Commit Graph

28151 Commits

Author SHA1 Message Date
6f2076a9b8 update docs 2021-10-05 22:11:19 -04:00
b2c4f08bbc use C++11 functionality to determine wall time 2021-10-05 21:52:52 -04:00
fcdabe0002 implement a platform neutral usleep() using C++11 2021-10-05 17:58:27 -04:00
528050aa08 use platform namespace to delete file 2021-10-05 17:57:38 -04:00
e3e82df995 port "embedded" shell commands to use platform functions 2021-10-05 16:36:06 -04:00
5128eb7b43 port read/write_restart to use the platform namespace 2021-10-05 16:35:37 -04:00
af070aa351 add support for seeking to the end of a file 2021-10-05 15:44:58 -04:00
741cf9c7d5 remove obsoleted include statements 2021-10-05 07:36:22 -04:00
0bdc6d47e0 port molfile plugin reader to platform namespace 2021-10-04 22:56:23 -04:00
ee594a879b make use of platform::putenv() 2021-10-04 22:39:43 -04:00
40f683c1a7 use platform functions to handle piping help output to a pager when on a console 2021-10-04 18:14:21 -04:00
7cdd82dee2 use platform functions for averaging fixes 2021-10-04 18:13:46 -04:00
dd2b5b22d4 fix saed/vtk does not use the overwrite option anywhere 2021-10-04 17:22:58 -04:00
485796f387 Merge branch 'master' into platform-namespace 2021-10-04 15:19:12 -04:00
ab51c1bd3d Merge pull request #2977 from akohlmey/collected-small-changes
Collected small changes
2021-10-04 11:07:03 -07:00
c6a15064b3 Merge pull request #2976 from stanmoore1/update_gitignore
Update .gitignore file in /src
2021-10-04 10:10:23 -07:00
6e54295b38 pre-built singularity images have been removed due to lack of interest 2021-10-04 11:34:28 -04:00
9d96e10048 silence compiler warning 2021-10-04 07:32:25 -04:00
dc2453a22b silence some compiler warnings 2021-10-04 06:56:13 -04:00
5246cedda6 Fix misplaced MPI calls bug in pair style drip 2021-10-04 06:50:38 -04:00
203b779622 also update eigen download for traditional build 2021-10-02 23:17:08 -04:00
45ea2b0431 update eigen3 to the latest release and move download to our own server 2021-10-02 22:52:03 -04:00
03f7bf6649 update eigen3 to the latest release and move download to our own server 2021-10-02 22:44:29 -04:00
c341c2c6a9 correct platform call in kim query command 2021-10-02 20:00:53 -04:00
7110e1c15e small format tweaks
- brief description should not end in a dot as it becomes a title line
- add empty line to separate title from body of description
- revert order of file/path separator constants so that the Linux version shows up in doxygen
2021-10-02 18:28:33 -04:00
a6aa3fd3ee apply clang-format 2021-10-02 18:26:46 -04:00
69a8dfe4d9 whitespace 2021-10-02 18:12:32 -04:00
dcaed72b6d update embedded docs 2021-10-02 17:29:21 -04:00
c6bdab8b4c disable optimization of cputime function for MSVC++ to avoid bogus 0s reports 2021-10-02 17:29:05 -04:00
2dcaa47b0e unfreeze versions of python packages used to build the documentation 2021-10-02 16:55:19 -04:00
37bfe3d0ce integrate platform sub-namespace into source code and documentation
this updates function calls to functions that have been moved from
the utils namepsace or the Info class to platform::
2021-10-02 16:55:11 -04:00
373dbcd9ae fix typo 2021-10-02 16:40:05 -04:00
35bef7b1d3 unfreeze versions of python packages used to build the documentation 2021-10-02 16:32:58 -04:00
195fe81c60 correct test for loading shared objects and libraries 2021-10-01 23:52:02 -04:00
a8193f42b8 Merge branch 'master' into platform-namespace 2021-10-01 21:58:52 -04:00
0cbf70a385 make compatible with C 2021-10-01 15:24:59 -04:00
60c6669d68 Remove lammpsplugin.h from .gitignore 2021-10-01 13:21:42 -06:00
cf06620538 raise the C++ standard to be at least C++14 when Kokkos is enabled.
This still allows to request a later standard for as long as it is C++14 or later
2021-10-01 15:16:40 -04:00
139dfd89e2 for improved C++20 compatibility 2021-10-01 15:14:53 -04:00
cc2d08506e accelerator_*.h files should not be ignored 2021-10-01 12:55:39 -06:00
bed1ff9a95 Remove more files from .gitignore 2021-10-01 12:46:06 -06:00
61c465c6f3 simplify creation of computes in fix ipi and fix plumed 2021-10-01 14:32:19 -04:00
7e7b8acf4b Update .gitignore 2021-10-01 12:12:53 -06:00
05b368e1c6 Merge pull request #2971 from lammps/doc-thermostats
Clarify thermostat doc pages to mention applying the thermostat only to regions of atoms
2021-10-01 12:18:38 -04:00
912d55c46a Merge pull request #2975 from rbberger/external_kokkos_fix
Avoid assertions in PythonCapabilities check when using external KOKKOS
2021-10-01 11:56:43 -04:00
dcf4b75ca2 Merge pull request #2973 from akohlmey/32bit-pointer-bugfix
32-bit pointer bugfix in bond/angle style gaussian
2021-10-01 11:36:26 -04:00
211df8b7b0 Avoid assertions in PythonCapabilities check when using external KOKKOS 2021-10-01 11:08:02 -04:00
434c170097 apply clang-format 2021-10-01 00:58:38 -04:00
01fb33cb5d fix memory allocation bug causing memory corruption on 32-bit arches 2021-10-01 00:57:02 -04:00
b5b2f5c03c additional tweak 2021-09-30 17:11:49 -06:00