Commits · 5fd17670b112ca4db247bfc62a1b26e6f003786f · multiscale / lammps · GitLab

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Mar 28, 2018
- new reset_ids command and dump_modify delay option · 5fd17670
  Steven J. Plimpton authored 6 years ago
  
  5fd17670
Mar 27, 2018
- Merge pull request #852 from akohlmey/collected-small-bugfixes-and-updates · b5b0f67b
  Steve Plimpton authored 7 years ago
  
  Collected small bugfixes and cleanups
  Unverified
  
  b5b0f67b
- Merge pull request #854 from lammps/readdump · a524d8c1
  Steve Plimpton authored 7 years ago
  
  new option *add keep* added to read_dump
  Unverified
  
  a524d8c1
- Merge pull request #850 from lammps/addlib · b571f542
  Steve Plimpton authored 7 years ago
  
  a few new lib interface methods
  Unverified
  
  b571f542
- rephrase error message, remove trailing whitespace · da9f6321
  Axel Kohlmeyer authored 7 years ago
  
  da9f6321
- new option *add keep* added to read_dump · e8b8428f
  Steven J. Plimpton authored 7 years ago
  
  e8b8428f
- doc tweak on added lib functions · 1956d93a
  Steven J. Plimpton authored 7 years ago
  
  1956d93a
Mar 26, 2018
- fix bug reported in issue #851 · 48509622
  Axel Kohlmeyer authored 7 years ago
  
  48509622
Mar 23, 2018
- do not capitalize library.cpp, even if it is at the beginning of a sentence · f38169f1
  Axel Kohlmeyer authored 7 years ago
  
  f38169f1
- Merge pull request #845 from akohlmey/dummy-pair-restart-warning · 24e48760
  Steve Plimpton authored 7 years ago
  
  More consistent and transparent handling for force styles with restarts
  Unverified
  
  24e48760
- Merge pull request #849 from stanmoore1/kk_deprecated · b5ee7137
  Steve Plimpton authored 7 years ago
  
  Remove deprecated Kokkos code
  Unverified
  
  b5ee7137
- Merge pull request #847 from akohlmey/collected-small-changes · e73663d1
  Steve Plimpton authored 7 years ago
  
  Collected small changes and bugfixes
  Unverified
  
  e73663d1
- Merge pull request #846 from akohlmey/pdf-manual-reorg · 5770a59e
  Steve Plimpton authored 7 years ago
  
  Refactor PDF Manual Structure
  Unverified
  
  5770a59e
- Merge pull request #842 from martok/meamc-bugfix · db5a6b27
  Steve Plimpton authored 7 years ago
  
  MEAM/C Improvements/fixes
  Unverified
  
  db5a6b27
- Merge pull request #839 from oywg11/master · 318877ad
  Steve Plimpton authored 7 years ago
  
  New registry dependent interlayer potential in LAMMPS
  Unverified
  
  318877ad
- a few new lib interface methods · d14c16a4
  Steven J. Plimpton authored 7 years ago
  
  d14c16a4
- minor cleanup in docs and updated log files for kolmogorov/crespi/full · 5a341bee
  Axel Kohlmeyer authored 7 years ago
  
  5a341bee
- refine the code and documentation · 78e09e18
  oywg11 authored 7 years ago
  
  78e09e18
Mar 22, 2018
- update kolmogorov-crespi examples · c398eb6b
  Axel Kohlmeyer authored 7 years ago
  
  c398eb6b
- refactor code and examples to match LAMMPS conventions. whitespace cleanup. shorten examples. · 8de7c449
  Axel Kohlmeyer authored 7 years ago
  
  8de7c449
- fix up and integrate documentation for contributed pair styles · 04c96836
  Axel Kohlmeyer authored 7 years ago
  
  04c96836
- Remove deprecated Kokkos code · a6d10ba9
  Stan Moore authored 7 years ago
  
  a6d10ba9
- update logs for eff and reax · b2194d61
  Axel Kohlmeyer authored 7 years ago
  
  b2194d61
- more meaningful output for electron units. fix bug in time unit to fs conversion · 8bbefb61
  Axel Kohlmeyer authored 7 years ago
  
  8bbefb61
Mar 21, 2018
- update BOP input and log files · 07a8e316
  Axel Kohlmeyer authored 7 years ago
  
  07a8e316
- detect and error out on unsupported/old bop potential files · 9f785a4f
  Axel Kohlmeyer authored 7 years ago
  
  9f785a4f
- update the bop potential file and input · a19f550c
  Axel Kohlmeyer authored 7 years ago
  
  a19f550c
- update logfiles · a5858712
  Axel Kohlmeyer authored 7 years ago
  
  a5858712
- update spc/e data and reax/c input · ad87b632
  Axel Kohlmeyer authored 7 years ago
  
  ad87b632
- update missing data files and adjust input files for potentials comparison · 57dbad59
  Axel Kohlmeyer authored 7 years ago
  
  57dbad59
- Merge branch 'compute_chunk_atom_pbc' of https://github.com/poppik/lammps into... · 96061b85
  Axel Kohlmeyer authored 7 years ago
  
  Merge branch 'compute_chunk_atom_pbc' of https://github.com/poppik/lammps into collected-small-changes
  96061b85
- Fixed pbc wrapping in case of spherical bins · c58bc6fc
  Pavel V. Strashnov authored 7 years ago
  
  c58bc6fc
- fix linker error bug with fftw3 and -DFFT_SINGLE · e66c71e1
  Axel Kohlmeyer authored 7 years ago
  
  e66c71e1
Mar 20, 2018
- refactor headline levels to result in a more structured PDF manual · 1a402d40
  Axel Kohlmeyer authored 7 years ago
  
  1a402d40
Mar 19, 2018
- print a message about the restored atom style · 69ca8e55
  Axel Kohlmeyer authored 7 years ago
  
  69ca8e55
- abort with an error when a pair style incorrectly advertises a restart ability · 5cdc6097
  Axel Kohlmeyer authored 7 years ago
  
  5cdc6097
- print error message when a pair style was not re-specified after reading a restart · 28a922b1
  Axel Kohlmeyer authored 7 years ago
  
  28a922b1
- print names of restored force field styles to screen and logfile · 16054cc3
  Axel Kohlmeyer authored 7 years ago
  
  16054cc3
- add pointer Force class to temporarily hold the name of the restarted pair style · 3c94f7d5
  Axel Kohlmeyer authored 7 years ago
  
  3c94f7d5
- write the name of a pair style to the restart even if it does not store data · c2c49395
  Axel Kohlmeyer authored 7 years ago
  
  c2c49395