lammps:87dcef71158fe6b75b84566f17162ce02ab445ac commits - 南方科技大学 https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commits/87dcef71158fe6b75b84566f17162ce02ab445ac 2018-06-18T10:08:31-06:00 https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/87dcef71158fe6b75b84566f17162ce02ab445ac Merge pull request #952 from rbberger/coverage 2018-06-18T10:08:31-06:00 Steve Plimpton sjplimp@sandia.gov Add code coverage target to CMake https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/7e234497ff7a43fbe3136bf0fe5aa352e22fae2f Merge pull request #953 from jrgissing/bond/react-update 2018-06-18T10:08:06-06:00 Steve Plimpton sjplimp@sandia.gov Bond/react update https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/277b43b2fda301f41f44eb6b648a81f33780f32f Merge pull request #949 from jdevemy/master 2018-06-18T10:07:26-06:00 Steve Plimpton sjplimp@sandia.gov Fix the tail correction with pair_nm https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/6f61ed2af5d3b03368e7ecd5cff2b6a7f5263f98 Merge pull request #938 from akohlmey/collected-bugfixes 2018-06-18T10:06:55-06:00 Steve Plimpton sjplimp@sandia.gov Collected bugfixes and updates https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/16cc613993df7ecd39513b05a3ba5957b38f8173 Merge pull request #920 from junghans/mscg 2018-06-18T10:06:16-06:00 Steve Plimpton sjplimp@sandia.gov cmake: add DOWNLOAD_MSCG option https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/3750e0a42775e490936dc04651d455b0cf635940 resolve newton setting and parallel disparities, improve syntax error catching 2018-06-16T11:13:52-06:00 jrgissing jrgiss05@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/40c4461a7806821efac26d24da43161b497ca026 Merge pull request #17 from lammps/master 2018-06-15T23:26:01-06:00 Jacob Gissinger jrgiss05@gmail.com rebase https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/d830fc2301c52e617e0c5ad1e5a8b7ec2f8b7de1 Inline find_program() for gcovr 2018-06-16T00:40:10-04:00 Richard Berger richard.berger@temple.edu https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/3411b0e576b974115e8af778ded73ea8f472a94c add more code owners 2018-06-15T18:03:15-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/47458f1ca027df59196bfae396be3e87e54d481a Add code coverage target to CMake 2018-06-15T17:57:33-04:00 Richard Berger richard.berger@temple.edu https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/c4bcb7e73dc742887e2395b64d3e923220688725 mention requirement to come after the box creation in Restrictions section 2018-06-15T17:52:54-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/18b543179c5135d274255b5c0af4170f9884331d fix typo 2018-06-15T17:47:23-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/14c4438a72064457c8bd5326990e5e328f8f3154 update docs to reflect the state of reserving space for topology info with mo... 2018-06-15T17:46:09-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/acd20512f0ddcb079c3526615e29146275c9ed31 require that box is defined before molecule command is issued 2018-06-15T17:40:14-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/5fcdfe6dcbe6b94a40192830345ff52ff5fdd6a0 describe the use of wildcards for adapting ranges of bond types 2018-06-15T17:35:43-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/fe483a769f53d260caf1364277b4bc63287badee update makefiles in lib/linalg to support .F files in addition to .f files 2018-06-15T15:35:34-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/f312fbfe32e581ca842d55b82cab8ec12a7fa6d7 update Install.py to use a specific numbered release version instead of master 2018-06-15T15:16:10-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/479cc9424d9858f18c18a4ab56813fb627af3a14 C include 2018-06-14T13:57:10+02:00 Julien Devemy julien.devemy@uca.fr https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/673202d05f2b0732d2c1be216956a9afa7d11a2f Bugfix for pair_nm and tail correction 2018-06-14T13:44:55+02:00 Julien Devemy julien.devemy@uca.fr https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/fcf9ed0fc2f50c2d8a47b5eee64f4cc295e96656 Merge pull request #946 from b-v/patch-1 2018-06-13T13:01:15-06:00 Steve Plimpton sjplimp@sandia.gov Update README.md https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/661848139c5051869f5fe1385f12024cc9c85f9a Merge pull request #926 from ndtrung81/gpu-updates 2018-06-13T12:57:01-06:00 Steve Plimpton sjplimp@sandia.gov some updates to the GPU package https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/12d8370ec570011dacbf540460c806d0618ad061 Update README.md 2018-06-12T23:03:33+01:00 b-v b-v@users.noreply.github.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/3c781afa6c142c3a7ed0a992a8c041c2c39cc88d Switched to standard C++ header files for pair lj/expand/coul/long in USER-MISC 2018-06-09T09:41:03-05:00 Trung Nguyen ndactrung@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/37268e435b3e9c21652c161485fa0e6095e9c49d Merge remote-tracking branch 'origin/master' into mscg 2018-06-08T18:06:06-06:00 Christoph Junghans junghans@votca.org https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/29e555213c5df6532731ba18d72f3a3944169cb7 Merge pull request #924 from junghans/cmake_misc 2018-06-08T17:34:58-06:00 Steve Plimpton sjplimp@sandia.gov miscellaneous CMake Fixes https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/965ac3cedd30a3b4c9c824661fa649b9f86dde11 cmake: lower cmake requirement to 2.8.12 2018-06-08T16:18:02-06:00 Christoph Junghans junghans@lanl.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/30e3e9ab8845c897144506bb4ed8b6d81446c4e0 cmake: simplify Fortran linkage 2018-06-08T16:14:28-06:00 Christoph Junghans junghans@lanl.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/6cb0c2e9c5d41a2f3dd5bbae8ed35ae5a46de9c3 Merge pull request #937 from stanmoore1/kk_bonds 2018-06-08T15:42:40-06:00 Steve Plimpton sjplimp@sandia.gov Fix issues in Kokkos topology files https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/ebd93cac699052792f6f9f5c97aed72badca7e18 Merge pull request #930 from stanmoore1/kk_update 2018-06-08T15:42:05-06:00 Steve Plimpton sjplimp@sandia.gov Update Kokkos library to v2.7.00 https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/142de878f92948e21eacc08708ea57ccdeea94f2 Kokkos doesn't yet support map_style hash, so use may_style array by default ... 2018-06-08T09:38:16-06:00 Stan Moore stamoor@sandia.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/a4a3133b7611c1b4b8eb3697d2fff6ce20f858d9 Switched to standard C++ header files for consistency with other source files 2018-06-01T23:13:49-05:00 ndtrung ndactrung@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/fa5ecf88a5aed141a2e099fab566b8ba4576ae7d change error->all to error->warning on pair style restartinfo bug 2018-06-01T16:13:05-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/7ca794beb99edb6f40ccc9716844a4aa66fa34df whitespace cleanup 2018-06-01T16:11:43-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/56c3a0be2910f783b6ee56a8c32440aa1b242a6f support virtualenv on machines with python3 where it is called virtualenv-3 2018-05-31T19:03:28-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/cf3095e93884f246187e7ee49c41173032fa531c document restartinfo bug message, add check to Pair::write_restart as well 2018-05-31T19:02:03-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/6056c1db4d52dc97b40905a83ab7bfab8a552503 fix restart bug in pair style quip 2018-05-31T18:54:38-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/ef3c0dbf7b9c9539da2563fd3ac9349423ce1a0d Merge branch 'molecule-template-validity-checks' of... 2018-05-31T16:30:25-04:00 Axel Kohlmeyer akohlmey@gmail.com Merge branch 'molecule-template-validity-checks' of <a href="https://github.com/jrgissing/lammps" rel="nofollow noreferrer noopener" target="_blank">https://github.com/jrgissing/lammps</a> into collected-bugfixes https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/4c18a0719360a4b366c930e66c949c4916535abc Merge branch 'fix/adapt-wildcard-bondtypes' of... 2018-05-31T16:15:33-04:00 Axel Kohlmeyer akohlmey@gmail.com Merge branch 'fix/adapt-wildcard-bondtypes' of <a href="https://github.com/jrgissing/lammps" rel="nofollow noreferrer noopener" target="_blank">https://github.com/jrgissing/lammps</a> into collected-bugfixes https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/e3e040227b194470184438af7720cf85cd02a3f9 Fix issues in Kokkos topology files 2018-05-30T12:31:20-06:00 Stan Moore stamoor@sandia.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/c27e617fd83b230ea7a4fadfe2a9c42c915f1a0f Add logic to Makefile.kokkos 2018-05-29T11:33:18-06:00 Stan Moore stamoor@sandia.gov