jianmu
/
lammps
forked from lijiext/lammps
1
0
Fork 0
Code Issues Pull Requests Packages Projects Releases Wiki Activity
13,895 Commits 9 Branches 198 Tags 1.1 GiB
Commit Graph

599 Commits

Author SHA1 Message Date
Stan Moore 7839c335da Fixing compile error with Kokkos CUDA Makefiles 2017-01-10 13:05:00 -07:00
Christian Negre 1f6cfb1b31 Makefile.lammps.gfortran changed 2017-01-10 10:56:31 -07:00
Steve Plimpton c31f1e9f22 add fix mscg command, example, lib 2017-01-09 13:36:40 -07:00
Stan Moore 9250a55923 Adding enable_lambda to KOKKOS_CUDA_OPTIONS 2017-01-09 12:24:30 -07:00
Stan Moore a9f0b7d523 Updating Kokkos lib 2017-01-09 10:39:46 -07:00
Christian Negre 967cdd947e cleanup 2017-01-05 15:37:01 -07:00
Giacomo Fiorin b0263e87bb Fix missing force with extended-Lagrangian mass 2016-12-27 17:16:32 -05:00
Giacomo Fiorin f553e230db Update Colvars library to version 2016-12-22 
Significant code cleanup and several fixes (walls + extended Lagrangian)

New harmonicWalls bias to apply confining boundaries with time-dependent force
constant & integration
 2016-12-27 13:17:34 -05:00
Giacomo Fiorin 6ab716164b Fix seg fault for gyration collective variable 2016-12-27 13:17:02 -05:00
Giacomo Fiorin 7a45c72b97 Allow extended Lagrangian on non-scalar collective variables 2016-12-27 12:35:30 -05:00
Christian Negre fe99fc287d changes in fix_latte 2016-11-28 15:29:37 -07:00
Christian Negre f040f15218 changes in latte makefile for lattelib and README 2016-11-14 16:11:12 -07:00
Christian Negre f3d6ecf07b changes for lattelib 2016-11-14 07:58:47 -07:00
Steve Plimpton 6f23f6535c initial dummy version of fix_latte.cpp 2016-11-09 13:48:11 -07:00
Giacomo Fiorin 182141b850 Make SMP parallelism for Colvars optional 2016-10-24 17:13:34 -04:00
Giacomo Fiorin e02505c8cc Add ensemble-biased metadynamics (Fabrizio Marinelli, NIH) 2016-10-24 17:11:09 -04:00
Giacomo Fiorin be2d155cef Minor changes and fixes not relevant to LAMMPS 2016-10-24 17:10:52 -04:00
Giacomo Fiorin c243093980 Fix wall forces and subtractAppliedForce for extended-Lagrangian ABF 2016-10-24 17:05:47 -04:00
Giacomo Fiorin ad57a17f48 Add C-linkage wrapper for colvarscript (useful with ctypes) 2016-10-24 16:48:20 -04:00
Axel Kohlmeyer 019bc0ba0b fix typos in Makefile.lammps for NetCDF support 2016-10-19 07:39:03 -04:00
Axel Kohlmeyer 27796b431e avoid distracting error output 2016-10-18 15:32:20 -04:00
Axel Kohlmeyer 2b47fa6653 update Makefile.lammps and add README according to suggestions by lars pastewka 2016-10-18 15:05:30 -04:00
Axel Kohlmeyer 4502d3276b updated Makefile.lammps for NetCDF support based on suggestions from lars pastewka 2016-10-18 14:45:06 -04:00
Axel Kohlmeyer ecb03dd2df import lammps-netcdf code as USER-NC-DUMP package 2016-10-11 23:03:18 -04:00
Axel Kohlmeyer 683689c808 revert to previous style conventions for size_t constants 2016-10-08 11:00:23 -04:00
Axel Kohlmeyer e01e90eb96 workaround for double free issue when using USER-COLVARS with lammps code loaded as shared library into a standalone executable 2016-10-08 10:45:22 -04:00
sjplimp 54fc194e5b Merge pull request #199 from akohlmey/small-changes 
Collected small changes and bugfixes
 2016-10-06 15:49:24 -06:00
A Bartok-Partay 8ea063378e add NETCDF libs (as defined in QUIP) to the linking line if QUIP was built with NETCDF support 2016-10-06 12:16:25 +01:00
Giacomo Fiorin 8809a603fb Colvars update: issue a warning that cannot be ignored regarding total forces 2016-10-05 18:26:21 -04:00
Giacomo Fiorin 969d3cf4b0 Colvars update: make ABF check that the colvar isn't using already subtractAppliedForce 2016-10-05 18:25:40 -04:00
Axel Kohlmeyer 03766dbda7 apply bugfix for MEAM provided by Wolfgang Verestek on lammps-users 
this closes lammps/#188
 2016-10-03 16:28:59 -04:00
Axel Kohlmeyer a3e05a2bac permission cleanup 2016-10-01 06:34:45 -04:00
Axel Kohlmeyer 6d200061ca update colvars library to version 2016-09-30 2016-09-30 08:15:44 -04:00
Axel Kohlmeyer 5b2becd09b Merge branch 'integration' into new-master 2016-09-29 10:37:09 -04:00
sjplimp 484122b8b6 sync with GH 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15592 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2016-09-16 19:21:34 +00:00
Axel Kohlmeyer 9637a5b530 colvars bugfix. updates colvars library to version 2016-09-14 2016-09-15 19:44:26 -04:00
Axel Kohlmeyer 14bed44743 ignore Makefile.lammps in lib tree 2016-09-13 09:36:48 -04:00
Axel Kohlmeyer 18cacb8e1d ignore *.mod generated by fortran compilers 2016-09-13 09:36:19 -04:00
sjplimp b190abea39 sync with GH 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15561 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2016-09-08 20:20:32 +00:00
sjplimp 07e55ef61e Merge pull request #22 from akohlmey/colvars-update 
accumulated colvars library update and lib "make clean" improvement
 2016-09-08 14:14:49 -06:00
Steve Plimpton 236ebf7fab Kokkos lib update 2016-09-08 13:56:18 -06:00
Axel Kohlmeyer 3a74ccffa2 update colvars library to version 2016-09-03 
(cherry picked from commit 4181f5ac9d)
 2016-09-06 21:28:59 -04:00
Axel Kohlmeyer c8cfd53c1b adjust makefiles in lib tree, so they don't return an error exit code on "make clean" targets. 
(cherry picked from commit 4117218ca3)
 2016-09-06 21:28:55 -04:00
Axel Kohlmeyer 16607a0132 update colvars library to version 2016-08-19 
(cherry picked from commit c67326be6d)
 2016-09-06 21:27:46 -04:00
Axel Kohlmeyer 3b476d914f update colvars to version 2016-08-10 
(cherry picked from commit eba3ad9abb)
 2016-09-06 21:27:46 -04:00
Axel Kohlmeyer 977b9e542f update colvars to another set of changes from the upstream repo 
(cherry picked from commit cb816f8cba)
 2016-09-06 21:27:45 -04:00
Axel Kohlmeyer 1b33d00785 update colvars makefile dependencies 
(cherry picked from commit df99a85930)
 2016-09-06 21:27:45 -04:00
Axel Kohlmeyer 3d2e5d0a50 suppress compiler warning 
(cherry picked from commit 6f227e194e)
 2016-09-06 21:27:45 -04:00
Axel Kohlmeyer ec2a6b9f0d update colvars to version 2016-08-10 
(cherry picked from commit f2ddf828e4)
 2016-09-06 21:27:41 -04:00
Axel Kohlmeyer 77620106a4 update colvars library to version 2016-08-05 
(cherry picked from commit 459db2eb6b)

# Conflicts:
#	doc/src/PDF/colvars-refman-lammps.pdf
 2016-09-06 21:26:50 -04:00
stamoor 39be4185c4 Updating Kokkos lib 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15556 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2016-09-06 23:06:32 +00:00
stamoor 1ad033ec0c Updating Kokkos lib 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15555 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2016-09-06 23:02:50 +00:00
sjplimp 083ff54c0c small bug fixes 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15527 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2016-08-31 20:26:15 +00:00
Steve Plimpton 4051aedf2c Merge branch 'small' into integration 
Conflicts:
	src/compute_omega_chunk.cpp
 2016-08-31 13:58:12 -06:00
Steve Plimpton ec8b9e21db sync with SVN 2016-08-31 13:28:26 -06:00
stamoor dbaaf4dbbd Removing aggressive_vectorization flag due to safety issue 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15521 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2016-08-30 17:52:49 +00:00
Axel Kohlmeyer 493613b495 avoid NaNs in MEAM 2016-08-30 06:54:36 -04:00
Steve Plimpton 2beecd1e73 removal of doc/html/_sources and minor sync with SVN 2016-08-26 11:34:37 -06:00
stamoor cc4b2dd6ed Changing default 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15503 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2016-08-26 15:50:25 +00:00
Steve Plimpton abc5a32c8a gpu lib sync 2016-08-23 15:30:01 -06:00
sjplimp efaa84a4ea git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15430 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-08-03 19:32:03 +00:00
sjplimp b8bf3ae5b0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15391 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-29 14:24:21 +00:00
sjplimp ee24be38cb git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15371 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-27 14:09:42 +00:00
sjplimp e6dc896b49 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15327 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-15 23:02:09 +00:00
sjplimp 638b0db535 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15322 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-15 22:40:38 +00:00
sjplimp c79a24c7ef git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15320 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-15 22:38:58 +00:00
sjplimp 12f3178e86 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15319 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-15 22:38:42 +00:00
sjplimp 05398a6863 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15315 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-15 22:25:17 +00:00
sjplimp 65c1e16401 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15268 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-06 23:26:44 +00:00
sjplimp fd27214f7d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15267 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-06 23:26:27 +00:00
sjplimp 34f829c5ac git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15261 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-05 14:41:13 +00:00
sjplimp a99c922a14 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15249 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-01 23:29:38 +00:00
sjplimp 9656958169 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15248 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-07-01 23:27:26 +00:00
sjplimp 2fcd26f6c4 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15200 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-06-17 23:07:51 +00:00
sjplimp e5fb28a6a0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15199 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-06-17 23:07:24 +00:00
sjplimp 328224a298 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15181 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-06-16 15:44:41 +00:00
sjplimp a4b82a95e9 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15162 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-06-14 13:58:49 +00:00
sjplimp e653da12a6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15095 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-06-02 14:03:00 +00:00
sjplimp dfb0f528c0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15038 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-05-12 13:52:42 +00:00
sjplimp bf3187d764 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14938 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-05-06 14:20:38 +00:00
stamoor 48d65b7fef Enabling new kokkos view 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14935 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2016-05-03 16:24:08 +00:00
sjplimp 91447edb58 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14928 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-05-03 16:11:34 +00:00
stamoor 33ce33ce36 Reverting back to old kokkos view 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14921 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2016-05-02 23:40:38 +00:00
stamoor fda492ea48 Updating kokkos lib 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14919 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2016-05-02 22:10:37 +00:00
stamoor 0a1b765248 Updating kokkos lib 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14918 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2016-05-02 22:06:50 +00:00
sjplimp 00f38fdaf0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14910 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-04-30 18:06:25 +00:00
sjplimp 17fd5898df git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14900 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-04-28 14:48:56 +00:00
sjplimp 98ed24437d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14875 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-04-26 18:28:26 +00:00
sjplimp 184d5dc0f0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14867 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-04-22 17:51:49 +00:00
sjplimp 44ca843073 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14841 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-04-18 14:00:58 +00:00
sjplimp a4e8eaaf4d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14833 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-04-15 16:16:52 +00:00
sjplimp f50b03fcab git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14830 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-04-15 16:07:28 +00:00
sjplimp 212a955285 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14829 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-04-15 16:07:01 +00:00
sjplimp ef7e119c86 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14824 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-04-14 14:42:56 +00:00
sjplimp c46d973c2b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14823 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-04-13 22:25:46 +00:00
sjplimp 008896a77d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14808 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-04-07 21:10:37 +00:00
sjplimp 67a4004f23 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14807 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-04-07 21:05:19 +00:00
sjplimp 0528cde331 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14783 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-03-22 14:29:41 +00:00
sjplimp acc29ff266 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14778 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-03-22 13:44:55 +00:00
sjplimp 361ed36bed git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14775 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-03-22 13:43:01 +00:00
sjplimp edb3f9559c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14758 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-03-21 16:10:48 +00:00
sjplimp ad3c57cb63 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14746 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-03-14 18:45:25 +00:00
sjplimp 9d64c50cd0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14709 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-03-01 20:47:13 +00:00
sjplimp 20beaccf0f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14703 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-03-01 20:40:25 +00:00
sjplimp 756480ba64 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14701 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-03-01 20:39:41 +00:00
sjplimp 08b53bb709 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14657 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-02-18 22:31:59 +00:00
sjplimp 52ca6416a0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14632 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-02-15 22:34:20 +00:00
sjplimp cd14e4314d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14593 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-02-15 15:32:27 +00:00
stamoor b355fa25f4 Squelching annoying kokkos output 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14508 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2016-01-28 21:07:07 +00:00
stamoor 0541d52c17 Fixing Kokkos bug 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14504 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2016-01-26 23:49:57 +00:00
sjplimp b5a1ba9bfa git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14371 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-12-15 22:29:37 +00:00
sjplimp 06a217aa08 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14370 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-12-15 22:26:37 +00:00
athomps 88f58beb97 Added latest changes from Albert Bartok 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14274 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-11-24 16:26:24 +00:00
sjplimp f6c76f4623 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14265 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-11-18 18:23:45 +00:00
sjplimp 449f373db5 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14165 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-22 22:08:30 +00:00
sjplimp 61649b57d0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14075 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-24 22:52:20 +00:00
sjplimp 44c8bb9cbf git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14060 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-24 20:23:56 +00:00
sjplimp 6f39a0a78d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14059 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-24 20:23:37 +00:00
stamoor cb971f0166 Kokkos bugfix 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14051 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-23 18:10:39 +00:00
sjplimp 942cce877b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14004 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-08 23:38:11 +00:00
sjplimp c7303a1c1d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14001 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-08 14:13:03 +00:00
sjplimp ae980d6fd1 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13986 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-02 20:41:38 +00:00
sjplimp 0f3d77ed75 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13950 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-08-28 23:35:43 +00:00
sjplimp fec0587835 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13926 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-08-20 16:53:24 +00:00
stamoor 3fcbe43295 Commented out line (temporarily) that causes a segmentation fault in the USER-AWPMD library 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13925 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-20 15:55:19 +00:00
stamoor 494ee3b26c Updating Kokkos library--adding new folder 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13922 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-19 22:17:15 +00:00
stamoor e2ac7b2352 Updating Kokkos library--first deleting old folder 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13921 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-19 22:12:32 +00:00
sjplimp 3e90c3eeab git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13913 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-08-19 15:43:07 +00:00
sjplimp 185e746ccb git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13908 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-08-19 15:19:08 +00:00
sjplimp 071ded95fc git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13907 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-08-19 15:16:24 +00:00
sjplimp 21f8abda24 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13906 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-08-19 15:15:32 +00:00
sjplimp 1c3e0dbfe9 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13904 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-08-19 14:56:21 +00:00
sjplimp 4731f7e94a git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13856 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-08-10 20:35:31 +00:00
sjplimp f2276c9d9f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13854 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-08-10 20:27:45 +00:00
sjplimp 2f7344a02a git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13831 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-08-04 19:55:02 +00:00
sjplimp 6e40300d26 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13670 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-07-22 14:36:59 +00:00
stamoor 4e757218e4 Adding missing Kokkos file 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13636 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-07-17 16:17:51 +00:00
sjplimp 61ec2f78ac git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13583 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-07-14 19:57:25 +00:00
sjplimp 26b23a47cd git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13581 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-07-14 19:55:01 +00:00
sjplimp ade2dca6af git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13506 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-07-02 00:45:28 +00:00
athomps 2b605e29db Describes new QUIP directory structure 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13499 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-07-01 21:02:16 +00:00
athomps 12b5742f6c Updated to new QUIP directory structure 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13493 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-06-23 23:18:51 +00:00
sjplimp c3fd41010d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13464 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-05-15 16:33:17 +00:00
sjplimp c676c2d560 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13445 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-04-30 14:10:18 +00:00
sjplimp f539e43b22 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13444 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-04-30 14:09:42 +00:00
sjplimp 29e574b720 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13400 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-04-11 23:13:07 +00:00
sjplimp 974e1eb022 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13396 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-04-06 15:14:53 +00:00
athomps 2729e19d4a Added one-liner for QUIP 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13394 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-04-06 14:37:39 +00:00
sjplimp 4825579470 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13252 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-03-18 21:39:32 +00:00
sjplimp 636ef51ae4 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13251 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-03-18 20:45:12 +00:00
sjplimp 5e0e0c3838 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13248 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-03-17 23:13:10 +00:00
sjplimp 141569b290 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13246 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-03-17 23:09:56 +00:00
sjplimp ad91adbedc git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13241 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-03-17 16:08:01 +00:00
sjplimp c63d258cc0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13239 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-03-17 16:06:12 +00:00
sjplimp 5a0a8f1335 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13207 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-03-09 14:50:53 +00:00
sjplimp 02d90d07e6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13151 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-02-24 16:29:22 +00:00
sjplimp 067833cf07 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13126 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-02-19 18:20:52 +00:00
sjplimp a2aa6c5be0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13057 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-02-04 22:09:15 +00:00
sjplimp 7e20001bca git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13056 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-02-04 22:07:12 +00:00
sjplimp 102cb9e0bf git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12913 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-01-09 16:07:15 +00:00
sjplimp 91b6d7f3b3 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12909 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-01-09 15:52:23 +00:00
sjplimp ebcccbf9dd git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12908 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-01-09 15:52:12 +00:00
sjplimp 99604912b9 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12902 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-01-08 23:36:35 +00:00
sjplimp 9847711956 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12901 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-01-08 22:47:59 +00:00
sjplimp a31233cd10 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12900 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-01-08 22:46:24 +00:00
sjplimp 6e61c2a738 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12822 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-12-09 19:42:56 +00:00
sjplimp 9f649c3123 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12813 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-12-02 02:12:19 +00:00
sjplimp c4af1cdbbd git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12811 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-12-02 02:09:53 +00:00
jatempl ac5973073f ATC version 2.0, date: Nov20 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12757 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2014-11-20 18:59:03 +00:00
sjplimp 52408b16d2 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12677 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-10-31 14:46:50 +00:00
sjplimp a79274aac4 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12663 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-10-30 15:22:01 +00:00
sjplimp 7510ec7960 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12655 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-10-29 15:47:24 +00:00
sjplimp 51a148df16 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12650 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-10-28 19:53:17 +00:00
sjplimp 7cea65198f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12649 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-10-28 15:21:46 +00:00
sjplimp 20a71b1d23 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12640 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-10-21 16:50:00 +00:00
sjplimp c90746a20c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12638 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-10-21 16:33:32 +00:00
sjplimp 211c12c39e git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12613 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-10-07 20:30:53 +00:00
sjplimp 044084847b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12612 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-10-07 20:30:25 +00:00
sjplimp 69f2390b06 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12596 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-10-07 15:24:30 +00:00
sjplimp 7c748bb17f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12590 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-10-06 23:40:06 +00:00
sjplimp 621fa7d600 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12588 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-10-06 22:59:05 +00:00
sjplimp 159d82e473 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12527 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-23 15:55:27 +00:00
sjplimp 4a95b00477 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12496 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-11 16:58:10 +00:00
sjplimp 68d424d3fc git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12404 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-05 14:24:03 +00:00
sjplimp 451d5c04ef git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12403 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-04 16:09:47 +00:00
sjplimp af4909ab51 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12399 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-04 15:42:52 +00:00
sjplimp 37ab2751d1 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12398 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-04 15:42:15 +00:00
sjplimp b2740c77d6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12375 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-08-27 21:21:02 +00:00
sjplimp 048a267b9f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12370 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-08-27 17:08:01 +00:00
sjplimp 222d9ee151 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12369 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-08-27 17:07:19 +00:00
sjplimp 26fe85211b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12367 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-08-27 16:20:42 +00:00
sjplimp 7387b0cc62 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12366 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-08-27 16:20:37 +00:00
sjplimp b69be175f0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12326 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-08-14 23:29:42 +00:00
sjplimp e3824e9332 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12325 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-08-14 23:29:25 +00:00
sjplimp b5d89cd768 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12169 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-07-02 20:53:37 +00:00
sjplimp 67ae64329e git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12146 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-06-27 17:25:22 +00:00
athomps 8dddba1112 Pruned unnecessary libraries 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12141 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2014-06-20 16:46:39 +00:00
sjplimp 2ec1442e97 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12132 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-06-14 19:34:19 +00:00
sjplimp b8f6904ce3 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12128 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-06-13 22:09:12 +00:00
sjplimp 5593d42f32 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12063 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-06-03 13:19:06 +00:00