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
4f0f791417
use new API, join loops, modernize
2021-10-31 17:37:43 -04:00
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
6b04ebd617
Merge branch 'master' into varargs-log-error-functions
2021-04-26 13:27:58 -04:00
e9e0bb71b6
Use varargs version of Error:all() and Error::one() where applicable
2021-04-25 21:30:51 -04:00
fe063b27c7
silence compiler warnings
2021-04-23 15:51:16 -04:00
a5563e8d04
simplify using utils::strdup()
2021-03-18 20:56:04 -04:00
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
4a40a70870
avoid overflow of timestep related computations
2020-10-01 09:48:54 -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
118c2e5be3
missed one unchecked call to ftruncate()
2019-10-19 16:36:13 -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
59dbb49cf9
remove trailing whitespace
2018-03-16 12:37:27 -04:00
beb5a30f67
new compute global/atom command, also bug fix for descending dump sorts
2016-11-30 14:01:27 -07:00
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
ce5f174281
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15414 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-08-01 20:35:57 +00:00
8e36364f5c
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14805 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-04-07 21:04:44 +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
32acf72146
Simplified non-overlap condition
...
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14287 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-05 03:32:34 +00:00
2271d9168e
Added missing normalization to vector case
...
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14283 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-04 21:56:45 +00:00
853eab8917
Fixed problem in column_length(int)
...
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14279 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-12-03 22:57:01 +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
9a878cdd67
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14128 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-10-21 18:29:37 +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
6da9e4c217
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13891 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-08-18 22:54:48 +00:00
3a3462678e
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13301 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-26 18:02:08 +00:00
69841d9e85
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13283 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-24 16:00:43 +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
ea303bbf9a
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13255 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-18 22:59:17 +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
bd1fa80867
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13230 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-03-11 15:49:44 +00:00
