lammps:2d2cb46dc01efdceec665404b3cf32233ac0b6a7 commits - 南方科技大学 https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commits/2d2cb46dc01efdceec665404b3cf32233ac0b6a7 2020-02-27T08:58:09+01:00 https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/2d2cb46dc01efdceec665404b3cf32233ac0b6a7 move release date 2020-02-27T08:58:09+01:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/26f11f19a7ed49221a85ae8d0d9173748a9814aa update LAMMPS version string 2020-02-25T15:04:56+01:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/7434267f579095d4712e90d6a5bdf60b23c12900 Merge pull request #1886 from mariellaippolito/master 2020-02-18T11:00:39-05:00 Axel Kohlmeyer akohlmey@gmail.com Updates to qmmm package https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/be847dc12dbe4b8241ef21d44469a42ed15998de Merge pull request #1885 from akohlmey/remove-cpp11-check 2020-02-18T10:59:56-05:00 Axel Kohlmeyer akohlmey@gmail.com Remove C++11 check for stable release https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/012dce93a01e8ce09d2d4ed4b7f13ae07e4beae6 Update package build docs for building the USER-QMMM package 2020-02-18T15:12:31+01:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/cc3a7c37cb64773524c2bdb9b02c4a53080728f8 more lib compilation updates 2020-02-18T11:16:08+01:00 mariella ippolito mippolit@r033c01s03.galileo.cineca.it https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/36458a95b7c4c1f1647419e3fd04e7632ecdac57 Updated 2020-02-18T10:59:51+01:00 mariella ippolito mippolit@r033c01s03.galileo.cineca.it https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/387a28315708a962f59d26405de5f7f6ade99844 more lib compilation updates 2020-02-18T10:55:13+01:00 mariella ippolito mippolit@r033c01s03.galileo.cineca.it https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/82b57bd3b8b7c8f15b4fd7fecdd63bcd5c53e031 Upfated Makefile.foo inside lib/qmmm 2020-02-18T10:47:04+01:00 mariella ippolito mippolit@r033c01s03.galileo.cineca.it https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/960553db58bd16c8ea395f0b2d3b761ad369efbc remove C++11 check for stable release 2020-02-17T15:09:24-05:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/ad125bf36a292215b60a65062125f3e5741c5e40 Merge pull request #1881 from akohlmey/next_lammps_version 2020-02-17T14:53:17-05:00 Axel Kohlmeyer akohlmey@gmail.com Update version string for next patch release https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/fe6f6b300259b4416d1af6085b9c336b4501c36e Merge pull request #1869 from akohlmey/doc-continued-refactoring 2020-02-17T13:06:07-05:00 Axel Kohlmeyer akohlmey@gmail.com More documentation refactoring for embedding math expressions https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/f9bee338ddd909db09817464e2f6c47ba0f30a63 Merge pull request #1875 from akohlmey/collected-small-fixes 2020-02-17T11:40:27-05:00 Axel Kohlmeyer akohlmey@gmail.com Collected small bug fixes and updates https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/f69c6196a0d10e2b3599fe13ae7936025d158b1a Merge branch 'master' into doc-continued-refactoring 2020-02-17T17:37:10+01:00 Axel Kohlmeyer akohlmey@gmail.com # Conflicts: # doc/src/compute_fep.rst https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/c8561ecef08cf7ef35388da8a283dac0660398b3 Merge pull request #1879 from akohlmey/user-plumed-update 2020-02-17T11:32:10-05:00 Axel Kohlmeyer akohlmey@gmail.com Update USER-PLUMED to include support for version 2.6.0. Fix bug in API check https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/d01b0ed543de5bbe58ed4f797c1ae8fc992befed Merge pull request #1882 from agiliopadua/docs 2020-02-17T11:31:43-05:00 Axel Kohlmeyer akohlmey@gmail.com Convert documentation of compute_fep, pair_fep_soft, pair_nm to mathjax https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/b30670d405461e10e4fb956a3e8d463bc50658d3 correct some grammar and style issues in describing using/building LAMMPS on ... 2020-02-17T10:27:57+01:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/4a2f05d3337266d48c3856436c9af3d7cd3eb458 convert pair styles srp to tersoff 2020-02-16T13:42:37-05:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/3f5bb96aed761621a4d08928396cbd76445e613e pair ufm to pair zbl 2020-02-15T16:47:32-05:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/a5081385107680871f648b097f75978261f57b5b convert wall fixes to embedded math 2020-02-15T12:13:32-05:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/b25f781071a71bde5746b339e5fe536455ccd08d convert docs for more fixes 2020-02-15T11:35:21-05:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/0e2604fc80519d92ba3391249d48b9f8442e832d Convert documentation of compute_fep and pair_fep_soft to mathjax 2020-02-15T16:19:39+01:00 Agilio Padua agilio.padua@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/fd8cd6faa57c28fcbf616ff01eacd3fc74243c46 typeset hyperdynamics fix docs with embedded math 2020-02-15T06:50:04-05:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/b0de48e47f94c4e5b2344a490284994c3043dd30 convert some more fixes 2020-02-15T02:31:50-05:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/f4b64e8d916e190d081f0d27282cba409b4c40d4 fix typo in comment 2020-02-14T18:29:11-05:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/07c5adc57ac4f71eb6bf37a675170becaf873b90 we need more specific matches to correctly handle TIME and TIMESTEP items 2020-02-14T16:07:34-05:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/381ac888c88cd3c803930c457bffd0d80c24cf80 initialize cut_respa to NULL in constructor to avoid uninitialized access 2020-02-14T15:51:38-05:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/9bff431553e8993234681e2160a956c57c371103 make sure coulomb tables are initialized in all coul/long GPU pair styles 2020-02-14T15:50:49-05:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/0b57549f4caa77846f99d71541b5d7114cf734cd must generate coulomb tables with pair style lj/class2/coul/long/gpu 2020-02-14T15:34:12-05:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/c23f164639698e14e679781420c220fc2d041b83 Increase portability to more C++ compilers 2020-02-14T13:40:31-05:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/2de515c67135b38570d6c3312bb5169de8e3e479 improve layout 2020-02-14T12:31:55+01:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/74a2fd973b41ebc614561aa2f0c44e208348b5f3 convert docs for fixes eos/cv, eos/table/rx, gcmc, grem, langevin/spin, lb/fluid 2020-02-14T12:27:55+01:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/c47245c629b882d716f1010f653c1eee78461c1c update/correct lammps executable manpage 2020-02-14T10:33:08+01:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/d7a7c103caf6e66d3ebbda2da7f64d75a24672a3 Update version string for next patch release 2020-02-14T09:55:56+01:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/7b32b1e595e2bfbb5350f28e615958cf384d56c5 Update pair_body_rounded_polyhedron docs 2020-02-14T09:52:06+01:00 Richard Berger richard.berger@temple.edu https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/b1493d651f21d665d60aafb4ffe273838326bafe Update pair_body_rounded_polygon docs 2020-02-14T09:44:03+01:00 Richard Berger richard.berger@temple.edu https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/f70e39c366f2ca07bd828a5b2b1b38c3d6bceb07 update fix ave/correlate/long docs to include info about limitations in outpu... 2020-02-14T09:30:06+01:00 Axel Kohlmeyer akohlmey@gmail.com update fix ave/correlate/long docs to include info about limitations in output options vs. ave/correlate https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/147d430a6de63b0c8071b766f4fd20d9764c211d Update pair_body_nparticle docs 2020-02-14T09:27:55+01:00 Richard Berger richard.berger@temple.edu https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/e339e1735d97bc6caa76cf1ea0946bdb8126d283 Update pair_beck docs 2020-02-14T09:19:32+01:00 Richard Berger richard.berger@temple.edu https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/076c28538c44f2129ede1949cc4073b73497e52c Merge branch 'read_dump_item_time' of https://github.com/mkanski/lammps into ... 2020-02-13T13:13:24-05:00 Axel Kohlmeyer akohlmey@gmail.com