|
|
7967cb1133
|
put implementation header first to avoid issues with mpi.h and lmptype.h with OpenMPI
|
2019-07-03 06:16:16 -04:00 |
|
|
|
557a1274e4
|
even more include file cleanup
|
2019-06-28 07:09:57 -04:00 |
|
|
|
a0450fbd2b
|
fix copy-n-modify error
|
2019-02-17 18:51:15 -05:00 |
|
|
|
07c1942b13
|
update global bonus data counters after deleting atoms
|
2019-02-17 17:14:45 -05:00 |
|
|
|
4ec05a3389
|
remove some more trailing whitespace
|
2018-12-01 08:14:02 -05:00 |
|
|
|
e4071d7f46
|
replace C-style include files with their C++ equivalents
|
2018-04-27 18:00:24 -04:00 |
|
|
|
5fd17670b1
|
new reset_ids command and dump_modify delay option
|
2018-03-28 11:31:35 -06:00 |
|
|
|
6965307250
|
print warning when "compress yes" is ignored with delete_atoms
|
2018-03-13 22:58:39 -04:00 |
|
|
|
99d5957a01
|
make default argument of virtual function Neighbor::build() explicit
|
2018-02-22 08:42:36 -05:00 |
|
|
|
8d37c89cb6
|
different bug fix for create_bonds, delete_atoms neigh list issue
|
2018-01-16 11:32:37 -07:00 |
|
|
|
2896df2140
|
avoid that occasional neighbor lists requested from commands linger around for too long and thus cause segementation faults
|
2018-01-04 17:16:31 -05:00 |
|
|
|
31eb12920c
|
Use multiple inheritance to remove accelerator_kokkos.h out of region.h and kspace.h
|
2017-12-01 10:18:22 -07:00 |
|
|
|
9aa450b832
|
Merge pull request #528 from akohlmey/no_static_in_ring_comm
Refactor ring communication to no longer require static class variables
|
2017-06-15 11:13:07 -06:00 |
|
|
|
fcc387f232
|
change ring communication API to no longer require a static variable pointing to 'this' of the caller
|
2017-06-14 17:01:06 -04:00 |
|
|
|
32b967ed9c
|
add rigid body overlap warnings to change_box and delete_atoms
|
2017-06-13 16:26:49 -04:00 |
|
|
|
d9891abdf4
|
new library functions
|
2016-10-27 09:34:04 -06:00 |
|
|
|
0f71c66b6f
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15348 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2016-07-22 21:19:08 +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 |
|
|
|
916fc0f1cb
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13889 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2015-08-18 21:13:14 +00:00 |
|
|
|
106b16942e
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12970 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2015-01-20 22:26:55 +00:00 |
|
|
|
7361c8d0a3
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12966 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2015-01-20 20:26:59 +00:00 |
|
|
|
4e87fa9fd2
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12963 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2015-01-20 18:55:01 +00:00 |
|
|
|
72ac6ea854
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12956 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2015-01-19 23:43:48 +00:00 |
|
|
|
a630194311
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12941 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2015-01-15 15:15:21 +00:00 |
|
|
|
bcca087203
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12934 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2015-01-13 15:27:17 +00:00 |
|
|
|
9beaf33d86
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12891 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2015-01-06 21:58:58 +00:00 |
|
|
|
f22314495c
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12886 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2015-01-06 21:07:35 +00:00 |
|
|
|
2516600403
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12579 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2014-09-30 23:20:03 +00:00 |
|
|
|
31509b7528
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12409 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2014-09-05 15:06:29 +00:00 |
|
|
|
7872ffe797
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12157 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2014-06-27 23:28:02 +00:00 |
|
|
|
d543c0199e
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11973 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2014-05-12 22:29:09 +00:00 |
|
|
|
af5d91115f
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11875 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2014-05-02 14:28:56 +00:00 |
|
|
|
1f8353a93d
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11854 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2014-04-30 17:41:33 +00:00 |
|
|
|
0343052dc9
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11766 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2014-04-10 20:21:07 +00:00 |
|
|
|
0ce16af78b
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11328 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2014-01-25 22:46:08 +00:00 |
|
|
|
127eb167c1
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11293 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2014-01-22 17:44:32 +00:00 |
|
|
|
bad19033d0
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11250 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2014-01-17 18:43:09 +00:00 |
|
|
|
b13ebf5889
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10224 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2013-07-08 14:45:35 +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 |
|
|
|
60b9a09f77
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9901 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2013-05-23 22:45:11 +00:00 |
|
|
|
ef9e700545
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8226 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2012-06-06 22:47:51 +00:00 |
|
|
|
3450c008aa
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7850 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2012-02-28 17:29:18 +00:00 |
|
|
|
52568d2738
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7849 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2012-02-28 17:19:20 +00:00 |
|
|
|
19e8c92a90
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7003 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-09-23 18:06:55 +00:00 |
|
|
|
aedbb28b6c
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6486 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-06-30 20:10:18 +00:00 |
|
|
|
8ff0659bae
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5947 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-04-15 22:25:19 +00:00 |
|
|
|
eb7d288360
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5896 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-04-05 19:10:43 +00:00 |
|
|
|
1f2a7add78
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5836 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-03-26 00:50:29 +00:00 |
|
|
|
d51c47d9ab
|
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5705 f3b2605a-c512-4ea7-a41b-209d697bcdaa
|
2011-02-22 22:09:18 +00:00 |
|