Commit Graph

131 Commits

Author SHA1 Message Date
06dcc9e283 Merge branch 'master' into improve-include-consistency
# Conflicts:
#	src/USER-MESO/atom_vec_tdpd.cpp
2019-07-09 14:50:00 -04:00
ce6fa0118a continuing to clean up include file lists 2019-07-04 08:39:17 -04:00
256531a29a put implementation header first for all remaining main folder source files 2019-07-03 19:34:13 -04:00
5e3a705911 fix bug caused by a parameter shadowing a class variable 2019-06-28 14:28:45 -04:00
fd93c27dcb make valgrind happy by fully initializing line buffer for thermo output 2019-06-17 07:35:30 -04:00
f0ec2e3279 refactoring of global and local hyper, including amended doc pages 2019-03-01 18:47:34 -07:00
d27215b7e1 enable more correct natoms computation when atoms are lost 2018-08-07 15:05:07 -06:00
d8138a5b4c move enum{IGNORE,WARN,ERROR) into Thermo class and use Thermo:: namespace to reference it 2018-05-09 18:11:31 -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
10d2e7c380 MAINT: DumpNetCDF and DumpNetCDFMPIIO need access to thermo output. 2017-06-08 23:18:54 +02:00
34dbf6b225 do not compute properties twice 2017-05-18 12:45:43 -04:00
26d71b66e4 convert bigint values for bonds/angles/dihedrals/impropers to doubles when evaluating those keywords in variable expressions 2017-05-18 12:41:48 -04:00
f871ecdc67 change to RCB cuts in load-balancing commands, also a new option for fix halt 2017-03-10 15:55:07 -07:00
3a054d1a82 Fix more typos in src files 2017-03-07 00:55:01 -05:00
639ea6c396 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15468 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-08-10 14:59:04 +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
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
e6c5898e53 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15417 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-08-01 21:11:50 +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
3297fbeb26 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15395 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-29 14:34:36 +00:00
f2f9fe0a65 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15386 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-28 13:43:23 +00:00
ddd85f006c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15369 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-27 14:04:56 +00:00
88812c44fb git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15250 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-01 23:31:09 +00:00
50ac419d3f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15159 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-06-08 23:15:55 +00:00
0bf65758e8 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14698 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-03-01 20:35:24 +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
00fc71e8b8 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14659 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-02-22 17:10:07 +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
ce59e32d1c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13937 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-08-28 20:00:56 +00:00
f7bc08d83d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13601 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-07-15 21:29:44 +00:00
e1cd500a21 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13008 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-01-30 18:51:56 +00:00
48cd742b52 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12998 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-01-28 17:19:47 +00:00
3337a367c0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12833 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-12-17 16:07:34 +00:00
a58e9a481f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12830 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-12-15 15:35:22 +00:00
d30ce3fe1f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12828 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-12-13 00:42:32 +00:00
f14e5cdce6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12714 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-11-18 00:15:46 +00:00
560ca5bb7d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12094 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-06-06 21:37:22 +00:00
45f7542271 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11892 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-05-02 16:36:53 +00:00
631aa15a32 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11781 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-04-11 23:35:35 +00:00
01abb902f1 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11121 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-12-17 14:13:09 +00:00
1949102ef9 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11007 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-11-08 20:56:32 +00:00
5d8427bc5b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10848 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-10-02 13:41:42 +00:00
62df2d920e git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10592 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-08-19 16:42:51 +00:00
8e61b4c5c0 Added density keyword
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10578 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-14 00:19:43 +00:00
db8eda0253 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9913 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-05-24 18:55:24 +00:00
e3b479a4cd git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9896 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-05-23 17:34:29 +00:00