Commit Graph

56 Commits

Author SHA1 Message Date
b19a211d70 update code 2021-08-18 18:06:21 -04:00
f6874af7e5 pretty 2021-08-18 18:05:36 -04:00
e08c4abb4b whitespace fixes 2021-08-18 13:06:00 -04:00
2bf9fa91db more changes to merge with current master 2021-08-17 14:03:58 -06:00
e6af1eecb8 resolved merge conflicts with master 2021-08-17 11:55:33 -06:00
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
24bf1e5b0c make use of utils::strdup() 2021-02-04 17:33:02 -05:00
4e791ac4f7 replace 'strstr(xxx,"x_") == xxx' with utils::strmatch("^x_") 2021-02-04 15:20:43 -05:00
95e2214d96 more typecasts to double to avoid 32-bit int overflows when computing memory usage 2021-02-04 14:35:38 -05:00
0b14770468 merge with current master 2021-01-11 16:13:33 -07:00
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
d1442b0538 enable per-atom custom arrays in addition to vectors 2020-09-04 11:33:49 -06:00
443cc4445e have compute property/atom output shape parameters as diameters not radii consistent with the manual 2020-07-05 16:44:44 -04:00
bddd6d5e84 update 2020-05-19 23:19:49 -04:00
fa4ef70829 code issues 2020-03-25 20:18:07 -04:00
7967cb1133 put implementation header first to avoid issues with mpi.h and lmptype.h with OpenMPI 2019-07-03 06:16:16 -04:00
ff819be807 more 'war on tabs' 2019-03-29 10:21:44 -04:00
1641f78e3e Merge from lammps master 2018-05-21 16:06:53 -06:00
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
ae5764beac added functionity to lib interface 2016-12-13 16:22:17 -07:00
083ff54c0c small bug fixes
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15527 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-08-31 20:26:15 +00:00
2993aec312 sync with Git
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15519 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-08-29 22:52:03 +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
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
1cf0407a49 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12615 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-10-07 20:49:34 +00:00
f01d9363e7 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12197 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-07-22 22:52:44 +00:00
01820feacd git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12075 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-06-04 22:30:13 +00:00
47b6b3bb41 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12073 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-06-04 22:12:23 +00:00
1b6af8196f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11775 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-04-11 14:41:25 +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
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
328cbc4db9 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10351 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-07-25 20:24:46 +00:00
0c6b84987c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9346 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-01-31 16:31:03 +00:00
4c71fc2311 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9270 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-01-14 15:56:34 +00:00
25225470db git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9138 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-12-03 15:43:15 +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
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
ca8dfd3d7c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7146 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-20 14:56:49 +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
405d127522 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6251 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-05-30 15:46:44 +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
819524ebd6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5932 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-04-13 21:40:14 +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
fbb475b9cd git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5835 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-03-25 21:13:51 +00:00
4379417aba git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5344 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-12-01 00:03:15 +00:00
5d66783527 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5343 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2010-12-01 00:01:42 +00:00