https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commits/8f4b7161c5a3aac92202798712d42bfb813354c0 2018-06-27T14:12:34-06:00 https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/8f4b7161c5a3aac92202798712d42bfb813354c0 README: add cmake 2018-06-27T14:12:34-06:00 Christoph Junghans junghans@lanl.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/9353569d302db637e3389dc5ce7658dde0c285f9 cmake: add KOKKOS_ARCH to summary 2018-06-27T13:25:56-06:00 Christoph Junghans junghans@lanl.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/868f5711a29dcf5145957671e9b4b910d1c035aa cmake: fix summary for GPU 2018-06-27T13:23:35-06:00 Christoph Junghans junghans@lanl.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/7ffab9a2285016ac95fa1f3eb7c6f468c239c952 cmake: added INJECT_KNL_FLAG option 2018-06-27T13:22:22-06:00 Christoph Junghans junghans@lanl.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/cb2cf5b7730761d11aec04265cbc754c5009a62d cmake: fixed comment 2018-06-25T06:31:09-06:00 Christoph Junghans christoph.junghans@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/c4d0994d5e60f813c7eba71a02f0d80ce16cdca4 cmake: fixed a typo 2018-06-25T06:29:24-06:00 Christoph Junghans junghans@lanl.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/0b1d4a1696ea1cf4f45415aa4e74776a09876df8 liblammps.pc: fix lib suffix 2018-06-22T17:06:39-06:00 Christoph Junghans junghans@lanl.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/264e4fd3b1b7f23e68f0206543721ecf0b328b3f cmake: fix for <cmake-3.4 2018-06-22T17:05:55-06:00 Christoph Junghans junghans@lanl.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/ce0f3daad64e681b94a208e7fa836222f53619e8 cmake: don't include quiet packages in summary 2018-06-22T11:43:52-06:00 Christoph Junghans junghans@lanl.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/cb7b23e2201744b9558d1f3cbbf4225c84d8bc25 cmake: add BUILD_EXE option 2018-06-22T11:11:09-06:00 Christoph Junghans junghans@lanl.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/3f17d33fbe0107cced8ad27da3cc3a5aca516814 cmake: add BUILD_LIB option 2018-06-22T11:06:12-06:00 Christoph Junghans junghans@lanl.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/ac41cc2c9a07c6016da237f363e3d616591451c6 cmake: add GPU_PREC status output 2018-06-22T09:02:10-06:00 Christoph Junghans junghans@lanl.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/f5f73b0172255de57df1c2b6715d972799a36612 Merge pull request #958 from ndtrung81/gpu-updates 2018-06-22T08:52:20-06:00 Steve Plimpton sjplimp@sandia.gov Bug fixes and updates to the GPU package https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/f0a2c57401e86da355d7f34ab8baf4fc5884b7d3 Merge pull request #959 from rbberger/cmake_documentation 2018-06-21T13:57:48-06:00 Steve Plimpton sjplimp@sandia.gov Expand cmake documentation https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/4ca3d30db70c6e45960475b5abb942f90f153f78 Add BUILD_MPI and BUILD_OMP in cmake docs 2018-06-21T14:45:00-04:00 Richard Berger richard.berger@temple.edu https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/65c895721fba8b69ab98a6b81803b91881f4e157 Update README.md to reflect change ENABLE_* to PKG_* 2018-06-21T12:32:46-04:00 Richard Berger richard.berger@temple.edu https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/bfacfc46be6d3dcd2120bfb55bea3aa5c620feb3 Add TOC to README.md 2018-06-21T12:32:46-04:00 Richard Berger themechatronic@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/919d95d37501be38afd206e7b1879bb58efa6736 Fill in package descriptions 2018-06-21T12:32:46-04:00 Richard Berger richard.berger@temple.edu https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/258185690d58bcef6f514eefa282da154ffc6381 Fixup GitHub markup version 2018-06-21T12:32:46-04:00 Richard Berger richard.berger@temple.edu https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/cea0227f147801e546249e0620e57f26b61bd3b5 Expand CMake build documentation 2018-06-21T12:32:32-04:00 Richard Berger richard.berger@temple.edu https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/3e58ebea4f9e86da3b06fe68c78ac99f213522e3 Merge pull request #957 from akohlmey/collected_small_fixes 2018-06-21T08:49:18-06:00 Steve Plimpton sjplimp@sandia.gov Collected small changes and bugfixes for next patch release https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/7a22612bea56bb12c29d331125d7e0fdc3024dd3 Merge pull request #956 from cnegre/latte_examples 2018-06-21T08:48:56-06:00 Steve Plimpton sjplimp@sandia.gov Added boxrel example and simplified latte.in https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/9805b5d34ab70dbff3e2023e142606a0dbff3b87 Merge pull request #955 from junghans/fortran_linking 2018-06-21T08:48:26-06:00 Steve Plimpton sjplimp@sandia.gov cmake: implicit fortran libs need to linked last https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/28504e91c0cbb1a5aa58f156d5a0efbc245a4049 Added missing source files for born/coul/wolf/cs in the gpu library 2018-06-20T15:08:24-05:00 Trung Nguyen ndactrung@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/47482afbc1a6fa36108d145c7571c2389baff86d add more thorough checks on parsing reaxff force field and signal when the... 2018-06-20T15:47:32-04:00 Axel Kohlmeyer akohlmey@gmail.com add more thorough checks on parsing reaxff force field and signal when the lgvdw setting is correct. https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/7d3a549de9fe48cd2ed33b71dd30e087c991d1c8 remove entries that are not compatible with lgvdw yes and not included in the... 2018-06-20T14:16:34-04:00 Axel Kohlmeyer akohlmey@gmail.com closes #876 https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/a9b794b2ab83e32af0386a5ad4d4a69d0305157c Updates to the core-shell gpu pair styles 2018-06-20T10:43:13-05:00 Trung Nguyen ndactrung@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/3ae8fdccd83c8eabde2739a0abf6e99dbc14f3f1 Updated the kernels for born/coul/long/cs and coul/long/cs gpu styles 2018-06-19T16:22:00-05:00 Trung Nguyen ndactrung@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/70a7b3761475f12833b10f08bc1c55f5b4ed662b Updated pair coul/long/cs and born/coul/long/cs; updated gpu neighbor builds... 2018-06-19T15:50:02-05:00 Trung Nguyen ndactrung@gmail.com Updated pair coul/long/cs and born/coul/long/cs; updated gpu neighbor builds to support core-shell styles where r2 can be tiny. https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/036647c10257a635991cdf3ecb00eafce04c663b correct sign of virial tally in fix smd. issue reported by Dinesh SD on lammp... 2018-06-19T16:19:37-04:00 Axel Kohlmeyer akohlmey@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/37b901eadbdf7acaf19634cfc1de7e8691b05c72 Added boxrel example and simplified latte.in 2018-06-19T11:12:28-06:00 Christian F. A. Negre christianfannegre@gmail.com https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/5a3ef992729ce1fe514416433916461f7a00b6c2 cmake: implicit fortran libs need to linked last 2018-06-18T16:11:31-06:00 Christoph Junghans junghans@lanl.gov https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/03a7d1cd5df653704541bdbaf8aac6a984011b99 Merge pull request #933 from rtoijala/fix_dt_reset_energy 2018-06-18T13:43:03-06:00 Steve Plimpton sjplimp@sandia.gov Limit atom energy change in fix dt/reset https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/08331da93dc44e96de97f1863541beaf05cd76e8 Merge pull request #950 from martok/subst-equal-fmt 2018-06-18T13:42:24-06:00 Steve Plimpton sjplimp@sandia.gov Add support for inline format strings to immediate variable substitution https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/ab0f3debeb4a22273b3305ed96a1b7441f58e5ae Merge pull request #948 from martok/variable-string 2018-06-18T10:50:36-06:00 Steve Plimpton sjplimp@sandia.gov Variable style 'string' substitutes variables in definition https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/fe14bfd1d20c36b515013740d9956d7f507a3d70 Merge pull request #951 from martok/meam-diaref-fix 2018-06-18T10:29:57-06:00 Steve Plimpton sjplimp@sandia.gov Apply modifications to MEAM &amp; MEAM/C as found by Kyung-Han Kang https://mirrors.sustech.edu.cn/git/11930499/lammps/-/commit/d55c7039ee60057b86590232b545733c49f2e062 Merge pull request #943 from Pakketeretet2/improve-manifoldforce-warning 2018-06-18T10:09:18-06:00 Steve Plimpton sjplimp@sandia.gov Improve fix manifoldforce warning 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