a9a5c8fb73
simplify acces with pointer
...
naming will be adjusted once global deltaState is removed
2022-02-03 23:08:29 +01:00
85ca3a3f24
simplified/standardized
2022-02-03 22:57:32 +01:00
0807112a71
new tests with T_ref = 293.15K (20°C)
...
seems to be the most common choice for room temperature
2022-02-03 22:36:27 +01:00
e940a02304
[skip ci] updated version information after successful test of v3.0.0-alpha5-568-g2cb3b2cc4
2022-02-03 13:47:57 +01:00
a243e10641
Merge remote-tracking branch 'origin/development' into Fortran-polishing
2022-02-03 09:01:33 +01:00
2cb3b2cc45
not needed
2022-02-03 07:58:51 +01:00
5d55392425
Merge branch 'thermal-restart' into development
2022-02-03 07:53:05 +01:00
cf2b22b34a
does not exist for older numpy versions
2022-02-03 07:39:38 +01:00
ef390ca916
[skip ci] updated version information after successful test of v3.0.0-alpha5-556-g97f849c09
2022-02-03 03:49:37 +01:00
038cdad85e
new naming
2022-02-02 23:58:21 +01:00
d72347fe25
Merge remote-tracking branch 'origin/development' into thermal-restart
2022-02-02 23:07:32 +01:00
2a45d2d48d
private updated
2022-02-02 23:00:53 +01:00
97f849c098
Merge remote-tracking branch 'origin/typehints_rngseed' into development
2022-02-02 22:45:52 +01:00
7078b5ec87
[skip ci] updated version information after successful test of v3.0.0-alpha5-552-ga6e78c5b6
2022-02-02 22:07:12 +01:00
a6e78c5b66
Merge branch 'remove-grain-growth' into 'development'
...
grain growth not maintained and has issues
See merge request damask/DAMASK!510
2022-02-02 16:52:54 +00:00
368f4b2ed3
Merge branch '108_fix-thermalexpansion' into 'development'
...
bugix: change of behavior
See merge request damask/DAMASK!513
2022-02-02 16:45:13 +00:00
d868a240b2
bugix: change of behavior
2022-02-02 16:45:13 +00:00
Martin Diehl