jianmu
/
lammps
forked from lijiext/lammps
1
0
Fork 0
Code Issues Pull Requests Packages Projects Releases Wiki Activity
1,651 Commits 9 Branches 198 Tags 1.1 GiB
Commit Graph

1651 Commits

Author SHA1 Message Date
sjplimp ef7b2c589c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2854 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-06-04 16:54:18 +00:00
sjplimp d089e246b9 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2853 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-06-04 16:53:17 +00:00
sjplimp 0ddeb592a1 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2852 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-06-04 16:52:20 +00:00
sjplimp b5f579d0fb git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2850 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-06-03 20:50:48 +00:00
sjplimp 4a4c5b8dd4 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2845 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-06-03 20:33:21 +00:00
sjplimp aef437dc39 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2844 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-06-03 20:33:16 +00:00
sjplimp 482c0912d6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2842 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-06-03 19:59:51 +00:00
sjplimp 97e7724158 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2841 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-06-03 19:59:19 +00:00
athomps 22729d0a34 improved portability of ReaxFF 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2840 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2009-06-02 18:12:05 +00:00
athomps e09138e044 Improved portability of ReaxFF implementation. 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2839 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2009-06-02 18:09:07 +00:00
athomps b27c1ccccf Improved portability of ReaxFF 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2838 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2009-06-02 18:00:10 +00:00
athomps 2c6c87a168 Improved portability of ReaxFF on IBM platforms. 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2837 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2009-06-02 17:54:19 +00:00
athomps c659a9750a Updated documentation for compiling ReaxFF library. 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2836 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2009-06-02 17:52:25 +00:00
athomps 06110955d2 Improved portability for _IBM platform. 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2835 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2009-06-02 17:51:22 +00:00
athomps 1293b29453 Added Strachan reference. 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2834 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2009-06-01 20:16:04 +00:00
sjplimp 1735c2fb13 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2832 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-21 15:08:44 +00:00
athomps 4b85fae4ad Updated reaxFF references. 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2831 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2009-05-20 22:43:42 +00:00
sjplimp d288757018 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2829 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-19 15:19:41 +00:00
sjplimp c0a48708c9 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2827 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-19 15:04:19 +00:00
sjplimp 9b5a353cc4 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2826 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-19 15:03:50 +00:00
sjplimp c840692377 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2825 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-19 15:02:32 +00:00
sjplimp 4fb6be1468 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2824 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-19 15:01:02 +00:00
sjplimp b6cd5233bd git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2823 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-19 15:00:00 +00:00
sjplimp bf4a17aa0f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2822 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-19 14:59:04 +00:00
sjplimp 06396c8958 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2821 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-19 14:58:16 +00:00
sjplimp b1ac804d3c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2820 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-19 14:57:46 +00:00
sjplimp 65317f1486 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2819 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-19 14:43:06 +00:00
pscrozi a12fe07b28 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2818 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-14 19:24:46 +00:00
athomps f06cc9667e Changed how x0 is shifted under PBC in linesearch 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2817 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2009-05-14 02:23:26 +00:00
sjplimp b421696569 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2815 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-12 13:34:00 +00:00
sjplimp acbd3c0081 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2814 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-12 13:33:47 +00:00
sjplimp d2932e8642 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2813 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-12 13:24:20 +00:00
sjplimp ccc857bd4e git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2805 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-05-06 13:07:08 +00:00
athomps e006e2c426 Added Erhart/Albe SiC tersoff potential from Felix Ulomek 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2804 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2009-05-05 17:18:23 +00:00
athomps 7b788ebd0e Added a fix to output ReaxFF bond-order information. 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2798 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2009-04-30 21:46:49 +00:00
sjplimp 180f47525d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2795 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-30 20:59:46 +00:00
athomps e08729c96f Created fix_reax_write_bonds 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2794 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2009-04-30 19:48:26 +00:00
athomps 883b5ae3a7 Added fix write/reax/bonds and reordered TATB atoms 
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2793 f3b2605a-c512-4ea7-a41b-209d697bcdaa
 2009-04-30 17:01:34 +00:00
sjplimp d11c29e95b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2791 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-30 16:53:21 +00:00
sjplimp 55ecf78cdc git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2790 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-30 16:53:04 +00:00
sjplimp bbd7007b2e git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2789 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-29 17:41:26 +00:00
sjplimp 8af12f9e13 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2785 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-29 17:29:52 +00:00
sjplimp a4d85b50ac git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2783 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-29 17:22:30 +00:00
sjplimp d4991f42ec git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2782 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-29 17:19:57 +00:00
sjplimp c0b782aaa2 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2781 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-29 16:54:14 +00:00
sjplimp 16ef076c31 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2780 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-29 16:54:06 +00:00
sjplimp 8515f83a1c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2777 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-28 19:50:15 +00:00
sjplimp 1904459e45 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2776 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-28 19:46:52 +00:00
sjplimp 2dacebfcd0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2775 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-28 14:56:27 +00:00
sjplimp 00efe14d6d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2774 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2009-04-28 14:51:48 +00:00