Commit Graph

54 Commits

Author SHA1 Message Date
17f39d9d2c rename fix STORE/PERATOM to STORE/ATOM 2023-03-13 22:33:47 -04:00
2af1949a92 whitespace 2023-03-06 13:42:45 -05:00
376c7899ab add user option for performing message sorting during load balancing 2023-03-06 09:48:33 -07:00
27da716852 getting out of the insurance business :-) 2023-01-23 16:45:41 -05:00
b4118c51cc merged in current master 2022-11-04 08:22:18 -06:00
5824534ac6 use symbolic constants Comm::BRICK / Comm::TILED for Comm::style 2022-10-27 07:03:25 -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
58800b5191 enable relancing to work with distributed grids 2022-08-11 13:28:50 -06:00
6c32058728 adapt all users of FixStore to use FixStoreGlobal or FixStorePeratom 2022-08-04 11:33:14 -04:00
6506be9409 update programming style 2022-01-21 15:56:58 -05:00
a46b8688ea apply fix from balance command to fix balance 2021-09-17 22:52:58 -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
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
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
88bf503451 Merge from master 2020-04-30 08:17:05 -06:00
80311891f1 Merge pull request #1874 from akohlmey/generalize-box-change-detect
Refactor handling of box change information from fixes
2020-04-15 11:14:45 -04:00
649a8cc01a Fix typo 2020-03-14 13:57:48 +09:00
5f68f3006f replace Fix::box_change_xxx variables with Fix::box_change bitmask and add check to Domain::init()
This allows a more specific tracking of whether multiple fixes are
modifying the same box parameter and error out in that case.
2020-02-08 15:12:26 -05:00
d8ef5f6991 added internal fix dummy command to enable more control of fix ordering 2019-11-05 12:57:34 -07:00
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
6b09f6d490 bug fix for tiled communication at cutoffs near box size 2019-03-27 15:51:10 -06:00
e9bc939098 Fix more unused parameter warnings (#1076) 2018-08-23 12:22:44 -06:00
b31f0245d0 2 small bug fixes to load balancing 2018-07-11 15:55:16 -06:00
71e1867dd2 move enum{LAYOUT_UNIFORM,LAYOUT_NONUNIFORM,LAYOUT_TILED}; to Comm class 2018-05-10 00:50:20 -04:00
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
7dd60f9737 Fix typos in src files 2017-03-05 21:03:40 -05:00
02bfa898ee adjustments to balancing weights and factors, also XOR op for formulas, if, dump_modify thresh 2016-10-05 15:46:20 -06:00
43633180eb git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15651 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-09-27 15:08:34 +00:00
ba444a4c6b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15522 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-08-30 19:33:56 +00:00
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
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
3841dd58ca git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13931 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-08-21 22:55:12 +00:00
d476b251e9 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12753 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-11-20 18:16:39 +00:00
7f8f2fd3ed git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12752 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-11-20 18:02:47 +00:00
c1e12f9508 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12285 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-08-08 17:55:44 +00:00
4fbebcc31d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12240 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-08-01 21:06:10 +00:00
5ac9e9a785 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12239 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-08-01 19:15:50 +00:00
4455b66003 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12207 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-07-28 19:58:51 +00:00
1efa498803 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11980 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-05-13 15:31:29 +00:00
6c06a66ae7 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11978 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-05-13 15:23:13 +00:00
0916861315 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11777 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-04-11 14:46:49 +00:00
dda38788f7 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10300 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-07-23 16:13:20 +00:00
aa33af4032 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10160 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-06-28 19:00:58 +00:00
fe2278f1b7 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8952 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-10-12 19:45:06 +00:00
912cfaca75 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8497 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-07-25 15:15:41 +00:00