Commit Graph

4488 Commits

Author SHA1 Message Date
64ec9a8cd0 Replace __float2int_rn with __float2int_rd so that it gives the same answer as static_cast<int> 2011-11-16 09:45:42 -05:00
0fd91e084e Modified EAM tests 2011-11-15 16:01:28 -05:00
aab9de4719 Add more EAM tests 2011-11-15 15:48:05 -05:00
ea34677220 Fixed preprocessor compile errors in DOUBLE precision CUDA compiles.
Added eam/gpu to the install script.
Modified neighbor builds in eam regression tests.
2011-11-15 14:35:08 -05:00
5714e73cad Merge branch 'upload' 2011-11-15 14:06:49 -05:00
55c3d17a55 Moving eam/gpu into library and deleting src/ copies of eam on cpu. 2011-11-15 14:05:34 -05:00
7a3c8430aa Merge branch 'master' of https://bitbucket.org/wb8/lal 2011-11-15 12:10:50 -05:00
43533e06e3 Merge branch 'master' of ssh://yona.ccs.ornl.gov/~/git/lammps 2011-11-15 12:04:19 -05:00
3a09b6d23f Merge branch 'master' of http://git.icms.temple.edu/lammps-ro 2011-11-15 12:03:23 -05:00
d667f1e349 Add EAM cpu/gpu tests 2011-11-15 12:02:04 -05:00
638562ff63 Add pair eam and eam/gpu to src/ 2011-11-15 11:55:30 -05:00
b442201bf6 Add EAM potential to lib/gpu 2011-11-15 11:54:00 -05:00
bcfe92a4ba Merge ssh://firefly9.ornl.gov/~/code/lammps 2011-11-14 18:01:23 -05:00
081127c74f Fixing bug where precision preprocessor definition didn't make it neighbor list build. 2011-11-14 17:40:30 -05:00
4d96e85601 Adding LAMMPS regression tests to LAMMPS from old code repository. 2011-11-14 14:41:57 -05:00
69b7787ff2 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7228 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-11-11 16:52:58 +00:00
189e650c67 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7226 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-11-09 15:09:04 +00:00
0be567a00a git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7225 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-11-09 15:04:01 +00:00
1963ce8783 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7223 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-11-08 14:53:07 +00:00
181c77d346 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7222 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-11-08 14:51:25 +00:00
96be0b6075 Switching to using views for host neighbor lists instead of NULL pointers due to issues with some OpenCL implementations. 2011-11-05 16:12:00 -04:00
487aaa53ca Merge branch 'upload' 2011-11-05 05:38:59 -04:00
ac35168478 First working version of NUMA mpi topology. 2011-11-04 20:13:13 -04:00
fdbb1eac88 Updating fix report/balance. 2011-11-04 17:28:20 -04:00
82fe0272c0 Adding code to map procs by node. 2011-11-04 17:23:55 -04:00
96672dcf14 Adding load balancing report fix. 2011-11-01 17:58:24 -04:00
618f3ab3ff git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7221 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-31 14:22:24 +00:00
f0e2a07be3 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7220 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-31 14:22:15 +00:00
10d1f843b5 Merge branch 'upload' 2011-10-30 17:17:07 -04:00
51c0f18c1d Adding error checking for compute exclusive mode. 2011-10-30 17:15:50 -04:00
d556467676 Updating Makefile. 2011-10-28 14:47:54 -04:00
390acdbbe9 Merge branch 'master' of http://git.icms.temple.edu/lammps-ro 2011-10-28 14:44:48 -04:00
ede8955c77 Adding publication to README. 2011-10-28 14:39:55 -04:00
7b911a5cc9 Modifying default thread per atom parameters. 2011-10-28 13:50:42 -04:00
fcf2d32f8b Adding answer clear to pppm clear function to prevent seg fault. Adding timing info for copy on hybrid neighbor lists. Removing duplicate output from base_ellipsoid. 2011-10-27 20:58:57 -04:00
c458e1fe5b Adding missing file from last commit. 2011-10-26 21:34:30 -04:00
ad68b61b46 Renaming files to have lal prefix. 2011-10-26 21:34:02 -04:00
ef856fdbdf Merge ssh://lens.ccs.ornl.gov/~/git/lammps 2011-10-26 19:47:51 -04:00
0bee1c14e0 Merge branch 'master' of http://git.icms.temple.edu/lammps-ro
Conflicts:
	doc/pair_coul.txt
	lib/gpu/Nvidia.makefile
	lib/gpu/README
	src/GPU/fix_gpu.cpp
	src/GPU/pair_cg_cmm_coul_long_gpu.cpp
	src/GPU/pair_cg_cmm_coul_msm_gpu.cpp
	src/GPU/pair_cg_cmm_gpu.cpp
	src/GPU/pair_coul_long_gpu.cpp
	src/GPU/pair_coul_long_gpu.h
	src/GPU/pair_gayberne_gpu.cpp
	src/GPU/pair_lj96_cut_gpu.cpp
	src/GPU/pair_lj_charmm_coul_long_gpu.cpp
	src/GPU/pair_lj_class2_coul_long_gpu.cpp
	src/GPU/pair_lj_class2_gpu.cpp
	src/GPU/pair_lj_cut_coul_cut_gpu.cpp
	src/GPU/pair_lj_cut_coul_long_gpu.cpp
	src/GPU/pair_lj_cut_gpu.cpp
	src/GPU/pair_lj_cut_tgpu.cpp
	src/GPU/pair_lj_expand_gpu.cpp
	src/GPU/pair_morse_gpu.cpp
	src/GPU/pair_resquared_gpu.cpp
2011-10-26 19:45:38 -04:00
524bc21243 Moving where opencl parameters are output. 2011-10-26 17:49:31 -04:00
db8cc02e18 Adding a capability for neighbor builds to openCL builds. 2011-10-26 17:42:21 -04:00
41e7406f3e Switching sqrt to rsqrt where possible. Adding a FERMI_OCL define for
opencl parameters and OpenCL Vendor output.
2011-10-26 16:54:41 -04:00
55f5a14b25 Modified code to use preprocessor definitions for transcendentals. 2011-10-26 15:15:49 -04:00
e05839cbeb git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7215 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-26 17:33:12 +00:00
331aca8ba6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7214 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-26 17:32:47 +00:00
600c945ee9 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7211 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-26 17:22:09 +00:00
3e3dc73616 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7210 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-26 17:21:47 +00:00
c6ab9c0ce6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7209 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-26 17:08:27 +00:00
9e2f81e4ed git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7208 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-26 17:06:50 +00:00
ce48b6d67c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7206 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-26 16:59:49 +00:00