c95d43f647
plug memory leaks
2025-03-26 04:16:54 -04:00
3b61bcf890
more error reporting updates
2025-03-20 12:31:08 -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
1d3b93b042
Add type first option to fix ave/correlate
2025-03-11 20:54:38 +10:00
ac21f24013
update fix ave/correlate for new error message features
2025-01-31 07:32:05 -05:00
e4dbfee498
replace fmt::print() with utils::print()
2025-01-23 00:11:31 -05:00
c45f2666ad
clean-up whitespace
2024-04-04 14:21:55 -06:00
66d042a0ee
make checks for exceeding length of variable-length vectors more consistent
2024-04-04 14:11:13 -06:00
9c85e5a99b
fix bug in option arg parsing of fix ave/correlate, also update doc page for fix ave/correlate/long
2024-03-29 14:27:43 -06:00
d96bfcdf06
Merge branch 'develop' into refactor-testing
2022-10-24 20:07:58 -04:00
2132b1d904
update developer reference text
2022-10-24 11:08:26 -04:00
cccf3f6f78
change email for contacting LAMMPS developers, add to homepage checker
2022-10-20 20:36:03 -04:00
299281b0e2
whitespace
2022-10-16 11:53:55 -04:00
ec121ab812
convert fix ave/correlate and fix ave/correlate/long
2022-10-16 11:47:11 -04:00
c4729b39b4
replace more uses of XXXINT_FORMAT with fmtlib
2022-03-30 13:53:25 -04:00
146c6fe5ff
remove check that is no longer needed
2021-12-09 18:08:43 -05:00
facb49fc27
disallow reset_timestep for time averaging fixes
2021-12-09 15:09:42 -05:00
7cdd82dee2
use platform functions for averaging fixes
2021-10-04 18:13:46 -04:00
09c19a936b
update URLs in source code and manual
2021-05-24 14:18:20 -04:00
d1941392d3
disable clang-format for all existing .cpp files (for now)
2021-05-05 23:53:38 -04:00
e9e0bb71b6
Use varargs version of Error:all() and Error::one() where applicable
2021-04-25 21:30:51 -04:00
a5563e8d04
simplify using utils::strdup()
2021-03-18 20:56:04 -04:00
d2b3677d6f
whitespace fixes
2021-02-08 21:45:58 -05:00
2f7d6672df
more files with ArgInfo support added
2021-02-03 16:39:01 -05:00
48f15e485d
put consistent definition of INVOKED_* constants as enumerator into compute.h
2021-01-31 20:13:47 -05:00
adf74b3a22
use https://lammps.sandia.gov based URLs consistently
2020-10-21 16:45:30 -04:00
f1ef7d85a8
T2345: Replace instances of NULL with nullptr
...
The following changes have been applied to src and lib folders:
regex replace: ([^"_])NULL ⇒ \1nullptr (8968 chgs in src, 1153 in lib)
Manually find/change: (void \*) nullptr ⇒ nullptr (1 case)
regex find: ".*?nullptr.*?"
Manually ~14 cases back to "NULL" in src, ~2 in lib
regex finds a few false positive where nullptr appears between two
strings in a function call
2020-09-12 09:34:38 -06:00
f88f4cd60e
more include file updates
2020-09-02 21:44:04 -04:00
6113169a47
IWYU based include statement cleanup
2020-09-02 17:39:34 -04:00
96d8d12a88
replace calls to force->*numeric() with the corresponding utils::*numeric()
...
this also removes the now obsolete functions from Force
2020-08-29 20:31:02 -04:00
741a1d1fc9
move Input::expand_args() to utils::expand_args()
2020-08-29 18:32:10 -04:00
2777d37a61
remove local buffers and snprintf() for file open error messages.
2020-06-04 13:30:44 -04:00
bf537dedf5
check status of ftruncate() in ave/* fixes
2019-10-19 10:49:05 -04:00
7967cb1133
put implementation header first to avoid issues with mpi.h and lmptype.h with OpenMPI
2019-07-03 06:16:16 -04:00
31cbccda85
continue cleaning up include file lists
2019-06-29 09:37:44 -04:00
ca04e8f31c
use snprintf() in a bunch of cases to avoid overflowing fixed size buffers with unchecked strings
2018-09-06 02:57:53 -04:00
e9bc939098
Fix more unused parameter warnings ( #1076 )
2018-08-23 12:22:44 -06:00
e4071d7f46
replace C-style include files with their C++ equivalents
2018-04-27 18:00:24 -04:00
958e3e6a80
sync with Git
...
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15520 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-08-29 23:49:20 +00:00
6c8d3ed4e8
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15463 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-08-09 14:10:55 +00:00
550be1d512
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15462 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-08-08 19:41:43 +00:00
056ff192c6
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15459 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-08-08 13:47:55 +00:00
98aee05152
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15418 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-08-01 21:30:11 +00:00
d1a65e5f6a
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14696 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-03-01 18:22:28 +00:00
354e20f431
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14220 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-10-30 20:04:06 +00:00
047be536bc
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13983 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-09-02 20:39:55 +00:00
25b928b276
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13282 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-24 15:34:07 +00:00
4c2103f695
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13253 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-18 21:54:52 +00:00
d3a7ef6598
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13088 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-02-10 16:18:21 +00:00
