Commits · 6be36196da03a407f0f93176d12317ce8b78636e · 郑智淋 / lammps · GitLab

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Apr 28, 2020
- explicitly include STUBS MPI headers for serial compile since we seem to pick... · 6be36196
  Axel Kohlmeyer authored Apr 28, 2020
  6be36196
- restore original command · 705c10ef
  Axel Kohlmeyer authored Apr 28, 2020
  
  705c10ef
- add packages to also allow a regular build not just cross-compilation · 867088db
  Axel Kohlmeyer authored Apr 28, 2020
  
  867088db
- fix typos · d931365e
  Axel Kohlmeyer authored Apr 28, 2020
  
  d931365e
- updates for building with hip · d3017744
  Axel Kohlmeyer authored Apr 27, 2020
  
  d3017744
- update HIP compilation makefile for updated legacy build · 25d1ad77
  Axel Kohlmeyer authored Apr 27, 2020
  
  25d1ad77
- (temporarily) disable CMAKE_TUNE_FLAGS verification script code · b362a06c
  Axel Kohlmeyer authored Apr 27, 2020
  
  b362a06c
- add preset to compile with hcc · dd5ebb0a
  Axel Kohlmeyer authored Apr 27, 2020
  
  dd5ebb0a
- tweak GPU.cmake so that hip_get_devices compiles and links · 29d66772
  Axel Kohlmeyer authored Apr 27, 2020
  
  29d66772
- Merge branch 'latte_super_build' of github.com:junghans/lammps into collected-small-changes · 5006c2c3
  Axel Kohlmeyer authored Apr 27, 2020
  
  5006c2c3
- Merge branch 'collected-small-changes' of github.com:akohlmey/lammps into collected-small-changes · c828492d
  Axel Kohlmeyer authored Apr 27, 2020
  
  c828492d
- fix command ordering issues with gpu image build · edd708db
  Axel Kohlmeyer authored Apr 27, 2020
  
  edd708db
- remove trailing whitespace · 76d7699a
  Axel Kohlmeyer authored Apr 27, 2020
  
  76d7699a
- Merge branch 'master' into collected-small-changes · 74e8505a
  Axel Kohlmeyer authored Apr 27, 2020
  
  74e8505a
- Merge pull request #1895 from stanmoore1/kk_compute_orientorder_atom · b38e95f8
  Axel Kohlmeyer authored Apr 27, 2020
  b38e95f8
- Merge pull request #2030 from lammps/revert-2018-cmake_kim-api_find · 0f28e0eb
  Axel Kohlmeyer authored Apr 27, 2020
  0f28e0eb
- Merge pull request #2026 from ndtrung81/ellipsoid-gpu-special-bonds · 121b40eb
  Axel Kohlmeyer authored Apr 27, 2020
  121b40eb
- Merge pull request #2027 from junghans/cmake_clean_up_plumed · d4c06a2e
  Axel Kohlmeyer authored Apr 27, 2020
  d4c06a2e
- Merge branch 'cmake_clean_up_plumed' of github.com:junghans/lammps into collected-small-changes · 0a9bed0c
  Axel Kohlmeyer authored Apr 27, 2020
  
  0a9bed0c
- remove latex support from accelerator image definitions · 7b79b310
  Axel Kohlmeyer authored Apr 27, 2020
  
  7b79b310
- add new combined container for compiling with GPU support. · 1aaf3ee0
  Axel Kohlmeyer authored Apr 27, 2020
  
  1aaf3ee0
- Merge branch 'kokkos_fix' of github.com:yafshar/lammps into collected-small-changes · 0338d578
  Axel Kohlmeyer authored Apr 27, 2020
  
  0338d578
- Merge pull request #2032 from akohlmey/change-box-image-flags · f9b873db
  Axel Kohlmeyer authored Apr 27, 2020
  f9b873db
- adding the standard header to prevent ‘NULL’ was not declared error · 437967bf
  Yaser Afshar authored Apr 27, 2020
  
  437967bf
Apr 27, 2020
- fix typo in MPI_Allreduce call. · 73ec2d81
  Axel Kohlmeyer authored Apr 27, 2020
  
  73ec2d81
- document the image flag reset for switching boundaries · b04cc115
  Axel Kohlmeyer authored Apr 27, 2020
  
  b04cc115
- when changing boundaries from periodic to non-periodic, we need to reset the... · 644f74c5
  Axel Kohlmeyer authored Apr 27, 2020
  644f74c5
- Add missing copymode flag statement · ee9757b1
  Stan Moore authored Apr 27, 2020
  
  ee9757b1
- Fix logic error · 5de6224b
  Stan Moore authored Apr 27, 2020
  
  5de6224b
- remove trailing whitespace · f1aaad2b
  Axel Kohlmeyer authored Apr 27, 2020
  
  f1aaad2b
- make behavior of comparing cutoff and long-range coulomb independent of order · bc3a1187
  Axel Kohlmeyer authored Apr 27, 2020
  
  bc3a1187
- do not mix c++ style and c-style comments · d53e468c
  Axel Kohlmeyer authored Apr 26, 2020
  
  d53e468c
- KIM.cmake: add workaround for <cmake-3.12 · 281c105a
  Christoph Junghans authored Apr 26, 2020
  
  281c105a
- Revert "cmake: move kim-api detection to cmake config" · d092b24c
  Christoph Junghans authored Apr 26, 2020
  
  d092b24c
Apr 26, 2020
- cosmetic edit to trigger new CI test runs · 0b6e5be3
  Axel Kohlmeyer authored Apr 26, 2020
  
  0b6e5be3
- move MPI compilation variable definitions workaround to MPI4WIN.cmake · 9a5b7141
  Axel Kohlmeyer authored Apr 26, 2020
  
  9a5b7141
- Merge remote-tracking branch 'github/cmake_latte_link_fix' into collected-small-changes · e5360bb6
  Axel Kohlmeyer authored Apr 25, 2020
  
  e5360bb6
- update MPI detection and handling of MPI to not automatically assume that a... · 758a27c1
  Axel Kohlmeyer authored Apr 25, 2020
  758a27c1
- USER-PLUMED: remove unused defines · 7fd50045
  Christoph Junghans authored Apr 25, 2020
  
  7fd50045
Apr 25, 2020
- Fixed bugs with special bonds for ellipsoid gpu pair styles · 1295a9ef
  Trung Nguyen authored Apr 25, 2020
  
  1295a9ef

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