Martin Diehl
9e131c0110
rank 0 takes care of statistics file
2020-02-03 23:09:46 +01:00
Martin Diehl
e9dad64f2b
use central functionality
2020-02-03 23:01:08 +01:00
Martin Diehl
7bdfd05749
simplified
2020-02-03 22:44:57 +01:00
Martin Diehl
c6579f8890
[skip ci] unified
2020-02-03 22:41:52 +01:00
Martin Diehl
1ad79883b4
not needed
2020-02-03 22:33:56 +01:00
Martin Diehl
4999f5aa4d
first steps of removing deprecated
...
use faster, pandas-based alternative 'table'
2020-02-03 21:40:10 +01:00
Martin Diehl
0ce0bb2d85
better understandable
2020-02-03 21:39:00 +01:00
Martin Diehl
54589a9c56
crystallite does not exist any more
2020-02-02 20:37:05 +01:00
Martin Diehl
8575794e47
adjust to recent changes
2020-02-02 18:54:53 +01:00
Martin Diehl
4c28e7f626
better have tests
2020-02-01 09:44:21 +01:00
Martin Diehl
588525611b
also report correctly negative seeds
2020-02-01 09:04:02 +01:00
Martin Diehl
26496976c8
not used anymore
2020-01-31 21:19:15 +01:00
Martin Diehl
0d96c728fe
better readable
2020-01-31 07:02:24 +01:00
Martin Diehl
3791c50468
better readable
2020-01-31 06:55:26 +01:00
Martin Diehl
f5f397cb70
better readable
2020-01-31 06:52:11 +01:00
Martin Diehl
6ce4ce523a
Merge branch 'MiscImprovements' of magit1.mpie.de:/damask/DAMASK into MiscImprovements
2020-01-31 00:13:25 +01:00
Martin Diehl
269d65005b
use nomenclature from the DAMASK paper
2020-01-31 00:07:23 +01:00
Martin Diehl
0b8ff64884
store mapping MARC/FEM2DAMASK mapping
...
do not calculate the mapping for elements and nodes per call on
the fly, rather store it. Not memory efficient in the case that numbers
are not consequtive (order does not matter, but missing nodes/elements
would waste some 2 integers per missing number). However, this seem to cause
problems anyway when range indicators like '1 to 10' are used.
2020-01-30 23:39:59 +01:00
Martin Diehl
d54b8714e1
avoid invalid error access
2020-01-29 23:42:50 +01:00
Martin Diehl
c2cdcb17f7
wrong string
2020-01-29 23:04:15 +01:00
Martin Diehl
59fe9d06b0
shortening
2020-01-29 22:53:19 +01:00
Martin Diehl
9690f170e1
4 space indentation
2020-01-29 22:44:42 +01:00
Martin Diehl
f5bd544b36
[skip ci] was too general
2020-01-29 18:15:49 +01:00
Martin Diehl
9fbdb6b757
[skip ci] need to follow DAMASK paper
2020-01-29 17:49:35 +01:00
Martin Diehl
4d07ab7519
prospector complained
2020-01-29 16:31:05 +01:00
Martin Diehl
9c138c87f0
not needed
2020-01-29 14:57:12 +01:00
Martin Diehl
64be6a277d
it's the surface, not the edge
2020-01-29 14:48:15 +01:00
Martin Diehl
b938f1a98d
polishing
...
* constants in CAPITALS
* more tests
* 'forall' is deprecated in Fortran 2018
2020-01-29 14:01:14 +01:00
Martin Diehl
fa39a7423b
preparing for actual use
2020-01-29 13:20:16 +01:00
Martin Diehl
348a91d503
Merge branch 'MiscImprovements' of magit1.mpie.de:/damask/DAMASK into MiscImprovements
2020-01-29 13:17:58 +01:00
Martin Diehl
3f96c12e06
avoid code duplication
2020-01-29 11:09:57 +01:00
Martin Diehl
6f467ea14e
Marc with optimization works if offloading to accelerators is disabled
2020-01-29 11:05:35 +01:00
Martin Diehl
49bfdcecab
avoid accessing non-existing chunks
...
note that Fortran does not shortcut logical expressions, hence the new
function
2020-01-29 09:13:55 +01:00
Martin Diehl
b8263519ca
ignore empty lines
2020-01-29 08:00:28 +01:00
Martin Diehl
7b0850f929
only read relevant lines
2020-01-29 00:10:05 +01:00
Martin Diehl
57db134c6d
polishing
2020-01-28 23:44:07 +01:00
Martin Diehl
ff41061759
no bare 'except'
2020-01-28 23:39:46 +01:00
Martin Diehl
fb5e57aa1a
WIP: implementing static map for Marc->DAMASK (elem/nodes)
2020-01-26 23:12:48 +01:00
Martin Diehl
d2a3fd3ac8
not needed to parse in nElem
2020-01-26 22:51:06 +01:00
Martin Diehl
f044b8c42f
explain data layout
2020-01-26 21:58:36 +01:00
Martin Diehl
0a1bac6787
flush helps to detect errors
2020-01-26 21:50:43 +01:00
Martin Diehl
f546ffb3be
polishing
2020-01-26 21:22:55 +01:00
Martin Diehl
f8c5dbea71
typo (MSC.Marc did not compile)
2020-01-26 21:02:32 +01:00
Martin Diehl
cda1f4acab
more tests
...
failed unitTests report consistently with "internal error"
2020-01-26 20:53:13 +01:00
Martin Diehl
a4134b4552
doing some internal checks
...
trivial, but better safe then sorry
2020-01-26 20:24:09 +01:00
Martin Diehl
830b05005f
read file only once
2020-01-26 19:56:30 +01:00
Martin Diehl
62865e779d
polishing
2020-01-26 18:31:56 +01:00
Martin Diehl
a6e979ae1f
simplified parsing of strings, floats, and ints
...
invalid characters for interpretation as float and int now raise error,
no warning
requesting invalid chunk now raises error, no warning
2020-01-26 18:23:23 +01:00
Martin Diehl
ea560ee167
typo
2020-01-26 15:14:16 +01:00
Martin Diehl
7e9ce183a4
better readable
2020-01-26 15:10:27 +01:00