8cbee78725
Changes to intel Makefiles to make use of MKL consistent.
2018-10-11 05:46:40 -07:00
acdc240cdd
better rRESPA doc page, also a new Makefile.theta
2018-07-11 08:42:28 -06:00
ec99b0957c
new ARM makefiles, also some doc tweaks
2018-06-29 08:06:51 -06:00
3c6102a0c3
Tweak whitespace in Makefile.kokkos_cuda_mpi
2018-04-05 11:49:57 -06:00
a802b750a6
USER-INTEL: Adding missing backslash for two Makefiles using Intel compiler.
2018-01-17 21:59:37 -08:00
07ddb5e62c
USER-INTEL: Adding compiler flag and small fix to tersoff/intel for 2018u1 compilers.
2018-01-15 23:54:48 -08:00
40e776ebc6
Remove OpenMP from KOKKOS_DEVICES in Kokkos CUDA Makefiles since normally this doesn't improve performance
2017-11-10 09:55:11 -07:00
f39c6213e1
Change path to nvcc_wrapper
2017-11-06 13:50:16 -07:00
05847a0e87
Merge branch 'master' into user-intel-update
2017-10-06 10:18:38 -04:00
5e89269631
Minor adjustments to intel makefiles and documentation based on the reversed
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preprocessor logic and default memory align. Removing knl_coprocessor makefile.
2017-10-02 23:41:14 -07:00
2a24cbfe0c
reverse logic for using MKL pRNG: this way, make serial and make mpi will compile LAMMPS with USER-INTEL installed
2017-10-02 21:13:51 -04:00
38530415c8
-ltbbmalloc is required
2017-09-25 20:03:53 -04:00
fbaa7ab8fa
Merge pull request #655 from akohlmey/fixes-for-patch
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collected small bugfixes for the next patch release
2017-09-20 08:51:47 -06:00
cdb6ec7419
reverse the pre-processor logic of the LRT mode define
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with this change, the USER-INTEL package can be installed and
compiled without having to alter makefiles for adding -lpthread.
All "intel optimized" makefiles have been updated to have the
LRT feature enabled. This change will allow us to include the
USER-INTEL package in several automated testing configurations
and thus allows to detect incompatibilities and compilation issus faster.
2017-09-19 11:24:05 -04:00
3a5d8362ff
have only one common MPI makefile for KOKKOS with CUDA
2017-09-06 14:16:17 -04:00
5089b263b2
make kokkos_cuda_mpi compatible with both MPICH and OpenMPI
2017-09-06 14:15:27 -04:00
5c985946d5
Merge branch 'master' into USER-DPD_kokkos
2017-08-22 13:50:19 -06:00
1d4d2155a2
USER-INTEL add-ons from Mike
2017-08-15 17:12:07 -06:00
ea4d11fc5e
Merge branch 'master' into USER-DPD_kokkos_testing
2017-06-26 09:36:30 -06:00
9b9f6d6fe2
USER-INTEL upgrade from M Brown
2017-06-16 16:56:28 -06:00
de27305227
Merge branch 'master' of https://github.com/lammps/lammps into USER-DPD_kokkos
2017-03-07 11:47:18 -07:00
efaa4c6710
new neigh_modify exclude option, other SNAP changes
2017-03-07 09:31:12 -07:00
83988a1026
Merge branch 'master' into USER-DPD_kokkos as of patch 21Feb17
2017-02-22 11:29:01 -05:00
1cd4c48ccc
new SNAP potential for W
2017-02-21 15:49:21 -07:00
96a43e8ef1
Merge branch 'master' into USER-DPD_kokkos as of patch 13Feb17
2017-02-13 12:29:41 -05:00
9d1991bf84
remove support for obsolete legacy FFT libraries and point -DFFT_FFTW to FFTW3
2017-02-02 08:10:23 -05:00
883385c8e4
Merge branch 'master' into USER-DPD_kokkos as of patch 17Jan17
2017-01-17 13:19:06 -05:00
252e07e083
Merge pull request #330 from akohlmey/collected-small-bugfixes
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Collected small bugfixes
2017-01-17 09:08:00 -07:00
c59bcf31d1
change $MKLROOT to $(MKLROOT) as reported by @WeiLiPenguin
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This closes #336
2017-01-13 08:10:51 -05:00
7839c335da
Fixing compile error with Kokkos CUDA Makefiles
2017-01-10 13:05:00 -07:00
9250a55923
Adding enable_lambda to KOKKOS_CUDA_OPTIONS
2017-01-09 12:24:30 -07:00
26d50853e9
Merge branch 'master' as of patch 6Jan17 into USER-DPD_kokkos
2017-01-09 13:12:02 -05:00
332372dec2
Renamed Makefile.afrl_thunder to Makefile.icex to be more general.
2017-01-05 14:03:16 -05:00
a4271ae8c5
Added a Makefile for AFRL Thunder.
2017-01-04 15:13:46 -05:00
8b5e15e979
add a Makefile for the White testbed
2016-12-20 16:30:50 -07:00
f509f133af
patch 13Dec16: neighbor refactor, Stan pppm/disp bug fix, M Brown INTEL package updates
2016-12-13 17:14:28 -07:00
22d93fe8fb
add restrict to CCFLAGS for makefiles intended for intel compilers
2016-11-16 14:31:10 -05:00
31204aab6a
sync with SVN
2016-11-08 08:57:51 -07:00
9b2d5ff3e7
remove executable permissions on non-executables and non-scripts
2016-09-08 14:45:07 -04:00
fa7c2cea4d
Adding Kokkos mpi-only Makefile
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15214 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-06-22 16:51:57 +00:00
ecffbbe531
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15165 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-06-14 16:32:54 +00:00
6334768dd1
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15057 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-05-13 15:46:48 +00:00
212f64d2f1
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15040 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-05-12 13:54:17 +00:00
92b45d0163
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14888 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-04-26 22:10:30 +00:00
e7363b4764
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14881 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-04-26 19:38:50 +00:00
325295bfaa
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14880 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-04-26 18:41:45 +00:00
a4af037d1d
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14859 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-04-22 15:45:50 +00:00
2ce937a070
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14857 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-04-20 23:39:50 +00:00
95c1623665
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14856 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-04-20 23:02:44 +00:00
93bc5c8be6
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14855 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2016-04-20 22:46:43 +00:00
