71f13cee9d
add missing aspherical particle info to restart files
2020-07-09 11:21:59 -04:00
04d7eacc2f
remove .c_str() in several places because it is no longer neede
2020-06-05 16:40:48 -04:00
f547d66104
Merge branch 'master' into more-fmtlib-and-string
...
# Conflicts:
# src/write_restart.cpp
2020-06-05 11:13:44 -04:00
ad76f5267b
whitespace fix
2020-06-05 08:54:41 -04:00
8ed32f95b3
simplify writing restarts a bit more
2020-06-05 07:31:39 -04:00
439eee3b86
get rid of BIGINT_FORMAT and use std::string.replace() to expand time step in data and restart file names
2020-06-04 21:38:00 -04:00
54a8b4e08b
more local buffers removed and file error status added.
2020-06-04 20:14:19 -04:00
3e36acc533
Merge branch 'master' into restart-consistency
...
# Conflicts:
# doc/src/fix_halt.rst
2020-03-18 20:30:00 -04:00
649a8cc01a
Fix typo
2020-03-14 13:57:48 +09:00
6fb42a42b8
check for I/O error before closing restart file
2020-03-09 17:42:00 -04:00
860e67873c
rename lmp_restart.h to lmprestart.h to avoid confusing it with lmp_<machine> files
2020-01-31 11:18:08 -05:00
c021a2d185
multiple consistency improvements for restart files
...
- make defines and enumerators automatically consistent by moving them to a shared header file
- change VERSION_NUMERIC to FORMAT_REVISION (and corresponding function names)
- new class member revision in ReadRestart class to allow backward compatibility
- step current FORMAT_REVISION to 1
- write the magic string a the end of each restart
- add a check, that skips to the end of a file and checks for the magic string and then returns
but do this only if FORMAT_REVISION is 1 or larger for backward compatibility
2020-01-31 10:49:59 -05:00
03418be645
minor tweaks to already processed files
2019-07-08 16:22:55 -04:00
256531a29a
put implementation header first for all remaining main folder source files
2019-07-03 19:34:13 -04:00
17853aef20
modify restart changes, so it stays backward compatible and does not result in unexpected behavior when reading old restarts. also use consistent naming conventions for enum entries
2018-10-05 09:47:47 +02:00
7f8302b65b
replace extra_special with maxspecial in restarts
2018-10-04 22:08:43 -06:00
4d52cb9245
more buffer overflow avoiding through using snprintf()
2018-09-06 09:57:43 -04:00
783839e985
add support for restarting extra/XXX/per/atom settings in binary restarts
2018-07-16 15:21:52 -04:00
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
c2c49395bd
write the name of a pair style to the restart even if it does not store data
2018-03-19 18:00:48 -04:00
3bc1c6b59e
Address bug in multifile restart writing with step number included
2018-02-01 14:25:55 +01:00
04ebd81ac5
minor whitespace cleanup
2017-06-06 17:26:18 -04:00
49dd9449b8
fix gcmc updates from Aidan, trimming of output for replica commands
2017-04-11 08:35:09 -06:00
579b61641e
Fixing restart error
...
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14893 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-04-26 23:00:32 +00:00
f70a764d5c
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14860 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-04-22 15:55:54 +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
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
050244f229
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13510 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-07-02 14:26:05 +00:00
1091ba1131
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13069 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2015-02-06 16:19:34 +00:00
aeb7fec23a
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12814 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-12-02 02:15:39 +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
a59a131024
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12017 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-05-22 14:38:26 +00:00
3d6ac732ad
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11616 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-03-10 15:45:25 +00:00
3f3e996939
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11389 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-01-30 17:42:09 +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
7932bcc79b
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11289 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-01-22 15:31:45 +00:00
fee9812c99
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11246 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2014-01-15 15:38:00 +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
bbc1eae436
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11107 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-12-11 15:27:42 +00:00
e797f74615
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11102 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-12-06 23:24:24 +00:00
a4c075eacf
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11100 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-12-06 23:19:33 +00:00
6bfbfa78f4
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11095 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-12-06 22:32:32 +00:00
17669c6275
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11090 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-12-05 22:49:45 +00:00
5ad6f286a8
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10628 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-21 17:34:16 +00:00
7511965094
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10626 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-21 17:22:55 +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
a8af5ea42f
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8306 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-06-18 23:03:41 +00:00
eed35157e7
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8292 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-06-14 23:20:23 +00:00
