61b8619f07
let dump_modify types numeric revert labels
2024-05-30 11:34:41 -04:00
3b091c0bd4
type label support for dump xyz
2024-05-21 19:35:04 -04:00
6442e05988
even more define to static constexpr conversions
2024-01-25 02:17:28 -05:00
12422ff510
replace defines with static constexpr declarations
2024-01-21 15:53:35 -05:00
fcc3c99e2b
avoid segfaults if a dump is created and followed by run pre no
2023-06-20 13:31:16 -04:00
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
74f2b67b1a
no if statement required before delete[]
2022-04-10 19:55:24 -04:00
b64e90dfe0
simplify. avoid XXXINT_FORMAT macros
2022-03-30 23:43:28 -04:00
b7dba37e2e
Merge branch 'time-dumps2' of github.com:lammps/lammps into time-dumps2
2021-12-23 14:34:00 -05:00
6a442e1df4
use compute_time() func in xyz output
2021-12-21 14:05:16 -07:00
6f6b384c55
Merge branch 'time-dumps2' of github.com:lammps/lammps into time-dumps2
...
# Conflicts:
# src/dump_xyz.cpp
2021-12-21 15:56:19 -05:00
cc4d7215f1
simplify. only output absolute time during MD.
2021-12-21 14:37:34 -05:00
576e787839
make xyz dumps print out current simulation time
2021-12-21 12:18:26 -07:00
ded48cc031
more optimizations and extend to other dump styles
2021-12-21 10:57:42 -07:00
6f87b1236a
cosmetic
2021-09-25 10:42:52 -04:00
53e773e438
calling fwrite() with a null pointer causes undefined behavior. avoid it.
2021-09-25 10:18:55 -04:00
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
1f50557b38
Adopt utils::strdup in dump styles
2021-03-19 15:34:43 -04:00
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
7967cb1133
put implementation header first to avoid issues with mpi.h and lmptype.h with OpenMPI
2019-07-03 06:16:16 -04:00
31cbccda85
continue cleaning up include file lists
2019-06-29 09:37:44 -04:00
e4071d7f46
replace C-style include files with their C++ equivalents
2018-04-27 18:00:24 -04:00
b221b15d24
NULLing ptrs in comm_brick and dump*.cpp
2016-11-07 15:50:18 +01:00
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
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
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
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
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
144f2f2fd6
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8159 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-05-23 15:51:56 +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
d5b494397e
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5547 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2011-01-14 15:53:06 +00:00
140cdf9485
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5504 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2011-01-07 21:42:19 +00:00
ded8b22c19
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4795 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2010-09-15 22:16:20 +00:00
31e51f9834
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3993 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2010-04-14 15:02:39 +00:00
4900c3d0c0
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3598 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2009-12-21 21:21:22 +00:00
799775274d
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3150 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2009-09-04 19:39:53 +00:00
cfe0d02a30
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1723 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2008-04-08 13:58:15 +00:00
aef3f32236
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@951 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2007-10-04 17:57:04 +00:00
9be7620ace
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@937 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2007-10-03 16:22:30 +00:00
209f169cbc
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@254 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2007-01-30 00:22:05 +00:00
222c95507e
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@26 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2006-09-27 19:51:33 +00:00
