Commit Graph

164 Commits

Author SHA1 Message Date
83ae0ad26f remove unused code 2018-06-18 17:47:59 -04:00
9dda907f7d Commit JT 060118 Changes Stan 2018-06-01 15:19:27 -06:00
1641f78e3e Merge from lammps master 2018-05-21 16:06:53 -06:00
ca6920be72 Merge pull request #907 from akohlmey/dump_maxfile
Implement 'dump_modify maxfiles' feature
2018-05-12 12:59:33 -06:00
075598b405 port dump_modify maxfiles option to COMPRESS and MPIIO package 2018-05-10 23:44:27 -04:00
1224296365 move enum{INT,DOUBLE,STRING,BIGINT}; to Dump class in dump.h 2018-05-10 01:09:04 -04:00
e4071d7f46 replace C-style include files with their C++ equivalents 2018-04-27 18:00:24 -04:00
a315599bac Commit modifs before release 1 (03/26/18) 2018-04-26 15:26:31 -06:00
9b0f8a0c55 First commit for the SPIN package.
Changes to come:
-Exchange interaction computation to check (loop on neighbors),
-Temperature/random fluctuations to correct (effects too strong),
-Physical results to check,
-Add final interactions (DMI, ME, Dipolar),
-Compute spin temperature (Nurdin and Ma formslisms),
-Work on MPI parallelization,
-Ewald sums to implement (see with Stan's pakage),
-See for prefered magnetic axis (Mitchell's idea),
2018-04-26 13:08:54 -06:00
2aef3a0e96 new dump_modify refresh and compute displace/atom refresh commands for incremental dump files 2018-03-27 14:37:04 -06:00
59dbb49cf9 remove trailing whitespace 2018-03-16 12:37:27 -04:00
ee862d8bf5 replace leading tabs 2018-03-16 12:34:33 -04:00
a069d21621 Merge pull request #476 from akohlmey/dump_custom_bugfix
dump custom memory allocation bugfix
2017-05-11 09:27:08 -06:00
328ef873d8 fix mixed memory alloc bug in dump custom. this closes #475 2017-05-10 22:41:41 -04:00
c4ac5773cb Fix segmentation fault in dump vtk 2017-05-10 19:51:14 -04:00
f8226e8ae5 NULL ptrs in dump_custom and dump_image 2016-11-07 15:56:47 +01:00
b221b15d24 NULLing ptrs in comm_brick and dump*.cpp 2016-11-07 15:50:18 +01:00
2106dce2b3 new fix halt command, other sundry small bug fixes 2016-10-18 13:11:40 -06:00
04f5eadcf1 added LAST option to dump_modify thresh, more restart info printed out to screen 2016-10-11 12:39:52 -06:00
c46be7db62 changes to imbalance weight factors 2016-10-05 10:33:39 -06:00
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
be6c086cb4 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15428 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-08-03 16:29:35 +00:00
38226b8086 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15426 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-08-03 16:09:38 +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
876b033ea8 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15083 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-05-31 16:33:07 +00:00
eb8fdc4ab6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14831 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-04-15 16:08:22 +00:00
e4ea9c0658 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14655 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-02-17 15:56:48 +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
233c6521dc git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13573 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-07-14 17:20:01 +00:00
8a517e353c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12578 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-30 22:59:27 +00:00
60b877f75f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12577 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-30 22:55:05 +00:00
fe1ade5fad git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12231 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-07-30 14:59:20 +00:00
22cecea979 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12224 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-07-29 23:26:56 +00:00
6760d0dd57 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12196 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-07-22 22:52:38 +00:00
23a05b2ddd git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12074 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-06-04 22:24:04 +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
fffe7f95b7 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11379 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-01-29 18:40:05 +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
a1ef01fc1a git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11243 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-01-14 16:17:20 +00:00
56633de3a3 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11070 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-11-26 23:02:35 +00:00
378ab5cce1 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11036 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-11-21 20:47:55 +00:00
5f9001a59d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10935 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-11-04 16:59:03 +00:00
ee61fe3043 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10891 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-10-30 14:49:31 +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
c87f384140 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9751 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-04-04 14:22:04 +00:00
bad59e0fca git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9260 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-01-11 16:21:15 +00:00
66c5617afb git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8395 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-06-25 22:03:31 +00:00