Commit Graph

430 Commits

Author SHA1 Message Date
326a97624e Merge pull request #1317 from ornladios/adios2-master
USER-ADIOS package with ADIOS 2.x
2019-02-27 17:24:12 -05:00
54e5c76333 Bump KIM API version to 2.0.1 2019-02-27 15:50:08 -06:00
e6df92e65a Merge pull request #1011 from ellio167/kim-v2-update
KIM v2 update
2019-02-21 20:06:59 -05:00
75fe967876 remove fluff about adios in CMakeLists.txt. 2019-02-20 09:02:24 -05:00
9c52a37546 PIMPL implementation of USER-ADIOS to hide internal data from style header file 2019-02-20 09:02:24 -05:00
24234d3a0b Fixed cmake build for ADIOS 2.x 2019-02-20 09:02:24 -05:00
8db88b1c02 Added initial untested ADIOS 2.x code with cmake building problems 2019-02-20 09:02:24 -05:00
f25b06fab0 Fixes part of issue #1278
Moving a style header or touching it will now trigger a reconfiguration before
building, which triggers style files to be regenerated.
2019-02-17 20:53:21 -05:00
c2725f5a49 forward build type setting to compiling downloaded KIM API 2019-02-15 03:53:09 -05:00
afa50ab61a update pathspec when linking KIM API from downloaded archive 2019-02-15 02:21:07 -05:00
e95cf4e917 Some various doc updates for kim-api support 2019-02-14 13:38:28 -06:00
333154633b Merge branch 'master' into kim-v2-update 2019-02-14 13:29:50 -06:00
9ac908f05f switch download server for voro++ from LBL to download.lammps.org, which seems much more reliable 2019-02-13 09:53:20 -05:00
927dc262b2 Update CMake & Install.py for KIM API v2 2019-02-06 23:41:45 -06:00
d677335b23 Merge remote-tracking branch 'lammps/master' into kim-v2-update 2019-02-03 12:45:44 -06:00
f2a977884c Merge pull request #1290 from akohlmey/python-script-portability
Use argparse module in for Install.py scripts in lib and further portability and consistency enhancements. Some lint removal as well.
2019-02-01 01:18:40 +01:00
ef5c327f74 Merge branch 'master' into collected-small-changes 2019-01-31 11:45:15 +01:00
53f600ea35 use enable all available plumed modules when using download/compile mode 2019-01-26 09:55:48 -05:00
9caf0ce3e1 add USER-YAFF package to build system 2019-01-22 12:17:04 -05:00
23ce00f366 Merge remote-tracking branch 'lammps/master' into kim-v2-update 2019-01-16 21:49:14 -06:00
d01c28002f update plumed support to use newer version of the library 2019-01-14 17:47:36 -05:00
b20be581c1 update Eigen3 download to version 3.3.7 for CMake as well 2019-01-14 15:02:09 -05:00
6fbd0c08cc if we want to check for C++ includes, we should now check for cmath not math.h 2019-01-10 16:50:00 -05:00
444dcca433 Merge pull request #1254 from akohlmey/remove-reax-meam
Remove REAX and MEAM packages
2018-12-29 13:06:07 -05:00
dd028e9071 Merge pull request #1266 from junghans/cmake_doc
doc: add CMAKE_VERBOSE_MAKEFILE and CXX_COMPILER_LAUNCHER
2018-12-29 12:09:06 -05:00
92e1cbe788 cmake: find install location of FindLAMMPS.cmake 2018-12-28 17:57:13 -07:00
f8a5a78c2c doc: add CMAKE_VERBOSE_MAKEFILE and CXX_COMPILER_LAUNCHER 2018-12-20 09:17:34 -07:00
6c0b100a53 Merge branch 'master' into kim-v2-update 2018-12-16 15:56:33 -06:00
540026ca00 Update CMakeLists.txt to avoid merge conflicts 2018-12-16 15:53:51 -06:00
b068690e13 Update for kim-api beta.3 release 2018-12-12 16:21:54 -06:00
d15e4b1546 Merge branch 'master' into remove-reax-meam 2018-12-11 23:31:48 -05:00
8422bf64fa prevent configuring -D PKG_USER-ATC=yes with -D LAMMPS_SIZES=bigbig in CMake 2018-12-10 17:42:38 -05:00
3f49eb8515 remove meam and reax from build system 2018-12-10 12:14:03 -05:00
a30e1b2670 cmake: USER-PLUMED does not LAPACK anymore 2018-12-07 06:10:29 -07:00
ebacd5ca6b anti-nitpick hack 2018-11-27 14:36:59 -05:00
79fafcb12c passing build type specific compiler flags to building the voro++ library 2018-11-27 09:57:21 -05:00
dbc798e286 correct passing flags to local voro++ build 2018-11-27 05:47:19 -05:00
d43f229162 do not warn about deprecated GPU target archs 2018-11-26 22:48:23 -05:00
00b138f542 verbose CUDA assembly processing is more distracting than helping 2018-11-26 22:45:54 -05:00
1fdfc89d25 make $HOME/.local the default LAMMPS installation destination 2018-11-26 22:27:21 -05:00
d6ea31e143 implement changes suggested by @junghans for GPU/CUDA compilation 2018-11-26 22:06:10 -05:00
91b96fa0c9 build MESSAGE package client/server library always as static library 2018-11-26 21:37:23 -05:00
c980dd0a56 remove stray endif() 2018-11-26 20:56:13 -05:00
3ad74985eb replace more inline expansions with explicit code. some general overhaul and better propagation of consistent compiler settings and flags for library builds 2018-11-26 20:53:23 -05:00
aa0b9684dc remove inline expansion from two more cases (of external library builds) 2018-11-26 20:19:28 -05:00
b3975f4b14 reword a few options for clarity 2018-11-26 17:03:32 -05:00
c61da28f0a allow building "fat" GPU binaries in CUDA mode, resulting in executables compatible with all GPUs supported by the used CUDA toolkit 2018-11-26 17:03:09 -05:00
421f97e444 Merge pull request #1214 from akohlmey/collected-small-changes
Collected small changes and many spelling fixes for next release candidate
2018-11-20 10:34:58 -05:00
fd4262805d for enabling MPIIO we also need to set -DLMP_MPIIO 2018-11-16 15:48:35 -05:00
2c979e878f fix cmake build for USER-H5MD
The hdf5 includes were needed as well for building the dump.
2018-11-16 15:18:58 +01:00