Commits · ed566bf6af0d9d8a489ec3a9df78659daedd4c74 · 郑智淋 / lammps · GitLab

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Aug 05, 2020
- First set of changes for Kokkos HIP · ed566bf6
  Stan Moore authored Aug 04, 2020
  
  ed566bf6
Aug 04, 2020
- Merge pull request #2260 from akohlmey/collected-small-changes · 6576c4cb
  Axel Kohlmeyer authored Aug 03, 2020
  6576c4cb
- Merge pull request #2271 from abhiShandy/pair-tests-Aug3 · ca7039aa
  Axel Kohlmeyer authored Aug 03, 2020
  ca7039aa
- Merge pull request #2270 from akohlmey/check-test-coverage · 436951fb
  Axel Kohlmeyer authored Aug 03, 2020
  436951fb
- Refactor check-styles.py · d0be2194
  Richard Berger authored Aug 03, 2020
  
  d0be2194
- Update check-packages.py · f9d1a914
  Richard Berger authored Aug 03, 2020
  
  f9d1a914
- Refactor check-packages.py · 45494931
  Richard Berger authored Aug 03, 2020
  
  45494931
Aug 03, 2020
- Merge pull request #2267 from abhiShandy/force-tests · 23a8b343
  Axel Kohlmeyer authored Aug 03, 2020
  23a8b343
- make check for alternate linke more restrictive: also check for linker binary. · d09d40af
  Axel Kohlmeyer authored Aug 03, 2020
  
  d09d40af
- Refactor check_tests.py · 865e853a
  Richard Berger authored Aug 03, 2020
  
  865e853a
- pair style gauss does not apply special_bonds · 9bc1da64
  Axel Kohlmeyer authored Aug 03, 2020
  
  9bc1da64
- update code for ufm/gpu to match changes in base class where uf4 is removed · 7e5e741e
  Axel Kohlmeyer authored Aug 03, 2020
  
  7e5e741e
- Merge branch 'pair-tests-Aug3' of github.com:abhiShandy/lammps into pair-tests-Aug3 · d271ee65
  Axel Kohlmeyer authored Aug 03, 2020
  
  d271ee65
- update test reference data for pair style ufm · f3d7f0be
  Axel Kohlmeyer authored Aug 03, 2020
  
  f3d7f0be
- must initialize scale array entries when using mixed parameters · 69688bbc
  Axel Kohlmeyer authored Aug 03, 2020
  
  69688bbc
- fix incomplete restart bug in pair style ufm · c171b2ce
  Axel Kohlmeyer authored Aug 03, 2020
  
  c171b2ce
- bug in forcelj of gauss_omp · ad6b37d6
  abhishandy authored Aug 03, 2020
  
  ad6b37d6
- remove unused setting and array · d241b17c
  Axel Kohlmeyer authored Aug 03, 2020
  
  d241b17c
- sort list of missing styles alphabetically · 86c6efc0
  Axel Kohlmeyer authored Aug 03, 2020
  
  86c6efc0
- remove obsolete function · bb183345
  Axel Kohlmeyer authored Aug 03, 2020
  
  bb183345
- passing test for soft · 10c0b8d9
  abhishandy authored Aug 03, 2020
  
  10c0b8d9
- failing test for UFM, with cosmetic change in its CPP, and doc correction · 80ceff55
  abhishandy authored Aug 03, 2020
  
  80ceff55
- passing tests for born-coul, gauss and yukawa · 8eb84229
  abhishandy authored Aug 03, 2020
  
  8eb84229
- properly handle hybrid styles when checking for missing tests · 90028a3c
  Axel Kohlmeyer authored Aug 03, 2020
  
  90028a3c
- add a custom python script to check the completeness of tests inputs · 896a0888
  Axel Kohlmeyer authored Aug 03, 2020
  
  896a0888
Aug 02, 2020
- Merge branch 'wip-tests' into force-tests · bbb4c396
  Axel Kohlmeyer authored Aug 01, 2020
  
  bbb4c396
- correct data file output format for ZBL style. update reference output. · eb91c6fe
  Axel Kohlmeyer authored Aug 01, 2020
  
  eb91c6fe
- tweak parameters for lj/expand to stabilize test run · cc87557f
  Axel Kohlmeyer authored Aug 01, 2020
  
  cc87557f
- fix missing initialization bug in lj/cut/coul/wolf and update reference data · 6827eb80
  Axel Kohlmeyer authored Aug 01, 2020
  
  6827eb80
- tweak potential parameters for better stability of test run · a4db52c3
  Axel Kohlmeyer authored Aug 01, 2020
  
  a4db52c3
- need to explicitly clamp the forces and energy in single function to zero at... · 4c3dc956
  Axel Kohlmeyer authored Aug 01, 2020
  4c3dc956
- fix parameters initialization bug in pair style lj/cubic · 891be931
  Axel Kohlmeyer authored Aug 01, 2020
  
  891be931
Aug 01, 2020
- bugfix for pair style buck/coul/cut · 7158f471
  Axel Kohlmeyer authored Aug 01, 2020
  
  7158f471
- unit tests for few buck/coul and born/coul; remove mixing from buck · 34279840
  abhishandy authored Aug 01, 2020
  
  34279840
- fix the atomic numbers in ZBL test · d15db7b5
  abhishandy authored Aug 01, 2020
  
  d15db7b5
- unit tests for few LJ derivatives and ZBL · 86c53cb2
  abhishandy authored Aug 01, 2020
  
  86c53cb2
- unit tests for beck, morse, and few LJ derivatives · 2a487f5f
  abhishandy authored Aug 01, 2020
  
  2a487f5f
- make more use of utils::logmesg() · 729cc81f
  Axel Kohlmeyer authored Jul 31, 2020
  
  729cc81f
- Merge branch 'master' into collected-small-changes · 74f50ed1
  Axel Kohlmeyer authored Jul 31, 2020
  
  74f50ed1
- Merge pull request #2266 from Vsevak/fix_opencl · 75dcd9ae
  Axel Kohlmeyer authored Jul 31, 2020
  75dcd9ae

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