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lammps
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83 Commits

Author SHA1 Message Date
Axel Kohlmeyer 4437f16e08
remove references to non-existing folders 2022-03-31 17:49:24 -04:00
Axel Kohlmeyer fb8074d294
renormalize line endings. add .gitattributes to configure them explicitly 2022-03-17 18:21:31 -04:00
Axel Kohlmeyer 6ceedb62be
rename USER-REAXC to REAXFF 2021-06-29 19:37:55 -04:00
Axel Kohlmeyer dc3efd17d2
rename USER-MEAMC to MEAM and pair style meam/c to meam (keeping meam/c as an alias) 2021-06-29 16:59:05 -04:00
Axel Kohlmeyer 63ecb77303
fix some more URLs 2021-05-24 15:38:27 -04:00
Axel Kohlmeyer 18091f15e0
Merge branch 'master' into collected-small-changes 2020-10-14 13:11:30 -04:00
Axel Kohlmeyer 7f804512b7
rename to be consistent with example log files 2020-10-14 13:11:13 -04:00
Axel Kohlmeyer 60ff1380d7
update log files for bench/POTENTIALS 2020-10-14 11:04:51 -04:00
Axel Kohlmeyer 1e2c8ce2e6
correct data file for USER-EFF 2020-10-14 08:15:59 -04:00
Axel Kohlmeyer 3894212712
correctly use REBO potential 2020-10-14 08:04:57 -04:00
Axel Kohlmeyer a002194e26
remove outdated "bench/KEPLER" folder 2020-10-14 07:57:32 -04:00
Axel Kohlmeyer a8c0e8d30a
FERMI GPU hardware is no longer supported by CUDA drivers and toolkit 2020-06-14 11:05:29 -04:00
Axel Kohlmeyer 3083306dbc
remove obsolete inputs and logs 2020-06-14 11:04:00 -04:00
Axel Kohlmeyer d2404cc88e
replace more potentials with symlinks 2020-06-14 11:02:41 -04:00
Axel Kohlmeyer ce02cb58a5
replace explicit potential files with links to the potentials folder 2019-09-06 13:37:49 -04:00
Axel Kohlmeyer b2194d617b update logs for eff and reax 2018-03-21 21:26:46 -04:00
Axel Kohlmeyer 07a8e31623 update BOP input and log files 2018-03-21 19:45:52 -04:00
Axel Kohlmeyer a19f550c1e update the bop potential file and input 2018-03-21 19:40:03 -04:00
Axel Kohlmeyer a585871251 update logfiles 2018-03-21 19:04:06 -04:00
Axel Kohlmeyer ad87b632ef update spc/e data and reax/c input 2018-03-21 19:03:02 -04:00
Axel Kohlmeyer 57dbad59c0 update missing data files and adjust input files for potentials comparison 2018-03-21 16:03:21 -04:00
Axel Kohlmeyer bdd2f3a6b2 remove references to Make.py and USER-CUDA 2017-07-20 12:25:42 -04:00
Richard Berger d6800405a5 Fix more typos in examples 2017-03-07 00:57:23 -05:00
Steve Plimpton 04f5eadcf1 added LAST option to dump_modify thresh, more restart info printed out to screen 2016-10-11 12:39:52 -06:00
sjplimp 77fe3db02c git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14608 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-02-15 17:21:52 +00:00
sjplimp 85a60a9415 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14607 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2016-02-15 17:21:29 +00:00
sjplimp 480fdccae1 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13524 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-07-06 15:54:38 +00:00
sjplimp b206e23b33 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13468 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-05-15 17:23:18 +00:00
sjplimp b8fbd034c7 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13240 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-03-17 16:06:46 +00:00
sjplimp db1cdb53f5 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12917 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2015-01-09 16:16:10 +00:00
sjplimp 3593159f19 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12816 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-12-05 21:46:04 +00:00
sjplimp bd26134155 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12605 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-10-07 17:30:37 +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 87863d5451 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12499 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-11 20:33:07 +00:00
sjplimp 1aa7f33727 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12498 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-11 20:32:47 +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 5b648b760b git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12490 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-11 16:28:03 +00:00
sjplimp f4f1cfe220 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12489 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-11 16:25:06 +00:00
sjplimp 356bcc1f01 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12488 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-11 16:09:48 +00:00
sjplimp 6c767f30b1 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12487 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-11 16:05:10 +00:00
sjplimp 4fea80fecf git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12486 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-11 16:03:27 +00:00
sjplimp 705237ae9e git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12485 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-11 16:00:27 +00:00
sjplimp d143c88dff git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12401 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-04 15:58:14 +00:00
sjplimp 3b20ca9f1a git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12400 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-04 15:50:18 +00:00
sjplimp dfde50e9f7 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12396 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-04 15:41:42 +00:00
sjplimp 0c0e5c356f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12394 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-04 15:39:04 +00:00
sjplimp f3e11380a7 git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12393 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-04 15:21:05 +00:00
sjplimp 34d05e299f git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12391 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-04 14:28:10 +00:00
sjplimp eca79d427e git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12390 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-09-04 14:21:17 +00:00
sjplimp 63aad352fa git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12067 f3b2605a-c512-4ea7-a41b-209d697bcdaa 2014-06-04 15:52:51 +00:00