Commits · 83b6d6ae960ce0e7f8edb32d95edb3540ae5f764 · argo / Applications / LAMMPS

12 Sep, 2018 1 commit
- small modifications of potential #839 · 83b6d6ae
  oywg11 authored Sep 12, 2018
  
  83b6d6ae
26 Jun, 2018 1 commit
- New paramteters for potential #839 · c9d147c3
  oywg11 authored Jun 26, 2018
  
  c9d147c3
25 Jun, 2018 7 commits
- Merge pull request #961 from cnegre/newsystem · 5e485657
  Steve Plimpton authored Jun 25, 2018
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Added newsystem flag to be passed to latte
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  5e485657
- LAMMPS does not build on windows without this one · af91f7fa
  Axel Kohlmeyer authored Jun 25, 2018
  
  af91f7fa
- Added new checksum value · 0cd86bab
  Christian F. A. Negre authored Jun 25, 2018
  
  0cd86bab
- Added new checksum value · bec82e40
  Christian F. A. Negre authored Jun 25, 2018
  
  bec82e40
- Merge branch 'newsystem' of https://github.com/cnegre/lammps into newsystem · 2fd45050
  Christian F. A. Negre authored Jun 25, 2018
  
  2fd45050
- Added fix latte · 8ffa96c9
  Christian F. A. Negre authored Jun 25, 2018
  
  8ffa96c9
- update MD5 sum for latte-v1.2.0.tar.gz src archive · 6a925124
  Axel Kohlmeyer authored Jun 25, 2018
  
  6a925124
22 Jun, 2018 4 commits
- patch 22Jun18 · d237625d
  Steven J. Plimpton authored Jun 22, 2018
  
  d237625d
- Merge pull request #960 from lammps/latte-tweak · 510834cb
  Steve Plimpton authored Jun 22, 2018
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made latte.in compatible with v1.1.1 and updated log files
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  510834cb
- Changed version on cmakelist and install.py · 2165a2aa
  Christian F. A. Negre authored Jun 22, 2018
  
  2165a2aa
- Merge pull request #958 from ndtrung81/gpu-updates · f5f73b01
  Steve Plimpton authored Jun 22, 2018
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Bug fixes and updates to the GPU package
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  f5f73b01
21 Jun, 2018 12 commits
- Added newsystem flag to be passed to latte · dc132c8b
  Christian F. A. Negre authored Jun 21, 2018
  
  dc132c8b
- Merge pull request #959 from rbberger/cmake_documentation · f0a2c574
  Steve Plimpton authored Jun 21, 2018
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Expand cmake documentation
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  f0a2c574
- Add BUILD_MPI and BUILD_OMP in cmake docs · 4ca3d30d
  Richard Berger authored Jun 21, 2018
  
  4ca3d30d
- made latte.in compatible with v1.1.1 and updated log files · cbfb751e
  Steven J. Plimpton authored Jun 21, 2018
  
  cbfb751e
- Update README.md to reflect change ENABLE_* to PKG_* · 65c89572
  Richard Berger authored Jun 21, 2018
  
  65c89572
- Add TOC to README.md · bfacfc46
  Richard Berger authored May 01, 2018
  
  bfacfc46
- Fill in package descriptions · 919d95d3
  Richard Berger authored May 01, 2018
  
  919d95d3
- Fixup GitHub markup version · 25818569
  Richard Berger authored May 01, 2018
  
  25818569
- Expand CMake build documentation · cea0227f
  Richard Berger authored Apr 30, 2018
  
  cea0227f
- Merge pull request #957 from akohlmey/collected_small_fixes · 3e58ebea
  Steve Plimpton authored Jun 21, 2018
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Collected small changes and bugfixes for next patch release
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  3e58ebea
- Merge pull request #956 from cnegre/latte_examples · 7a22612b
  Steve Plimpton authored Jun 21, 2018
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Added boxrel example and simplified latte.in
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  7a22612b
- Merge pull request #955 from junghans/fortran_linking · 9805b5d3
  Steve Plimpton authored Jun 21, 2018
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cmake: implicit fortran libs need to linked last
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  9805b5d3
20 Jun, 2018 4 commits
- Added missing source files for born/coul/wolf/cs in the gpu library · 28504e91
  Trung Nguyen authored Jun 20, 2018
  
  28504e91
- add more thorough checks on parsing reaxff force field and signal when the... · 47482afb
  Axel Kohlmeyer authored Jun 20, 2018
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add more thorough checks on parsing reaxff force field and signal when the lgvdw setting is correct.
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  47482afb
- remove entries that are not compatible with lgvdw yes and not included in the publication · 7d3a549d
  Axel Kohlmeyer authored Jun 20, 2018
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closes #876
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  7d3a549d
- Updates to the core-shell gpu pair styles · a9b794b2
  Trung Nguyen authored Jun 20, 2018
  
  a9b794b2
19 Jun, 2018 4 commits
- Updated the kernels for born/coul/long/cs and coul/long/cs gpu styles · 3ae8fdcc
  Trung Nguyen authored Jun 19, 2018
  
  3ae8fdcc
- Updated pair coul/long/cs and born/coul/long/cs; updated gpu neighbor builds... · 70a7b376
  Trung Nguyen authored Jun 19, 2018
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Updated pair coul/long/cs and born/coul/long/cs; updated gpu neighbor builds to support core-shell styles where r2 can be tiny.
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  70a7b376
- correct sign of virial tally in fix smd. issue reported by Dinesh SD on lammps-users · 036647c1
  Axel Kohlmeyer authored Jun 19, 2018
  
  036647c1
- Added boxrel example and simplified latte.in · 37b901ea
  Christian F. A. Negre authored Jun 19, 2018
  
  37b901ea
18 Jun, 2018 7 commits
- cmake: implicit fortran libs need to linked last · 5a3ef992
  Christoph Junghans authored Jun 18, 2018
  
  5a3ef992
- Merge pull request #933 from rtoijala/fix_dt_reset_energy · 03a7d1cd
  Steve Plimpton authored Jun 18, 2018
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Limit atom energy change in fix dt/reset
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  03a7d1cd
- Merge pull request #950 from martok/subst-equal-fmt · 08331da9
  Steve Plimpton authored Jun 18, 2018
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Add support for inline format strings to immediate variable substitution
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  08331da9
- Merge pull request #948 from martok/variable-string · ab0f3deb
  Steve Plimpton authored Jun 18, 2018
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Variable style 'string' substitutes variables in definition
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  ab0f3deb
- Merge pull request #951 from martok/meam-diaref-fix · fe14bfd1
  Steve Plimpton authored Jun 18, 2018
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Apply modifications to MEAM & MEAM/C as found by Kyung-Han Kang
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  fe14bfd1
- Merge pull request #943 from Pakketeretet2/improve-manifoldforce-warning · d55c7039
  Steve Plimpton authored Jun 18, 2018
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Improve fix manifoldforce warning
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  d55c7039
- Merge pull request #952 from rbberger/coverage · 87dcef71
  Steve Plimpton authored Jun 18, 2018
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Add code coverage target to CMake
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  87dcef71