sjplimp
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1dc3bee64c
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9609 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-07 17:45:43 +00:00 |
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sjplimp
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e2a79bb807
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9607 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-07 17:43:42 +00:00 |
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sjplimp
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bc6f0b436a
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9606 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-07 17:43:41 +00:00 |
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sjplimp
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9f2a3147f1
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9605 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-07 17:33:09 +00:00 |
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sjplimp
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91b7613960
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9604 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-07 17:32:03 +00:00 |
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sjplimp
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3d25c94f33
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9603 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-07 17:24:33 +00:00 |
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sjplimp
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20ad5bdda3
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9602 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-07 16:16:01 +00:00 |
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sjplimp
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0316286abb
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9601 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-07 15:50:09 +00:00 |
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sjplimp
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e21af691be
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9600 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-07 15:38:26 +00:00 |
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sjplimp
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7309370570
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9599 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-07 15:35:07 +00:00 |
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pscrozi
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d296cb9eb1
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9598 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 21:33:57 +00:00 |
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pscrozi
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ed72c6c5ae
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Optimizations to kspace_style MSM, including improving the single-core performance and increasing the parallel scalability. A bug in MSM for mixed periodic and non-periodic boundary conditions was also fixed.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9597 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 21:12:28 +00:00 |
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pscrozi
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a3d29c1665
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9596 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 19:58:37 +00:00 |
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sjplimp
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70fbc16e7d
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9595 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 17:42:05 +00:00 |
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sjplimp
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a5e982730c
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9594 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 17:38:18 +00:00 |
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sjplimp
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e2736ada2c
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9593 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 17:31:00 +00:00 |
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sjplimp
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2d00a52dbe
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9592 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 17:25:59 +00:00 |
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sjplimp
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7296a641ff
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9591 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 17:22:33 +00:00 |
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sjplimp
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72c9d2d11f
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9590 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 17:20:27 +00:00 |
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sjplimp
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f611f9a58f
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9589 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 17:18:26 +00:00 |
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sjplimp
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5404f3c1b5
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9588 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 17:17:34 +00:00 |
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sjplimp
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db2aafd8f4
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9587 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 17:17:22 +00:00 |
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sjplimp
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dfd6d4b943
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9586 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 17:14:09 +00:00 |
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sjplimp
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986c317c5d
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9585 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 16:52:56 +00:00 |
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sjplimp
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4819ef9e1e
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9584 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 16:46:43 +00:00 |
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sjplimp
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18a04f2c5c
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9583 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 16:44:56 +00:00 |
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sjplimp
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ead9fe7029
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9582 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 16:44:51 +00:00 |
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sjplimp
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adb129fe99
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9581 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 16:44:43 +00:00 |
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sjplimp
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f4b458219d
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9580 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 00:24:26 +00:00 |
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sjplimp
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df0ad75e6b
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9579 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-06 00:24:19 +00:00 |
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sjplimp
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fd612bb393
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9578 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-05 21:15:00 +00:00 |
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sjplimp
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0a364f2bae
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9576 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-05 00:18:45 +00:00 |
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sjplimp
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28bcd038af
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9575 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-05 00:18:44 +00:00 |
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sjplimp
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df40403cd9
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9574 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-05 00:16:06 +00:00 |
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sjplimp
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32ba98e947
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9573 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-05 00:15:17 +00:00 |
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sjplimp
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1fe23b3041
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9572 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-05 00:13:42 +00:00 |
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sjplimp
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30370bb2aa
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9571 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-05 00:10:59 +00:00 |
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sjplimp
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6903543002
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9570 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-05 00:10:51 +00:00 |
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sjplimp
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d4b33beba9
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9569 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-05 00:05:59 +00:00 |
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sjplimp
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b116401f4d
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9568 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-05 00:00:59 +00:00 |
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sjplimp
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a746d1ce48
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9567 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-05 00:00:50 +00:00 |
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sjplimp
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a5c6bfb1c5
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9566 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-04 23:09:29 +00:00 |
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sjplimp
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fe7a7c25f1
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9564 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-04 21:43:08 +00:00 |
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sjplimp
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561b3086f8
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9563 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-04 21:43:07 +00:00 |
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sjplimp
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e57c8ddef1
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9562 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-04 21:38:12 +00:00 |
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athomps
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9659cf6739
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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
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2013-03-04 19:42:18 +00:00 |
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athomps
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3ae5083560
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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
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2013-03-04 19:19:54 +00:00 |
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athomps
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cc237b52a6
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Removed reax/c time-averaging. Replaced integers with chemical symbols in pair_coeff command for reax/c (this actually happended on 2/25/2013, but should have happened now).
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9559 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-04 18:43:46 +00:00 |
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athomps
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dd0d1ab850
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Removed reax/c time-averaging and merged reax and reax/c for fix reax/bonds and replaced integers with chemical symbols in pair_coeff command for reax/c
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9558 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-03-04 18:34:42 +00:00 |
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athomps
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538bd16793
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Fixed clashes between #define constants in header files
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9557 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2013-02-26 00:02:36 +00:00 |