2132b1d904
update developer reference text
2022-10-24 11:08:26 -04:00
cccf3f6f78
change email for contacting LAMMPS developers, add to homepage checker
2022-10-20 20:36:03 -04:00
deb694745b
update neighbor list requests with default settings
2022-03-08 06:34:27 -05:00
c5c3c335c9
enable clang-format
2022-03-05 20:16:10 -05:00
875560b827
use new neighbor list request API
2022-03-05 20:15:48 -05:00
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
2426e6245d
move static constants in pair style out of the globally included header
2020-12-17 14:03:15 -05:00
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
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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
6113169a47
IWYU based include statement cleanup
2020-09-02 17:39:34 -04:00
96d8d12a88
replace calls to force->*numeric() with the corresponding utils::*numeric()
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this also removes the now obsolete functions from Force
2020-08-29 20:31:02 -04:00
fcd0b9f78f
move Force::bounds() and Force::boundsbig() to utils.
2020-08-29 18:23:03 -04:00
eb91c6feb6
correct data file output format for ZBL style. update reference output.
2020-08-01 14:43:14 -04:00
68d5d74fd3
add restart and data file handling to pair style zbl
2020-06-23 08:55:47 -04:00
b9d989769d
pair style zbl does not have restart support
2020-06-23 08:26:55 -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
06a57dd659
use ev_unset for all pair styles
2019-03-13 17:49:16 +01:00
e9bc939098
Fix more unused parameter warnings ( #1076 )
2018-08-23 12:22:44 -06:00
e4071d7f46
replace C-style include files with their C++ equivalents
2018-04-27 18:00:24 -04:00
ee862d8bf5
replace leading tabs
2018-03-16 12:34:33 -04:00
275c08453f
Add Kokkos versions of pair_style snap and zbl
2018-01-09 17:03:49 -07:00
35753b8f08
add error location propagation to force->bounds() and force->boundsbig()
2016-10-26 15:53:02 -04:00
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
fe3c6670f6
Modifed ZBL to accomodate mixing
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14047 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-09-23 00:30:30 +00:00
2f55b6da36
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13903 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-08-19 14:55:57 +00:00
4a975dd8cf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12957 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-01-19 23:49:20 +00:00
0680636555
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10804 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-09-18 14:05:57 +00:00
d11d8a4acb
Extended to cover all units styles
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10798 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-09-17 19:09:29 +00:00
fe7ae37d52
Switched econv to use qqr2e
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10794 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-09-17 17:34:09 +00:00
210045f4a5
Added pair style ZBL
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10790 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-09-16 23:02:26 +00:00
