Commits · 6833d6def68497a85d87591b8872a38b3e37fe54 · 郑智淋 / lammps · GitLab

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Jul 30, 2019
- Merge branch 'master' into kim-simulator-models · 6833d6de
  Axel Kohlmeyer authored Jul 29, 2019
  6833d6de
- Merge pull request #1542 from akohlmey/improve-include-consistency · 2e685083
  Axel Kohlmeyer authored Jul 29, 2019
  2e685083
- Merge pull request #1548 from jrgissing/bond/react-clarify-how-stabilization-works · 7043b9f6
  Axel Kohlmeyer authored Jul 29, 2019
  7043b9f6
- Merge pull request #1576 from Adrian-Diaz/patch-rcb · 91e0bebd
  Axel Kohlmeyer authored Jul 29, 2019
  91e0bebd
- Merge pull request #1581 from akohlmey/comm-cutoff-with-bond · d6886243
  Axel Kohlmeyer authored Jul 29, 2019
  d6886243
- Merge pull request #1588 from akohlmey/cmake-installation-folder-bugfix · 191044ab
  Axel Kohlmeyer authored Jul 29, 2019
  191044ab
- Adjust write_echo() within kim_query · c03e9c97
  Ryan S. Elliott authored Jul 29, 2019
  
  c03e9c97
- make kim_query log of variable setting look more like other KIM log messages · 2ffc3529
  Axel Kohlmeyer authored Jul 29, 2019
  2ffc3529
- Merge branch 'kim-simulator-models' of github.com:ellio167/lammps into kim-simulator-models · 514608b8
  Axel Kohlmeyer authored Jul 29, 2019
  
  514608b8
- add write_echo() method to Input class for logging implicit commands where the... · ea4107c4
  Axel Kohlmeyer authored Jul 29, 2019
  ea4107c4
- Add details about installing models to KIM example input · 0f059c56
  Ryan S. Elliott authored Jul 29, 2019
  
  0f059c56
- Add logging to kim_query (compile error at moment) · 2afc498a
  Ryan S. Elliott authored Jul 29, 2019
  
  2afc498a
- add false positive · e0b20c4f
  Axel Kohlmeyer authored Jul 29, 2019
  
  e0b20c4f
- provide some more details about 'make install' with CMake · 6a1b6163
  Axel Kohlmeyer authored Jul 29, 2019
  
  6a1b6163
- .frc files only need to be installed if msi2lmp is built · 96e0b03e
  Axel Kohlmeyer authored Jul 29, 2019
  
  96e0b03e
- need to install some base C++ headers for C++ library use · 53075587
  Axel Kohlmeyer authored Jul 29, 2019
  
  53075587
- kim_query check for empty query result · a0abd270
  Ryan S. Elliott authored Jul 29, 2019
  
  a0abd270
Jul 29, 2019
- Merge branch 'improve-include-consistency' of github.com:akohlmey/lammps into... · 838ea2ec
  Axel Kohlmeyer authored Jul 29, 2019
  838ea2ec
Jul 27, 2019
- avoid recursive header inclusion · 0f10c55c
  Axel Kohlmeyer authored Jul 26, 2019
  
  0f10c55c
- Merge branch 'master' into improve-include-consistency · 9477df42
  Axel Kohlmeyer authored Jul 26, 2019
  
  9477df42
- Merge pull request #1580 from stanmoore1/kk_cuda_aware · 35cee904
  Axel Kohlmeyer authored Jul 26, 2019
  35cee904
- Fix typo · f2dbe186
  Stan Moore authored Jul 26, 2019
  
  f2dbe186
- Cleanup of CUDA-aware MPI code · e816f0e7
  Stan Moore authored Jul 26, 2019
  
  e816f0e7
- Add MPI_Get_library_version to STUBS library · 0ba854b4
  Stan Moore authored Jul 26, 2019
  
  0ba854b4
- Merge pull request #1587 from valleymouth/bug_nve · f4a98417
  Axel Kohlmeyer authored Jul 26, 2019
  f4a98417
- Better workaround for Spectrum MPI · 17d6b317
  Stan Moore authored Jul 26, 2019
  
  17d6b317
- Update kim_init to use KIM::Collections::GetItemType() · 6a5902ec
  Ryan S. Elliott authored Jul 26, 2019
  6a5902ec
- Add warning to cmake if PKG_KIM=ON but DOWNLOAD_KIM not set & KIM is not found · 010cb0ed
  Ryan S. Elliott authored Jul 26, 2019
  010cb0ed
Jul 26, 2019
- correct shell profile variables to point to the installation directory · 0bb9df76
  Axel Kohlmeyer authored Jul 26, 2019
  
  0bb9df76
- Revert "new versions of jacobi() method" · 8d4f1896
  Axel Kohlmeyer authored Jul 26, 2019
  8d4f1896
- Fixing remaining wrong indexing of rmass in nve/kk. · ca1fece8
  Denis Taniguchi authored Jul 26, 2019
  
  ca1fece8
- simplify installation of data folders and make it consistent · e8d891c0
  Axel Kohlmeyer authored Jul 26, 2019
  e8d891c0
- make include files independent of previously included headers. include them... · 47689b4a
  Axel Kohlmeyer authored Jul 26, 2019
  47689b4a
- Fixing bug in nve/kk when using rmass. · 179b5071
  Denis Taniguchi authored Jul 26, 2019
  
  179b5071
- Merge pull request #1584 from akohlmey/bonded-hybrid-restart · 9bedd0d0
  Axel Kohlmeyer authored Jul 25, 2019
  9bedd0d0
- fix spelling errors and false positives · 52e17554
  Axel Kohlmeyer authored Jul 25, 2019
  
  52e17554
- doc spelling update · 60dfa7da
  Ryan S. Elliott authored Jul 25, 2019
  
  60dfa7da
- revise logic and documentation of communication cutoff selection one more time · fe83e4de
  Axel Kohlmeyer authored Jul 25, 2019
  
  fe83e4de
- Update kim_query & clear and update examples/kim · fadb4005
  Ryan S. Elliott authored Jul 25, 2019
  
  fadb4005
- Small logic tweak · ab74bfef
  Stan Moore authored Jul 25, 2019
  
  ab74bfef

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