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
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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.
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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
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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
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2016-08-08 19:41:43 +00:00
056ff192c6
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2016-08-08 13:47:55 +00:00
be6c086cb4
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2016-08-03 16:29:35 +00:00
38226b8086
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2016-08-03 16:09:38 +00:00
ce5f174281
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2016-08-01 20:35:57 +00:00
876b033ea8
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2016-05-31 16:33:07 +00:00
eb8fdc4ab6
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2016-04-15 16:08:22 +00:00
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2016-02-17 15:56:48 +00:00
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2015-10-30 20:04:06 +00:00
233c6521dc
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2015-07-14 17:20:01 +00:00
8a517e353c
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2014-09-30 22:59:27 +00:00
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2014-09-30 22:55:05 +00:00
fe1ade5fad
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2014-07-30 14:59:20 +00:00
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2014-07-29 23:26:56 +00:00
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2014-07-22 22:52:38 +00:00
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2013-11-26 23:02:35 +00:00
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2013-11-21 20:47:55 +00:00
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2013-06-28 19:00:58 +00:00
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