Commits · 6f61ed2af5d3b03368e7ecd5cff2b6a7f5263f98 · 郑智淋 / lammps · GitLab

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Jun 19, 2018
- Merge pull request #938 from akohlmey/collected-bugfixes · 6f61ed2a
  Steve Plimpton authored Jun 18, 2018
  6f61ed2a
- Merge pull request #920 from junghans/mscg · 16cc6139
  Steve Plimpton authored Jun 18, 2018
  16cc6139
Jun 16, 2018
- add more code owners · 3411b0e5
  Axel Kohlmeyer authored Jun 15, 2018
  
  3411b0e5
- mention requirement to come after the box creation in Restrictions section · c4bcb7e7
  Axel Kohlmeyer authored Jun 15, 2018
  
  c4bcb7e7
- fix typo · 18b54317
  Axel Kohlmeyer authored Jun 15, 2018
  
  18b54317
- update docs to reflect the state of reserving space for topology info with molecule files · 14c4438a
  Axel Kohlmeyer authored Jun 15, 2018
  
  14c4438a
- require that box is defined before molecule command is issued · acd20512
  Axel Kohlmeyer authored Jun 15, 2018
  
  acd20512
- describe the use of wildcards for adapting ranges of bond types · 5fcdfe6d
  Axel Kohlmeyer authored Jun 15, 2018
  
  5fcdfe6d
- update makefiles in lib/linalg to support .F files in addition to .f files · fe483a76
  Axel Kohlmeyer authored Jun 15, 2018
  
  fe483a76
- update Install.py to use a specific numbered release version instead of master · f312fbfe
  Axel Kohlmeyer authored Jun 15, 2018
  
  f312fbfe
Jun 14, 2018
- Merge pull request #946 from b-v/patch-1 · fcf9ed0f
  Steve Plimpton authored Jun 13, 2018
  fcf9ed0f
- Merge pull request #926 from ndtrung81/gpu-updates · 66184813
  Steve Plimpton authored Jun 13, 2018
  66184813
Jun 13, 2018
- Update README.md · 12d8370e
  b-v authored Jun 12, 2018
  
  12d8370e
Jun 09, 2018
- Switched to standard C++ header files for pair lj/expand/coul/long in USER-MISC · 3c781afa
  Trung Nguyen authored Jun 09, 2018
  
  3c781afa
- Merge remote-tracking branch 'origin/master' into mscg · 37268e43
  Christoph Junghans authored Jun 08, 2018
  
  37268e43
- Merge pull request #924 from junghans/cmake_misc · 29e55521
  Steve Plimpton authored Jun 08, 2018
  29e55521
- cmake: lower cmake requirement to 2.8.12 · 965ac3ce
  Christoph Junghans authored Jun 08, 2018
  
  965ac3ce
- cmake: simplify Fortran linkage · 30e3e9ab
  Christoph Junghans authored Jun 08, 2018
  
  30e3e9ab
- Merge pull request #937 from stanmoore1/kk_bonds · 6cb0c2e9
  Steve Plimpton authored Jun 08, 2018
  6cb0c2e9
- Merge pull request #930 from stanmoore1/kk_update · ebd93cac
  Steve Plimpton authored Jun 08, 2018
  ebd93cac
Jun 08, 2018
- Kokkos doesn't yet support map_style hash, so use may_style array by default if Kokkos is enabled · 142de878
  Stan Moore authored Jun 08, 2018
  
  142de878
Jun 02, 2018
- Switched to standard C++ header files for consistency with other source files · a4a3133b
  ndtrung authored Jun 01, 2018
  
  a4a3133b
- change error->all to error->warning on pair style restartinfo bug · fa5ecf88
  Axel Kohlmeyer authored Jun 01, 2018
  
  fa5ecf88
- whitespace cleanup · 7ca794be
  Axel Kohlmeyer authored Jun 01, 2018
  
  7ca794be
Jun 01, 2018
- support virtualenv on machines with python3 where it is called virtualenv-3 · 56c3a0be
  Axel Kohlmeyer authored May 31, 2018
  
  56c3a0be
- document restartinfo bug message, add check to Pair::write_restart as well · cf3095e9
  Axel Kohlmeyer authored May 31, 2018
  
  cf3095e9
- fix restart bug in pair style quip · 6056c1db
  Axel Kohlmeyer authored May 31, 2018
  
  6056c1db
- Merge branch 'molecule-template-validity-checks' of... · ef3c0dbf
  Axel Kohlmeyer authored May 31, 2018
  ef3c0dbf
- Merge branch 'fix/adapt-wildcard-bondtypes' of... · 4c18a071
  Axel Kohlmeyer authored May 31, 2018
  4c18a071
May 31, 2018
- Fix issues in Kokkos topology files · e3e04022
  Stan Moore authored May 30, 2018
  
  e3e04022
May 30, 2018
- Add logic to Makefile.kokkos · c27e617f
  Stan Moore authored May 29, 2018
  
  c27e617f
May 27, 2018
- also include consistent type checks · 95e259fe
  jrgissing authored May 26, 2018
  
  95e259fe
- molecule templates sanity checks · 69a9f1bf
  jrgissing authored May 26, 2018
  
  69a9f1bf
- Merge pull request #14 from lammps/master · e7773808
  Jacob Gissinger authored May 26, 2018
  e7773808
- Merge pull request #929 from stanmoore1/snap_fix · 0368202d
  Steve Plimpton authored May 26, 2018
  0368202d
May 26, 2018
- fix/adapt wildcard bondtypes · 3ba87e52
  jrgissing authored May 25, 2018
  
  3ba87e52
- Update Kokkos library to v2.7.00 · 1422b041
  Stan Moore authored May 25, 2018
  
  1422b041
May 25, 2018
- Fix possible MPI deadlock in pair_snap · 18c6d7f2
  Stan Moore authored May 24, 2018
  
  18c6d7f2
- Restore workaround for compiler bug in pair_snap.h · 1b4068b5
  Stan Moore authored May 24, 2018
  
  1b4068b5
May 24, 2018
- Updated UCL_Device built with OpenCL to use platforms that support accelerators by default · 341fa160
  Trung Nguyen authored May 23, 2018
  
  341fa160

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