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66 Commits

Author SHA1 Message Date
Franz Roters c4e450fe34 make Marc2023.4 default and unse it for testing 2024-01-04 15:23:50 +01:00
Franz Roters 755fa7e5d8 make Marc 2023.3 the default version and use it for testing 2023-10-18 16:21:29 +02:00
Franz Roters ab41273df7 make Marc 2023.2 and use it for testing with new reference results 2023-10-18 13:56:27 +02:00
Franz Roters d8a1d28797 actually use new version 2023-07-24 17:06:07 +02:00
Philip Eisenlohr 06201da5e2 Improvements to Python docstrings 2023-02-21 15:27:06 +00:00
Martin Diehl 93e05aed29 should always point to the most recent version 2023-01-08 20:46:07 +01:00
Franz Roters bdd85a414c support for MSC.Marc 2022.2 2022-11-17 07:12:27 +00:00
d.mentock 77fa2a1d93 adjustments to patchfile required for marc2021/2022 spack packages 2022-06-15 15:48:34 +02:00
Franz Roters 087302a2a4 chnage Marc default version to 2022.1 2022-05-10 09:00:55 +02:00
Martin Diehl 7a4097d52b Marc code belongs to Marc subfolder 2022-04-24 19:03:22 +02:00
Franz Roters 727dd8936d use latest Marc version 2021-12-02 08:50:59 +01:00
Franz Roters 9132ce96f1 corrected python error 2021-11-25 17:36:41 +01:00
Franz Roters f435062a1d support for Marc2021.3.1 2021-11-25 17:30:22 +01:00
Martin Diehl adb1d4ccf9 version numbers are no floating point numbers 2021-11-24 17:29:07 +01:00
Martin Diehl 712d8d54c3 following official naming and website 
The product is MSC Marc, Mentat is just a part of it
 2021-10-19 10:08:11 +02:00
Philip Eisenlohr ad707f543b [skip ci] added quotes around second list value ("l") 2021-08-25 14:57:38 +00:00
Franz Roters 3be2fd81e9 added help on optimization levels 2021-08-25 16:10:39 +02:00
Philip Eisenlohr f61296f5c5 added help to submit_job 2021-08-25 08:56:28 -04:00
Philip Eisenlohr 4055bf9199 shortened string and path assembly 2021-08-24 15:14:39 -04:00
Franz Roters 741f81455b use newest Marc release (2021.2) 2021-07-13 16:43:23 +02:00
Franz Roters 55333f7e3e Merge branch 'no-shell-variables' into 'development' 
KISS: no shell variables

See merge request damask/DAMASK!370
 2021-04-26 15:48:58 +00:00
Philip Eisenlohr 690b478013 [skip ci] language polishing 2021-04-24 13:12:44 -04:00
Martin Diehl 95831e53f6 using improved documentation 2021-04-24 16:23:34 +02:00
Martin Diehl 6699f2ee5f don't use shell variables 
Marc solver can be controlled in python, installation can be tuned with
CLI arguments
 2021-04-22 12:02:53 +02:00
Martin Diehl 3f8bd645d8 handle the case that MSC-related variables are not set 2021-04-22 07:55:41 +02:00
Martin Diehl cfbb2d416f better example 2021-04-10 23:58:53 +02:00
Martin Diehl 1133090b6c logfile does not contain much valuable information 
Marc automatically creates .out
 2021-04-10 23:50:20 +02:00
Martin Diehl 3e8bcd3225 cleaning examples, using consistent names 
- examples in repository should only show the most basic steps
- MSC.Marc, marc => Marc
 2021-03-26 09:27:49 +01:00
Martin Diehl 6895ef6b18 always write LF line endings 
small pitfall: I windows users use a filehandle that results from a call
to open() without the newline option, they get still CRLF line endings
 2021-02-10 10:03:35 +01:00
Martin Diehl 0f6094890a simplified 
damask.environment does not offer any advantage over os.environ for
variables. After 'root_dir' was removed, the whole module became
obsolete
 2021-01-15 12:14:05 +01:00
Martin Diehl 37de561938 shell variables are more robust 
they will also work if Fortran and python code are installed in
different locations.
 2021-01-13 18:53:16 +01:00
Martin Diehl 7059e6af6e might not be in the last line 2020-11-01 18:34:52 +01:00
Martin Diehl 8224122bb9 more user friendly error handling 2020-10-31 13:16:25 +01:00
Vitesh Shah 904c338b13 Reflect version underscore of installation files 2020-10-29 15:21:40 +01:00
Vitesh Shah bd67296e8d MARC_VERSION as MSCVERSION 2020-10-22 11:50:13 +02:00
Martin Diehl 9d505c8518 better readable 
- more explicit reporting
- always relative import for DAMASK
 2020-08-24 09:58:24 +02:00
Martin Diehl 4860f9c9ce drop support for parallel marc versions 
can still be handled by the user, but is a niche use case
 2020-07-18 09:51:53 +02:00
Martin Diehl 2bbd68d964 with_suffix strips .1 from 2019.1 2020-07-16 09:33:17 +02:00
Martin Diehl 199ec51bf8 typo 2020-07-15 21:59:43 +02:00
Martin Diehl 6259984e93 simplified 
complicated, but allows to use functions as properties
 2020-07-15 20:54:37 +02:00
Philip Eisenlohr 14d3b7e66d more f-stringing 2020-06-24 16:59:55 -04:00
Martin Diehl bda555fd1c we are looking for a path, not for a file 2020-06-03 16:47:03 +02:00
Martin Diehl bb5485927e names like 2020.2 cannot be converted to int 2020-06-03 15:18:46 +02:00
Martin Diehl 5da1aa49bc string should be a Path object 2020-06-03 15:17:00 +02:00
Martin Diehl 9b04a45bbd bugfix (wrong variable name) 2020-06-03 13:53:00 +02:00
Martin Diehl 3be1a33820 easier to read 2020-06-03 13:32:47 +02:00
Martin Diehl 4decae967a nothing to inherit .. 2020-03-21 20:18:46 +01:00
Martin Diehl c6025925ac relative imports within damask package 2020-03-21 20:17:50 +01:00
Martin Diehl c5e956f386 solver submodule structure working again 2020-03-21 20:14:15 +01:00
Martin Diehl e390982be7 clean first level structure 2020-03-19 15:19:11 +01:00