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3095 Commits

Author SHA1 Message Date
sjplimp b72306641c '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14179 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-22 23:53:49 +00:00
sjplimp 439af71a6a '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14178 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-22 23:53:39 +00:00
sjplimp bcf560477a git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14177 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-22 23:46:08 +00:00
sjplimp 01acc93029 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14170 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-22 22:17:18 +00:00
sjplimp 0a4b0ced33 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14169 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-22 22:17:09 +00:00
sjplimp 36b3880e39 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14167 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-22 22:09:44 +00:00
sjplimp d75b4730d9 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14160 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-21 23:17:48 +00:00
sjplimp 7a68ceb57a '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14159 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-21 23:17:38 +00:00
sjplimp 069e25a84b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14153 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-21 21:01:49 +00:00
sjplimp 636a6903db '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14150 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-21 20:53:14 +00:00
sjplimp 219997462e '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14149 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-21 20:53:05 +00:00
sjplimp 869b8f9d3a git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14145 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-21 19:55:55 +00:00
sjplimp bc33be3ede '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14141 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-21 19:41:00 +00:00
sjplimp 1a488ad50a '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14140 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-21 19:40:47 +00:00
sjplimp cb6baee0b1 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14137 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-21 19:30:46 +00:00
sjplimp a5abe2a330 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14136 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-21 19:30:35 +00:00
sjplimp 45e18fe128 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14133 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-21 18:53:15 +00:00
sjplimp 2ea1457e5c '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14132 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-21 18:53:06 +00:00
sjplimp cd078405e0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14131 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-21 18:52:59 +00:00
sjplimp c4af165bba '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14130 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-21 18:51:25 +00:00
athomps bf26b12668 Added vashishta to USER-OMP from Axel 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14125 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-21 03:57:35 +00:00
athomps a38f111b9c Added Vashishta potential 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14124 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-19 17:23:32 +00:00
athomps ce62105570 Require type argument be zero when mol keyword used 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14120 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-15 21:02:03 +00:00
athomps c7170a4296 Added Vashishta potential 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14117 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-15 17:39:43 +00:00
athomps d357a2f44a added tfac_insert keyword 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14111 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-13 16:11:13 +00:00
athomps 39e8123a02 added tfac_insert keyword 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14109 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-13 15:53:41 +00:00
athomps 97878b1a9f Added deprecated warning message to pair_style reax 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14107 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-07 20:20:48 +00:00
athomps eda7896364 Added elastic constant example at finite temperature 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14098 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-05 18:25:21 +00:00
sjplimp 1bb4a26214 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14095 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-10-05 15:32:23 +00:00
sjplimp bee7ed920a '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14090 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-05 15:19:04 +00:00
sjplimp 0e398e5e65 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14089 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-10-05 15:18:49 +00:00
sjplimp 858eed2438 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14084 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-28 12:38:18 +00:00
sjplimp 89ea1e4ae6 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14083 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-28 12:38:11 +00:00
sjplimp 4d4d56175a '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14081 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-28 12:29:55 +00:00
sjplimp 615657899c '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14080 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-28 12:29:43 +00:00
sjplimp 27c4accd4f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14077 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-24 22:54:21 +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 df7687fcc1 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14069 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-24 20:44:30 +00:00
sjplimp 87025c6770 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14067 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-24 20:44:03 +00:00
sjplimp aec30b07c2 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14066 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-24 20:43:49 +00:00
sjplimp c622ab1e6d '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14063 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-24 20:29:42 +00:00
sjplimp ac2ab62f03 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14062 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-24 20:29:32 +00:00
sjplimp ea547aaf79 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14056 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-24 20:02:14 +00:00
sjplimp 787cc145e8 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14055 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-24 20:02:03 +00:00
athomps 4f6a6f37cb Modifed ZBL to accomodate mixing 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14048 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-23 00:30:50 +00:00
athomps b9a5521bb1 Tweaked bit about thermostats 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14044 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-18 20:36:17 +00:00
sjplimp 67771a01fb '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14042 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-11 23:39:48 +00:00
sjplimp 79e54786e7 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14041 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-11 23:39:40 +00:00
athomps 0da2e1782b Fixed triclinic bug in gcmc and qtype bug atom/swap 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14039 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-11 23:08:52 +00:00
athomps 886e170098 Fixed triclinic bug in gcmc and qtype bug atom/swap 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14038 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-11 22:08:22 +00:00
sjplimp 66566c56d6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14033 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-11 15:05:42 +00:00
sjplimp fa8776172b '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14031 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-11 15:05:34 +00:00
sjplimp bef809beca '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14030 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-11 15:05:25 +00:00
sjplimp 3561a54e47 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14027 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-11 14:50:14 +00:00
sjplimp 4035556ffa '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14026 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-11 14:50:01 +00:00
sjplimp b1090f8689 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14023 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-09 14:05:05 +00:00
sjplimp 819dbd184a git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14017 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-09 00:02:59 +00:00
sjplimp fafba07dff '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14011 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-08 23:53:49 +00:00
sjplimp 63759a1e85 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14010 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-08 23:53:23 +00:00
sjplimp c3e333c217 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14009 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-08 23:51:12 +00:00
sjplimp ab7ff21f9b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14008 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-08 23:50:44 +00:00
sjplimp 3cf2e3fa2e git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14007 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-08 23:50:35 +00:00
sjplimp 9a80425dcc '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14006 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-08 23:50:06 +00:00
sjplimp 807cb7200d '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14005 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-08 23:49:48 +00:00
sjplimp 11d819482c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14003 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-08 23:37:41 +00:00
stamoor 6f4af86222 Updating minimum gcc version for kokkos 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14002 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-08 22:13:59 +00:00
sjplimp 1bc274e5e1 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13996 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-03 00:19:48 +00:00
sjplimp 4be16166e9 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13994 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-03 00:14:29 +00:00
sjplimp f35b63f278 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13993 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-03 00:14:17 +00:00
sjplimp ba42504838 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13991 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-03 00:09:07 +00:00
sjplimp 7df1d7a4b8 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13988 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-02 20:44:39 +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 fbf69990db '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13985 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-02 20:41:18 +00:00
sjplimp a6b9148a1e '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13984 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-09-02 20:41:02 +00:00
sjplimp 3f79c91279 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13981 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-09-02 19:32:36 +00:00
sjplimp 1a435a401c '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13970 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-29 22:01:12 +00:00
sjplimp c5ff6e6450 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13969 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-29 22:01:04 +00:00
sjplimp 6e4f2fdf82 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13968 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-29 21:58:24 +00:00
sjplimp 21a6d444aa '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13967 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-29 21:58:08 +00:00
sjplimp c20049b583 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13965 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-08-29 00:19:08 +00:00
sjplimp 34c599b125 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13962 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-29 00:13:46 +00:00
sjplimp 4d13f3d33d '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13961 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-29 00:13:36 +00:00
sjplimp f945c6d79a '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13960 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-28 23:54:15 +00:00
sjplimp fa37609d36 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13959 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-28 23:54:06 +00:00
sjplimp 90a3eb3ae7 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13955 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-08-28 23:49:09 +00:00
sjplimp 59520bb5d2 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13954 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-28 23:48:49 +00:00
sjplimp a47262d209 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13953 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-28 23:48:36 +00:00
sjplimp 264816622a git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13946 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-08-28 20:45:18 +00:00
sjplimp 59149e72ff '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13944 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-28 20:40:16 +00:00
sjplimp b0215cc367 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13943 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-28 20:40:07 +00:00
sjplimp abcda0a1fc '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13942 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-28 20:07:56 +00:00
sjplimp c2352b946f '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13941 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-28 20:07:46 +00:00
sjplimp 75cf1f5349 '' 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13939 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2015-08-28 20:02:02 +00:00
sjplimp eee480c020 '' 
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 2015-08-28 20:01:49 +00:00
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sjplimp 63534501c2 '' 
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 2015-08-21 22:51:32 +00:00
sjplimp f5388bbbb2 '' 
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 2015-08-21 22:51:16 +00:00
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sjplimp fbaff8ec0f '' 
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 2015-08-19 16:15:31 +00:00
sjplimp e3cfdfd491 '' 
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 2015-08-19 16:15:23 +00:00