46cb787934
avoid HDF5 error when creating link twice
2020-01-12 00:55:00 +01:00
5bc1c98da7
use 0-based indexing for worldrank
2020-01-12 00:49:03 +01:00
1bb94f03b8
polishing (prospector was complaining)
2020-01-12 00:21:14 +01:00
ddd8027b8a
autodetect string length
2020-01-12 00:10:42 +01:00
97ddd56540
avoid strange deformation gradients
...
otherwise, the test fails in a few cases (determinants were in the range
1e-5 to 1e16)
2020-01-11 23:44:11 +01:00
d9afdaed16
using updated tests (no crystallite anymore)
2020-01-11 23:43:03 +01:00
3938f34978
Merge branch 'MiscImprovements' into MoreImprovements
2020-01-11 22:37:41 +01:00
8f99dd85ac
[skip ci] updated version information after successful test of v2.0.3-1308-g612e8e34
2020-01-11 22:16:08 +01:00
2d9c25f8e5
Merge branch 'development' into MiscImprovements
2020-01-11 20:34:35 +01:00
d4535dadb4
use American english
2020-01-11 20:33:29 +01:00
612e8e3431
Merge branch 'quaternion-code-unification' into 'development'
...
always using intrinsic init when assigning quaternions as output variables
See merge request damask/DAMASK!116
2020-01-11 20:00:41 +01:00
300f1b7015
added options to return "natural" versions of asQ, asRodrig, and asAxisAngle
2020-01-11 11:36:22 -05:00
ac112d2d36
tolerance needed for optimized code
2020-01-11 13:55:56 +01:00
e762cb4dfd
issue with gfortran < 9
...
the false branch of merge seems to be evaluated which results in a
signaling NaN
2020-01-11 12:36:35 +01:00
842666cc20
no overlap with Marc's code
2020-01-11 11:25:50 +01:00
3a6819f548
check for invalid operations
2020-01-11 05:19:15 +01:00
f028519597
some facts from wikipedia as tests
2020-01-11 04:59:38 +01:00
de95ca5906
inverse of a quaternion
2020-01-11 04:15:51 +01:00
115716b8c2
polishing/use existing functions
2020-01-11 03:58:12 +01:00
c7180c3295
some more tests for quaternion operations
2020-01-11 03:50:17 +01:00
aefd401e8c
this is a quaternion class
...
it is meant to represent any quaternion, not only unit
quaternions/rotations that follow a specific convention. Need to check
in rotations.f90 where the homomorph should happen
2020-01-11 03:11:45 +01:00
79cafebffe
following https://www.python.org/dev/peps/pep-0257/
2020-01-11 03:08:39 +01:00
3a08a8bbe2
always using intrinsic init when assigning quaternions as output variables
2020-01-10 12:16:18 -05:00
115a2552f8
4 newer versions are out
2020-01-10 03:19:39 +01:00
87c7a5d5a3
polishing
2020-01-10 02:11:19 +01:00
8f43f05437
stronger encapsulation
2020-01-10 01:45:00 +01:00
5d2802f6c9
no patches available at the moment
2020-01-10 01:36:48 +01:00
0771411cd8
group similar operations
2020-01-10 01:33:03 +01:00
7d2012f492
no need to exclude small values
...
no danger of division by zero
2020-01-10 01:29:35 +01:00
70e23fea93
polishing
2020-01-10 01:28:32 +01:00
09f42a3991
ang files might have more columns
2020-01-08 15:34:21 +01:00
bd6f2a6b5c
consistent string length
2020-01-04 19:01:36 +01:00
6b6ad52355
use variable string as return (no need for trim)
2020-01-04 18:53:55 +01:00
3999c0b630
is not used anymore (and IO_fixedXXXvalue seem to be superfluous)
2020-01-04 17:29:25 +01:00
bd5f963260
polishing
2020-01-04 16:54:07 +01:00
6421a9db9a
require implicit none
2020-01-04 16:15:11 +01:00
0898cc2605
PGI has problems with forall in this case
2020-01-04 03:18:51 +01:00
3d32ad47db
some debug options for PGI
2020-01-04 03:13:25 +01:00
d2a9946f83
PGI compiler has problems with norm2 or dEq
2020-01-04 01:54:19 +01:00
385085de73
correct names for numpy (differ from math)
2020-01-04 01:05:40 +01:00
00e14b9861
PGI does not allow sum in init for parameter
2020-01-04 01:04:20 +01:00
e1b35be23a
not used anymore
2020-01-03 15:41:46 +01:00
e692118ec5
easier to use for single output label
2020-01-03 15:41:15 +01:00
b5e4e42505
splitext includes leading dot
2020-01-03 14:44:31 +01:00
326e3d0824
polishing
2020-01-03 14:02:14 +01:00
886e111064
not needed
2020-01-03 13:53:23 +01:00
2975e46ca1
not needed
2020-01-03 13:52:06 +01:00
4ebd89c040
shape is known (no need for automatic allocation)
2020-01-03 13:47:04 +01:00
a6ddbbd70c
cleaning
2020-01-03 12:40:25 +01:00
d81dc01ce0
we consider indvidual systems, not families
2020-01-03 12:14:20 +01:00
Martin Diehl