Martin Diehl
ff1778d149
Merge branch 'development' into new-ASCII
2019-12-03 15:56:49 +01:00
Test User
e237d30e99
[skip ci] updated version information after successful test of v2.0.3-1133-gfede8225
2019-12-03 13:28:36 +01:00
Martin Diehl
62ca2952fc
polishing
2019-12-03 11:27:14 +01:00
Martin Diehl
93da6d3f63
was not used
2019-12-02 23:07:01 +01:00
Martin Diehl
c36a5bdfbb
bugfix: calculation of size of postResults was wrong
2019-12-02 23:06:28 +01:00
Martin Diehl
2969a53338
not used/needed anymore
2019-12-02 12:54:45 +01:00
Martin Diehl
fede8225bc
Merge branch 'development' into pytest
2019-12-02 12:47:37 +01:00
Martin Diehl
f85ee7d7fb
plasticity is postResults-free
2019-12-02 12:39:44 +01:00
Martin Diehl
5d524e1283
tests for nonlocal updated in PRIVATE
2019-12-02 08:55:09 +01:00
Martin Diehl
2b3b26087f
consistent names
2019-12-01 20:07:16 +01:00
Martin Diehl
05aa38cc71
using short names
2019-12-01 15:05:49 +01:00
Martin Diehl
bb152a171a
consistent naming among plasticity laws
2019-12-01 10:32:45 +01:00
Martin Diehl
1cf1da5bcc
consistent naming
2019-12-01 09:35:44 +01:00
Martin Diehl
33c090d2ac
pointers for better readability
2019-12-01 08:55:24 +01:00
Martin Diehl
afad2f2dce
short and consistent naming
2019-12-01 08:39:30 +01:00
Martin Diehl
df4b642400
polishing
2019-12-01 08:33:04 +01:00
Martin Diehl
07fb915a7e
postResults not needed anymore
2019-12-01 08:27:56 +01:00
Martin Diehl
c7d675a1e9
not needed anymore
2019-11-30 16:03:18 +01:00
Martin Diehl
d93fb12e8c
remove extra output
...
current implementation was not very general, no separation of different
dislocation types.
if output is needed, re-implemenation is straight forward
2019-11-30 14:36:54 +01:00
Martin Diehl
5a792ad09d
updated tests
2019-11-30 14:30:13 +01:00
Martin Diehl
bb75b6cf92
Merge remote-tracking branch 'origin/development' into almost-no-postResults
2019-11-30 13:45:43 +01:00
Test User
a4fdad78a4
[skip ci] updated version information after successful test of v2.0.3-1111-g374980da
2019-11-29 19:04:38 +01:00
Martin Diehl
76a1506893
small improvements
...
bugfix: writing correct labels (now consistent with readin)
error handling for inconsistent initialization
2019-11-28 20:18:54 +01:00
Martin Diehl
f2e722ed2e
polishing
2019-11-28 18:22:34 +01:00
Martin Diehl
3e65d44e07
centralized facilities for differential operations
...
note the need to reverse the grid shape in data from the ASCII table. If x is fastest,
z is slowest we require x to be the rightmost index
2019-11-28 15:46:22 +01:00
Martin Diehl
80b50f460e
cleaning
...
trying to get rid of strange re-ordering related to ASCII table data
layout
2019-11-28 10:09:22 +01:00
Martin Diehl
4c4ccfe72e
not needed
2019-11-28 06:27:19 +01:00
Martin Diehl
ca92400c2f
polishing
...
columns is the term used py pandas
2019-11-28 05:58:28 +01:00
Martin Diehl
b85049cb81
use brackets for line continuation with comments
2019-11-28 05:41:53 +01:00
Martin Diehl
98d5738fe6
Merge branch 'new-ASCII' into grid-filters
2019-11-28 05:12:36 +01:00
Martin Diehl
374980daea
Merge branch 'development' into no-crystallite
2019-11-27 13:26:47 +01:00
Martin Diehl
80002e6cfd
proper capitalization
2019-11-27 13:21:41 +01:00
Martin Diehl
9035d8d3cb
Merge branch 'development' into pytest
2019-11-27 13:18:20 +01:00
Martin Diehl
a8016d64bb
simplified
2019-11-27 12:31:32 +01:00
Martin Diehl
cee095b58e
better use centralized code
2019-11-27 12:22:28 +01:00
Martin Diehl
7d4b982c73
make information on modifications mandatory
2019-11-27 12:08:23 +01:00
Martin Diehl
76c3577378
pandas.DataFrame needs to be a 2nd order array
2019-11-27 12:03:35 +01:00
Martin Diehl
39734ef53c
alter data
...
allows to access multiple columns ('f') and individual components
('1_f')
2019-11-27 10:56:29 +01:00
Martin Diehl
96714089b1
documented and tested handling of multi-dimensional data
...
more precise regex expressions. get_array can handle individual
components
2019-11-27 09:58:58 +01:00
Martin Diehl
9ad74745c1
missing import detected by prospector
2019-11-27 08:48:41 +01:00
Martin Diehl
ab83dc2ebc
use central facilities
2019-11-27 08:45:01 +01:00
Martin Diehl
eb033e11b2
polishing
2019-11-27 08:44:38 +01:00
Martin Diehl
882a11c5f8
get labels without shape information
2019-11-27 08:43:20 +01:00
Martin Diehl
31d3958ca6
using fast new Table class
...
more a proof-of-concept since shell scripts are deprecated. The detailed
error handling of the former scripts is not implemented, i.e. the user
need to ensure that the files exist and the data has the correct shape
2019-11-26 22:59:42 +01:00
Martin Diehl
2d96136a0d
more general constructor for Table
...
reading from file is just one case (now handled by static method).
General constructor needs data and header information as dictionary.
Works only with python 3.7 where dict keeps the insertion order. Earlier
python versions/other implementations might fail.
2019-11-26 22:53:46 +01:00
Martin Diehl
5661f60552
fname seems to be the common name
2019-11-26 21:36:24 +01:00
Martin Diehl
925a4f73d6
staticmethod better suited than class method
...
a classmethod changes the class, i.e. it assigns attributes and gives
them specific values.
a staticmethod does not alter the class
https://www.geeksforgeeks.org/class-method-vs-static-method-python
2019-11-26 20:32:54 +01:00
Martin Diehl
845cfc34ec
similar logic as in geom class
...
- filename is not part of the object
- transparent handling of files, strings, and path-like objects for file
IO
2019-11-26 14:26:25 +01:00
Martin Diehl
81abc43920
Merge branch 'development' into new-ASCII
2019-11-26 10:29:05 +01:00
Martin Diehl
23f5e0fa58
filters for operations on regular grids (in fourier space)
2019-11-26 10:25:39 +01:00