lammps:9108306c119c62fa3c387a8788b7196f2af42b5d commits - 南方科技大学 https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commits/9108306c119c62fa3c387a8788b7196f2af42b5d 2018-06-24T00:36:09+02:00 https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/9108306c119c62fa3c387a8788b7196f2af42b5d Shorter entropy/atom example 2018-06-24T00:36:09+02:00 PabloPiaggi ppiaggi@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/86519ce213f3341313922efd41407e5751036386 Rename compute to entropy/atom 2018-06-24T00:25:07+02:00 PabloPiaggi ppiaggi@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/b2e6863d937b7e902746b554e5227f3a046cee04 add reference log file. 2018-06-15T17:01:26-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/cb887d48a1bdd82f3c617afa7f69160a4fe175fc include compute pentropy/atom in src/USER-MISC/README 2018-06-15T16:55:05-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/9ef1bfe81443d2034c22fc0a566021254ce1d8b3 whitespace cleanup 2018-06-15T16:44:07-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/76b85e4d25e03b557e236491b3a97beeac66cbd7 rename source files for compute pentropy/atom to match the command name 2018-06-15T16:43:19-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/8a2faff5417641a577d2249256e9aae86ba5e431 integrate compute pentropy/atom into the documentation tree 2018-06-15T16:40:25-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/6de4569483e2ea5dd8ee6a1db5d7ee0f7efd7745 Removed unused variables - corrected documentation 2018-05-22T17:29:51+02:00 PabloPiaggi ppiaggi@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/fbc435a0cb617f6472e7ed094ed333397a76d899 Formatted according to Lammps guidelines 2018-05-22T16:40:25+02:00 PabloPiaggi ppiaggi@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/108c31e24a472aaaa84b48ed0913657fa86a3504 Moved to USER-MISC 2018-05-22T14:56:26+02:00 PabloPiaggi ppiaggi@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/e550f5120b3aff11ae376c601d921bd908743479 Updated docs 2018-05-22T12:44:40+02:00 PabloPiaggi ppiaggi@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/124641dc8af97154d5a485453a0e8106a845da9a Examples - new local option 2018-05-18T15:13:48+02:00 PabloPiaggi ppiaggi@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/59b59573a736057543bf9ea1ffa2c2c5ff2ded57 Added documentation for compute_pair_entropy_atom 2018-05-02T16:10:31+02:00 PabloPiaggi ppiaggi@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/51d2625daf39396affbac67d72b2edeaf0aeee51 First fully working version of compute_pair_entropy_atom 2018-04-30T19:40:18+02:00 PabloPiaggi ppiaggi@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/4e6188cff61c2888cb8b10504a62d03031471fd7 pair_entropy_atom workin - avg missing 2018-04-28T09:01:09+02:00 PabloPiaggi ppiaggi@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/d504dcc46595c1fda92453063763c4b0b6ff0540 Some changes to compute_pair_entropy_atom 2018-04-27T17:50:35+02:00 PabloPiaggi ppiaggi@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/8e3ba36a4f24c91b6967ed4fa7f515f3a68a11ef Merge pull request #866 from lammps/header-error-messages 2018-04-04T09:45:07-06:00 Steve Plimpton sjplimp@sandia.gov add placeholders to include files for error messges https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/12bc84163dd6aec373fdcfa15b2ed8fb1b8e0528 remove or reformulate references to USER-CUDA package, which no longer exists 2018-04-04T11:06:20-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/5221ac2d5534ef59d8dbf3d467ea63aaf212646a add placeholders to include files for error messges 2018-04-03T17:48:31-06:00 Steven J. Plimpton sjplimp@singsing.sandia.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/0bfb6f0c2a5e98ee427ee5db746fa41b462e1122 Merge branch 'master' of github.com:lammps/lammps 2018-03-30T15:22:15-06:00 Steven J. Plimpton sjplimp@singsing.sandia.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/7786cb5a4beb23e57a08303da92dbe475dc655c0 patch 30Mar18 2018-03-30T15:21:55-06:00 Steven J. Plimpton sjplimp@singsing.sandia.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/e476f89b471620204a38f70d78955d4f6a32fb5e Merge pull request #860 from lammps/doctweak 2018-03-30T10:10:34-06:00 Steve Plimpton sjplimp@sandia.gov alphabetize correction in docs https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/bfc07712cf46537313a398f87df64d69d825962f alphabetize correction in docs 2018-03-30T09:48:15-06:00 Steven J. Plimpton sjplimp@singsing.sandia.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/ee5ad9cbb3f2e9bfa9a8b617adef56454abf2528 Merge pull request #857 from lammps/resetids 2018-03-30T09:45:02-06:00 Steve Plimpton sjplimp@sandia.gov new reset_ids command and dump_modify delay option https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/a19e8fb269a0b01cb1dcf7566177f18a263c8d6a Merge branch 'master' into resetids 2018-03-30T09:15:24-06:00 Steve Plimpton sjplimp@sandia.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/81caeffb382da0974f2416a809214e4a6a9a4ee4 Merge pull request #855 from lammps/dumpinc 2018-03-30T09:07:19-06:00 Steve Plimpton sjplimp@sandia.gov new dump_modify refresh and compute displace/atom refresh commands fo… https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/a4795df5f9b232f365c87c5e23ca8fcef5b0102e complete integration of reset_ids into the documentation build system 2018-03-30T10:49:38-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/ef8423918ae2571ca59f9b1ab1ab5bc8b2abf118 fix typo 2018-03-29T17:04:53-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/0984e94c04daab963d7d83152a3eeaca927ae0a9 Merge pull request #858 from junghans/fix_return 2018-03-29T08:11:33-06:00 Steve Plimpton sjplimp@sandia.gov MathSpecial::fm_exp: fix return value on ppc64 https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/2a930dac42aee59a7b38bf1db94442108c44f80a Merge pull request #856 from akohlmey/fix_srp_bugfix 2018-03-29T08:10:55-06:00 Steve Plimpton sjplimp@sandia.gov Bugfix for SRP with triclinic cells https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/09313cf3b50ae21962b6336ae4542335254e62c0 shift files into doc/src 2018-03-28T13:35:13-06:00 Steven J. Plimpton sjplimp@singsing.sandia.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/6dff29bb9cd5f0cfc799c775d6cac9faafdd288e remove files that were added in error last summer by a pull request 2018-03-28T13:52:07-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/c664f46b31650f362cc132bcc17a3f9de923768b MathSpecial::fm_exp: fix return value on ppc64 2018-03-28T11:51:04-06:00 Christoph Junghans junghans@votca.org https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/5fd17670b112ca4db247bfc62a1b26e6f003786f new reset_ids command and dump_modify delay option 2018-03-28T11:31:35-06:00 Steven J. Plimpton sjplimp@singsing.sandia.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/b37664b44ee663a8207ada169ad39d97824d9983 squash bug in fix srp that was incorrectly comparing cutoffs for triclinic cells 2018-03-28T10:57:13-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/b5b0f67bcd7ebfdeb100ff88dfc50b907ad8c7a9 Merge pull request #852 from akohlmey/collected-small-bugfixes-and-updates 2018-03-27T15:43:57-06:00 Steve Plimpton sjplimp@sandia.gov Collected small bugfixes and cleanups https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/a524d8c19329d3bbc84fc2555c28207efed8a917 Merge pull request #854 from lammps/readdump 2018-03-27T14:39:35-06:00 Steve Plimpton sjplimp@sandia.gov new option *add keep* added to read_dump https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/b571f5423a39b57c05ee851b85d2bf0a74b7ea57 Merge pull request #850 from lammps/addlib 2018-03-27T14:39:16-06:00 Steve Plimpton sjplimp@sandia.gov a few new lib interface methods https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/2aef3a0e9670f32459dd5100dd23bb484cfcc663 new dump_modify refresh and compute displace/atom refresh commands for increm... 2018-03-27T14:37:04-06:00 Steven J. Plimpton sjplimp@singsing.sandia.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/da9f63210ef304a614914402646e188c145b1b2d rephrase error message, remove trailing whitespace 2018-03-27T13:59:21-04:00 Axel Kohlmeyer akohlmey@gmail.com