Commit Graph

24207 Commits

Author SHA1 Message Date
210cddd94e working on adding damping types to mdr damping 2025-04-08 18:32:45 -04:00
586d24f5ef whitespace 2025-04-07 23:02:00 -04:00
7643c901eb cleaned mdr damping and updated velocity damping for mdr use 2025-04-07 22:57:29 -04:00
ea76dc99e9 Adding damp coeff back in 2025-04-04 15:20:55 -06:00
3d4b57d7fd Removing old variable 2025-04-04 14:40:01 -06:00
30bbbafd9d Cleaning up MDR files 2025-04-04 09:57:43 -06:00
3c1ed34753 removed csv_writer.h 2025-03-31 22:16:09 -04:00
eeaf0694ad white space and comment removal 2025-03-31 22:13:29 -04:00
8ee8cb1aa3 code clean-up 2025-03-31 20:13:24 -04:00
3aafe2831b added MDR damping method 2025-03-31 20:13:24 -04:00
9d01ac2caf Stablized radius update, added WFM, added outputs 2025-03-31 20:13:24 -04:00
d515af2e2b Merge branch 'develop' into library-handle-argument-errors 2025-03-26 05:13:10 -04:00
7878ec170c Merge pull request #4501 from lammps/errors-more-cleanup
[Community Project] More Error and Warning Messages Cleanup
2025-03-25 17:52:08 -04:00
9e241df062 Merge pull request #4182 from akohlmey/group-bitmap-accessor
Refactor code to use group bitmap accessor
2025-03-25 14:12:27 -04:00
e9ac9e77db add option to return an entire column, row, or array as flat array with lammps_extract_fix() 2025-03-25 11:20:15 -04:00
7fba02f865 fix logic bug when writing coeffs to data file 2025-03-25 03:02:17 -04:00
b4ff184a0a complete refactoring of handle check and error handling 2025-03-24 17:19:31 -04:00
b45c811fbb more argument error improvements 2025-03-24 09:15:19 -04:00
7b5c281596 when calling Error we must wrap the code in BEGIN/END capture 2025-03-24 05:52:47 -04:00
350fa4ddec more library interface argument checking and error handling 2025-03-24 05:25:11 -04:00
e0322b96ec sync new library interface function across all interfaced derived packages 2025-03-24 04:33:27 -04:00
15cdba0bf0 have Error::set_show_error() return the previous setting 2025-03-24 04:13:24 -04:00
3a18ca5197 updates, recover failed tests with -DLAMMPS_BIGBIG 2025-03-23 23:17:53 -04:00
b4e4ea1069 we don't need lammps_throw_error. just call lmp->error->xxx 2025-03-23 21:23:24 -04:00
ccbf47c66d forgot exceptions in two cases 2025-03-23 19:02:10 -04:00
6fca985d5d add method that allows suppressing printing error messages immediately 2025-03-23 19:01:25 -04:00
a26ea958c6 throw suitable exception when trying to extract unknown or incompatible compute or fix data 2025-03-23 18:07:08 -04:00
3d5430bfe4 Merge branch 'develop' into errors-more-cleanup 2025-03-23 16:01:00 -04:00
1b58a4695b add explanations for "before/after simulation box is defined" errors 2025-03-21 20:30:47 -04:00
649fd86e11 add errorurl(11) with explanation to "Energy/Stess was not tallied by pair style" 2025-03-21 19:57:57 -04:00
3ab91e4e1a fix up uses of errorurl(21) 2025-03-20 23:12:21 -04:00
c037ec07a2 make utils::errorurl() point to generic page with error code 0 2025-03-20 22:45:41 -04:00
e9bc334a14 add some more missing errorurl() calls and error pointers 2025-03-20 22:45:01 -04:00
3b61bcf890 more error reporting updates 2025-03-20 12:31:08 -04:00
e4c96459e5 flag some more compatible time and out-of-bounds errors with errorurl()s 2025-03-20 06:16:59 -04:00
643afe6eff fix segfault issue for optional arguments 2025-03-19 20:28:42 -04:00
04bb57f8e2 update a bunch more error messages 2025-03-19 17:17:47 -04:00
b936673935 consolidate calls to utils::errorurl() with corresponding error class calls. 2025-03-19 02:23:10 -04:00
8a04dc036d Merge remote-tracking branch 'github/develop' into errors-more-cleanup 2025-03-19 01:39:22 -04:00
e502d40491 Merge remote-tracking branch 'github/develop' into collected-small-fixes 2025-03-17 17:40:29 -04:00
68c92f3267 add new explanation for warning about multiple time integrations 2025-03-17 12:18:32 -04:00
d42330edbd consolidate errors #6 and #7 plus handle non-numeric box. add missing entries. 2025-03-17 11:40:36 -04:00
0a7b528d39 don't silence format errors 2025-03-17 11:01:16 -04:00
afbae53a0a convert remaining errors to print coeff status 2025-03-16 06:03:23 -04:00
035aefcc26 address issues flagged by coverity scan 2025-03-15 21:38:18 -04:00
111817ce32 also print pair coeff setflag status when not all pair coeffs are set 2025-03-15 21:16:07 -04:00
b34b6b80e4 refactor info code so coeffs status can be appended to error 2025-03-15 20:11:33 -04:00
07c0c435ef Merge branch 'develop' into remove-smallsmall 2025-03-15 02:11:02 -04:00
81ab0b7504 Merge pull request #4456 from akohlmey/add-error-explanations
Add short explanations and URL to them for common errors and warnings
2025-03-14 20:18:34 -04:00
3aba21f6e2 Merge pull request #4481 from akohlmey/collected-small-fixes
Collected small fixes and changes
2025-03-14 18:10:14 -04:00