Martin Diehl
1871dcd75a
small polishing
2022-02-01 09:03:39 +01:00
Martin Diehl
08d3e22bcd
size is known
2022-02-01 08:35:00 +01:00
Martin Diehl
a673abb413
indicate that this mapping should be used only for C
2022-01-30 06:24:50 +01:00
Martin Diehl
f70df11b67
consistent reporting
2022-01-29 15:59:22 +01:00
Martin Diehl
762f93d724
following naming convention
2022-01-29 15:30:59 +01:00
Martin Diehl
487912cfb0
following Python notation
2022-01-29 15:14:40 +01:00
Martin Diehl
477f2d8167
capitalize constants
2022-01-29 14:49:45 +01:00
Martin Diehl
774ec4e8c4
not used
2022-01-29 14:47:14 +01:00
Martin Diehl
dd0f2cfa3c
tau is often easier to use than pi
...
https://tauday.com/tau-manifesto
2022-01-29 14:46:09 +01:00
Martin Diehl
4a84c42112
improving constants
...
IUPAC does not specify an official ambient temperature, T=273.15K from
standard temperature and pressure (STP) is not particularly suited for our
purposes
2022-01-29 13:49:41 +01:00
Martin Diehl
c5fd467b44
power to one not needed
2022-01-26 21:47:33 +01:00
Franz Roters
e7a999ffb1
Merge branch '146_grid-indexing+allocation' into 'development'
...
avoid duplicated variables + name adjustments
See merge request damask/DAMASK!505
2022-01-26 14:52:43 +00:00
Martin Diehl
68ea33c591
start at 1 for the same loop pattern
2022-01-26 12:21:08 +01:00
Martin Diehl
a86dc322fb
consistently put the check on the next line
2022-01-26 12:18:26 +01:00
Martin Diehl
f1051ec28f
polishing
2022-01-21 23:34:42 +00:00
Martin Diehl
96fed368ad
name adjustments
2022-01-21 14:51:46 +01:00
Martin Diehl
bc1b391449
Merge remote-tracking branch 'origin/development' into 146_grid-indexing+allocation
2022-01-21 07:23:24 +01:00
Sharan Roongta
c2a822d8fd
keys() function for dictionary as in Python.
...
Does not work for gfortran which fails with an ICE.
2022-01-20 23:45:47 +00:00
Martin Diehl
292cbdee30
consistent name
2022-01-20 14:56:21 +01:00
Martin Diehl
7bd8452bf8
set return value
2022-01-20 07:56:45 +01:00
Martin Diehl
7b1080fdb7
better and consistent variable name
2022-01-20 07:42:16 +01:00
Martin Diehl
1f86111f57
call SNESSetDM after DMDASNESSetFunctionLocal
...
following example ex5f.F90, seems to resolve segmentation fault
2022-01-19 22:57:22 +01:00
Martin Diehl
fe094939e6
better to understand
2022-01-19 19:43:54 +01:00
Martin Diehl
0f4f2b6717
use only grid, not (x/y/z) start and end
2022-01-19 19:38:07 +01:00
Martin Diehl
89cb018189
polishing
2022-01-19 18:58:46 +01:00
Martin Diehl
3d6dcad385
Merge remote-tracking branch 'origin/thermal-solver-improvements' into 146_grid-indexing+allocation
2022-01-19 18:50:55 +01:00
Martin Diehl
25ddec76e7
avoid (x/y/z)end and (x/y/z)start, same information is in grid
2022-01-19 17:41:16 +01:00
Martin Diehl
96ff3314a3
simplified
2022-01-19 17:10:47 +01:00
Martin Diehl
642df40634
one-based counting
2022-01-19 16:56:54 +01:00
Sharan Roongta
1ad537b60c
better to use global grid dimensions
...
also checking early allocation of Temperature field
2022-01-19 16:54:10 +01:00
Martin Diehl
b18483cc6e
simplify MPI debugging
...
needs manual modification in the source code
2022-01-19 16:45:14 +01:00
Martin Diehl
869fdc847a
Merge branch 'development' into misc-improvements
2022-01-18 11:02:18 +01:00
Martin Diehl
c5fd6a3677
random seed should contain some entropy
...
setting all elements to the same value does not make sense. Moreover,
negative values are allowed
2022-01-18 10:47:26 +01:00
Philip Eisenlohr
8b5122f52a
Merge branch 'physics-based-hex-interactions' into 'development'
...
Physics based hex interactions
See merge request damask/DAMASK!495
2022-01-17 15:24:05 +00:00
Sharan Roongta
40ee4d3dd1
Merge branch 'petsc-64bit-integer' into 'development'
...
support for PETSc with 64bit integers
See merge request damask/DAMASK!496
2022-01-17 09:16:39 +00:00
Franz Roters
1d2bbc8cd9
Merge branch 'dislotwin-fix-tangent' into 'development'
...
corrected tangent calculation for twinning and transformation
See merge request damask/DAMASK!492
2022-01-17 07:57:51 +00:00
Martin Diehl
a37178ddee
handle case of -0.0
...
-0.0 < 0.0 ! false
so need sign to change direction for also for the corner case of -0.0
2022-01-15 12:28:39 +01:00
Martin Diehl
d1cd125a5b
direct array reversal, don't duplicate FFTW manual
2022-01-15 12:27:07 +01:00
Philip Eisenlohr
2c054f2b38
use same hex-hex interaction documentation as webpage
2022-01-13 11:23:09 -05:00
Philip Eisenlohr
45e33782e4
documentating more hex interactions
2022-01-13 10:42:05 -05:00
Martin Diehl
82dabe29c1
mesh: separate kind for DAMASK and PETSc integers
2022-01-13 16:30:42 +01:00
Philip Eisenlohr
4562f4262c
add documentation to source code
2022-01-13 10:14:36 -05:00
Martin Diehl
29530da579
use correct kind of constants for calls to MPI/PETSc
2022-01-13 13:50:30 +01:00
Martin Diehl
91a3ea96ec
final MPI-DAMASK integer kind decoupling
...
bugfix: set error for openMP-calucations
2022-01-13 13:21:44 +01:00
Martin Diehl
d7dbb6ffc2
needs to be public for Marc
2022-01-13 12:03:22 +01:00
Martin Diehl
a7417a7ad7
default integer, PETSc integer, and MPI integer might be different
2022-01-13 12:02:33 +01:00
Martin Diehl
a3a3388855
decouple DAMASK default integer from MPI default integer
2022-01-13 10:25:45 +01:00
Martin Diehl
1c46e7ea1a
not needed
2022-01-13 08:30:46 +01:00
Martin Diehl
8223dc7fa7
polishing
...
MPI, HDF5, PETSc, and DAMASK might have different integer kinds ..
2022-01-13 08:17:31 +01:00
Martin Diehl
3fb5bd459c
pInt leftovers
2022-01-13 07:44:15 +01:00