Commit Graph

293 Commits

Author SHA1 Message Date
sjplimp f6096c899a git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10776 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-09-12 23:53:49 +00:00
sjplimp 77412e3248 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10772 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-09-12 21:11:37 +00:00
jzimmer 3d6369b7f5 Removing "stdout" files
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10771 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-09-12 19:52:08 +00:00
sjplimp a61a72719f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10765 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-09-12 18:36:54 +00:00
sjplimp e76a4743d6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10764 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-09-12 18:30:39 +00:00
sjplimp e7e46657c4 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10752 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-09-10 23:40:00 +00:00
sjplimp d9b19cf6ba git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10748 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-09-10 23:35:01 +00:00
sjplimp 61c85165fd git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10744 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-09-09 20:04:25 +00:00
rjones 5302074b3f ATC version 2.0, date: Sep1
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10709 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-09-01 08:07:54 +00:00
rjones 07e3b8c7d7 ATC version 2.0, date: Aug28
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10696 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-28 22:16:56 +00:00
rjones 31b31f0a6a ATC version 2.0, date: Aug22
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10659 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-23 00:14:37 +00:00
rjones eacdc7e58c not for release
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10656 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-22 23:54:35 +00:00
jzimmer a04f267b54 ATC version 2.0, date: Aug22
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10655 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-22 23:31:13 +00:00
jzimmer 2b9951bf56 Including info on cauchy_born examples.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10642 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-22 00:22:23 +00:00
rjones b22a8a7b61 ATC version 2.0, date: Aug21
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10639 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-21 23:06:11 +00:00
jatempl 7d0fe14fdb Updated to current set of examples.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10636 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-21 22:57:26 +00:00
rjones 2d63313b24 obsolete
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10635 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-21 22:49:06 +00:00
athomps 417d9c5756 Changed broken dimension command
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10590 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-15 21:52:09 +00:00
rjones 546d3c4e61 remove log file
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10580 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-14 01:55:53 +00:00
rjones 2629a8389d ATC version 2.0, date: Aug7
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10562 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-07 21:34:59 +00:00
rjones 666de878ad ATC version 2.0, date: Aug7
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10558 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-08-07 21:29:05 +00:00
sjplimp 6420945660 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10535 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-08-05 14:13:12 +00:00
sjplimp f839dbf2c5 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10510 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-08-01 16:25:10 +00:00
rjones 13b38d09e5 test if I can commit
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10498 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-07-30 21:52:03 +00:00
sjplimp 137702f471 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10459 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-07-29 15:10:40 +00:00
sjplimp 9e639c529d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10458 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-07-26 21:54:21 +00:00
sjplimp b12b9fced9 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10409 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-07-26 15:38:06 +00:00
sjplimp 7d3d8b5b9d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10395 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-07-25 23:59:16 +00:00
sjplimp 38305bf20c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10387 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-07-25 23:17:16 +00:00
sjplimp da8124b43b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10386 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-07-25 23:17:11 +00:00
sjplimp d7e0099571 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10265 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-07-18 13:58:43 +00:00
sjplimp 05f12d0a82 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10187 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-06-28 22:23:17 +00:00
sjplimp 859db8d77b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9915 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-05-24 20:07:56 +00:00
sjplimp b4a109bfe8 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9908 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-05-24 14:11:43 +00:00
athomps d46b65f17c Added remap keyword to change_box command
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9882 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-05-14 18:02:10 +00:00
sjplimp 3ba07ca1e6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9641 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-03-11 21:37:15 +00:00
sjplimp a920f23204 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9632 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-03-11 20:47:14 +00:00
athomps 9659cf6739 Updated fix reax/c/bonds command to remove time averaging. Update the pair_coeff command to use chemical symbols instead of integers
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9561 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-03-04 19:42:18 +00:00
athomps 3ae5083560 Updated fix reax/c/bonds command to remove time averaging. Update the pair_coeff command to use chemical symbols instead of integers
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9560 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-03-04 19:19:54 +00:00
athomps edc95d9a42 Added fix_species
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9517 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-02-15 21:29:41 +00:00
sjplimp 7ebdff8bbd git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9514 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-02-15 21:00:56 +00:00
sjplimp 2654f62891 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9513 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-02-15 20:19:33 +00:00
sjplimp 3f839cf8f0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9381 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-02-01 16:59:27 +00:00
sjplimp 3d334d0a4c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9365 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-02-01 00:06:14 +00:00
sjplimp e729c74316 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9361 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-01-31 20:15:10 +00:00
sjplimp f8ac8768d0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9358 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-01-31 19:32:24 +00:00
athomps 19a0bc490e Updated ReaxFF ZnO citation
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9331 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-01-25 20:01:07 +00:00
athomps c8086bffe6 Updated ReaxFF ZnO citation
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9330 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2013-01-25 19:39:24 +00:00
sjplimp 87f2415519 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9278 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-01-17 15:52:46 +00:00
sjplimp f51ad982f6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9277 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-01-17 15:51:57 +00:00
sjplimp 9b87f88124 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9227 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-01-04 17:58:46 +00:00
sjplimp 772e83406d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9204 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-01-03 16:22:36 +00:00
sjplimp a69bbed0b7 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9184 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2013-01-02 16:48:13 +00:00
athomps 755e63c0bd Added alternate displace mods
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9147 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-12-07 16:07:10 +00:00
sjplimp fbc3f58a05 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9027 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-10-26 23:31:09 +00:00
sjplimp ccbe10ff39 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9003 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-10-25 15:42:25 +00:00
sjplimp 6dcb5fb23d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9002 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-10-25 15:35:14 +00:00
sjplimp 5f377d2d45 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8989 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-10-22 14:37:08 +00:00
sjplimp 25f111feaa git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8985 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-10-19 16:11:21 +00:00
sjplimp f74ab7aee2 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8768 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-09-11 14:27:02 +00:00
sjplimp 17a4a224a6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8767 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-09-11 14:26:34 +00:00
sjplimp 487d2437bf git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8684 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-08-18 22:59:24 +00:00
sjplimp 127f12e6fa git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8669 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-08-15 14:18:34 +00:00
sjplimp 39818495c5 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8658 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-08-14 20:19:44 +00:00
sjplimp 5a74d4f88b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8637 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-08-13 23:53:55 +00:00
sjplimp a2f01ca576 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8636 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-08-13 23:49:26 +00:00
sjplimp c98a5d4149 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8629 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-08-13 21:44:23 +00:00
sjplimp f44c7cdc38 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8610 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-08-11 19:15:14 +00:00
sjplimp 92549d638f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8609 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-08-11 19:09:47 +00:00
sjplimp c78fd4c91f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8608 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-08-11 19:09:14 +00:00
sjplimp 19986f631d git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8607 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-08-11 19:08:10 +00:00
sjplimp eb86735df2 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8606 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-08-11 19:07:13 +00:00
sjplimp 58443251c3 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8604 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-08-11 19:05:13 +00:00
sjplimp b47e7e7bde git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8569 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-08-08 15:31:35 +00:00
sjplimp 1236aa9a4a git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8568 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-08-08 15:31:29 +00:00
sjplimp 44904c5bf3 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8163 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-05-23 16:20:25 +00:00
sjplimp 4dad31bf42 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8128 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-05-22 15:12:29 +00:00
athomps 585eaa3bee Added fix reax/c/bonds
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8051 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-05-08 15:49:51 +00:00
athomps 3f9f4ea43a Updated displace.mod
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8042 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-05-03 22:02:26 +00:00
athomps f5d54c5ac1 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7988 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-03-28 17:12:09 +00:00
athomps 268a29a99a ffield.reax made identical to ffield.reax.rdx
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7976 f3b2605a-c512-4ea7-a41b-209d697bcdaa
2012-03-23 23:25:46 +00:00
sjplimp eab4d169d0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7890 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-03-02 16:19:12 +00:00
sjplimp 90700db4cc git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7826 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-02-20 23:47:46 +00:00
sjplimp e963497c6c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7795 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-02-15 15:25:35 +00:00
sjplimp 2ab478095e git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7733 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-02-09 16:14:12 +00:00
sjplimp f1623a4962 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7625 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-01-31 22:52:15 +00:00
sjplimp 3affc90781 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7624 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-01-31 22:49:41 +00:00
sjplimp a6a995940f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7617 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-01-31 00:54:51 +00:00
sjplimp 04407d4f15 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7608 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-01-30 22:53:22 +00:00
sjplimp c07292f8e6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7601 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-01-28 00:23:16 +00:00
sjplimp cc84c41ef0 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7547 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-01-12 19:12:10 +00:00
sjplimp ec06aed001 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7546 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-01-12 19:03:12 +00:00
sjplimp 34c1930201 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7497 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-01-10 01:54:14 +00:00
sjplimp 9a3ab257bd git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7495 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-01-10 01:39:21 +00:00
sjplimp 3cf4cb2706 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7489 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-01-09 23:45:41 +00:00
sjplimp 876112a0c6 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7488 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-01-09 23:45:25 +00:00
sjplimp 0af770b923 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7432 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2012-01-06 17:34:26 +00:00
sjplimp a55728fa74 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7274 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-12-02 15:47:54 +00:00
sjplimp 70a85bddfd git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7256 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-12-01 14:58:11 +00:00
sjplimp 789f069c2b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7062 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2011-10-10 16:33:07 +00:00