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13 commits

Author SHA1 Message Date
Ole Schütt
3d0b1c90e6 Tests: Convert TEST_TYPES to matchers.py 2025-03-01 19:07:38 +01:00
Ole Schütt
2b6ea54d62 Format all input files 2023-12-18 22:41:19 +01:00
Juerg Hutter
b951fa5f73
Farming: rename of variables and introduction of external commands (#2649) 2023-03-06 10:38:19 +01:00
Ole Schütt
a42c4d12de do_regtest: Make reference values mandatory 2020-01-28 12:07:44 +01:00
Ole Schütt
bb17fff6cb prettify TEST_FILES files 
svn-origin-rev: 15777
 2015-08-28 11:26:53 +00:00
Matthias Krack
7c8e988d96 Remove cvs based tidy scripts. Similar svn based script clean_cwd.sh added (see cp2k/tools/). 
svn-origin-rev: 12089
 2011-12-12 15:23:26 +00:00
Teodoro Laino
1bb8aeac39 a more appropriate choice for PROJECT_NAME : use different ones unless a RESTART is 
in place.


svn-origin-rev: 10814
 2010-12-28 13:33:01 +00:00
Teodoro Laino
45df9de802 fix more deps for new regtester 
svn-origin-rev: 10789
 2010-12-22 12:08:24 +00:00
Teodoro Laino
22d810e1bd allow FARMING to have a restart file name depending on the project name of 
input driven. Added a &RESTART print_key section and a RESTART_FILE_NAME keyword.
Moved RESTART logical flag to DO_RESTART.


svn-origin-rev: 10784
 2010-12-22 08:13:21 +00:00
Joost VandeVondele
92e42c992f all for using an OUTPUT_FILE_NAME when farming 
svn-origin-rev: 9726
 2010-04-02 11:50:26 +00:00
Teodoro Laino
2154ba256c clening cell type (removing everything connected with units), removing UNIT keyword 
from CELL and defining instead units for A,B,C and ABC keywords. Added two more keywords
in COORD sections to have an additional and disentangled control of the units for
coordinates (UNIT and SCALEDi, in &COORD). Updating the whole bunch of regtests and
resetting 9 for numerics (due to the new conversion tools). Several cosmetics.
Moreover, this commit introduces the possibility to have units also for output quantities.
At the moment this keyword is supported only for a minor set of print_keys (essentially
the ones that were depending on the unit_of_length of cell). More work to do on this
topic in the future.


svn-origin-rev: 7967
 2008-11-25 10:57:52 +00:00
Joost VandeVondele
88469b16c2 adding input files 
svn-origin-rev: 6391
 2007-09-28 15:06:02 +00:00
Joost VandeVondele
c1cfd7176f add a master-slave mode for doing farming. 
This improves load balance in the case where jobs of unequal lenght are being processed.
Allow for dependencies between jobs in a farming run.


svn-origin-rev: 6390
 2007-09-28 13:44:15 +00:00