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07c0c435ef
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Merge branch 'develop' into remove-smallsmall
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2025-03-15 02:11:02 -04:00 |
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cea31e463d
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remove references to -DLAMMPS_SMALLSMALL and trigger error when used
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2025-03-14 10:20:31 -04:00 |
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9b1dca201f
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rewrite incorrect statement
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2025-03-06 15:45:24 -05:00 |
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1c65907d72
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Merge branch 'develop' into bye-bye-python-zwei
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2025-02-13 17:01:39 -05:00 |
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b188cdc044
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add check for Python version. Require minimum of Python 3.6 (Sphinx requires 3.8)
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2025-02-07 20:51:50 -05:00 |
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6eddb3a33f
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various minor tweaks and reformatting for CMake scripts
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2025-02-07 20:50:14 -05:00 |
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2ae07ec1cb
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sync C++ standard selection with main CMakeLists.txt file
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2025-02-04 17:00:12 -05:00 |
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6fb318f61c
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Merge branch 'develop' into collected-small-changes
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2025-01-23 20:22:14 -05:00 |
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e26599c532
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Revert "We no longer support Intel icc version 19 or older. Clean up checks/flags."
This reverts commit 906117ff47.
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2025-01-23 00:15:48 -05:00 |
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651c1b2bc2
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Merge branch 'develop' into collected-small-changes
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2025-01-21 20:06:50 -05:00 |
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fbfdcbbac1
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Merge branch 'develop' into kk_bug_fixes
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2025-01-21 14:50:34 -07:00 |
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f4b8200bcc
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download plumed-2.9.3 by default now
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2025-01-21 10:39:08 -05:00 |
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9cb67de38f
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Merge branch 'develop' of github.com:lammps/lammps into kk_bug_fixes
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2025-01-20 15:50:48 -07:00 |
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781b40643c
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add deprecation warning for using accelerator offload with INTEL package
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2025-01-14 20:49:00 -05:00 |
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edb068c43f
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Merge pull request #4426 from akohlmey/update-to-fmtlib-11.1
Update embedded fmtlib copy to version 11.1
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2025-01-14 01:24:57 -05:00 |
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ddff545a4c
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Merge pull request #4431 from Becksteinlab/imd-v3-integration
Interactive Molecular Dynamics [IMD] Version 3 implementation
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2025-01-13 15:59:41 -05:00 |
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2df402c4ff
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Merge branch 'develop' into cmake-cpp-std-deprecation
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2025-01-12 21:47:02 -05:00 |
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906117ff47
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We no longer support Intel icc version 19 or older. Clean up checks/flags.
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2025-01-12 21:46:04 -05:00 |
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38c3477d2f
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Merge pull request #4394 from rbberger/find-package-pace
ml-pace: allow linking to existing pace library
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2025-01-09 19:41:19 -05:00 |
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02a8a9d706
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make LAMMPS_ASYNC_IMD a CMake variable, too, and document it properly
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2025-01-08 20:50:16 -05:00 |
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668435380b
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Make sure that yaml-cpp::yaml-cpp exists
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2025-01-08 15:41:37 -07:00 |
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ec7be395ea
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ml-pace: update tag
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2025-01-08 11:48:34 -07:00 |
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8595d8f05c
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Merge branch 'develop' of github.com:lammps/lammps into kk_update_4.5.0
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2025-01-07 10:04:43 -07:00 |
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9e373e7cc1
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Merge branch 'develop' of github.com:lammps/lammps into kk_bug_fixes
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2025-01-07 10:02:34 -07:00 |
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d87abc0d01
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correct CMake script code for including WHAM executables in macOS app-bundle
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2025-01-02 17:25:44 -05:00 |
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e31ca3c9c5
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Update CMake
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2024-12-24 10:35:05 -07:00 |
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74cf599778
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work around bug in FindVTK.cmake shipped with VTK 9.1 (and possibly other versions)
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2024-12-19 08:32:34 -05:00 |
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9e3f7e55ee
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Update build systems for Kokkos v4.5.0
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2024-12-13 09:32:45 -07:00 |
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c2b6ce5786
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remove src/KOKKOS/group_kokkos.cpp
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2024-12-04 18:02:44 -05:00 |
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88807c6ae6
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ml-pace: allow linking to existing pace library
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2024-11-25 16:18:50 -07:00 |
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71bbc52feb
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recommit changes from @stanmoore1
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2024-10-25 20:03:45 -04:00 |
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cfb8b25c6e
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fix grammar
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2024-10-24 13:33:42 -04:00 |
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40e5d53345
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Prevent deduplication of -Xcudafe flag
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2024-10-23 15:53:56 -06:00 |
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820fe1ee8a
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Fix compile issue with gcc
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2024-10-23 12:18:20 -06:00 |
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46c365f75c
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Merge branch 'develop' of github.com:lammps/lammps into alphataubio-kokkos-fixes
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2024-10-23 09:32:27 -06:00 |
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73eb7de7aa
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cmake: voro target to upstream name
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2024-10-18 09:26:23 -06:00 |
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0ae0afbae9
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Merge branch 'develop' into cmake-cpp-std-deprecation
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2024-10-12 20:11:28 -04:00 |
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f8a8783044
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Merge branch 'develop' into alphataubio-kokkos-fixes
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2024-10-12 20:09:59 -04:00 |
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5c82063376
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Merge branch 'electrode' of github.com:robeme/lammps into collected-small-changes
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2024-10-10 17:32:28 -04:00 |
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49a850c8aa
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add cmake support for make-globbed-toc
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2024-10-10 17:25:05 -04:00 |
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58989765f0
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Install shared libraries on Windows with RUNTIME DESTINATION
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2024-10-10 00:52:36 +02:00 |
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79c9d69931
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Update CMakeLists.txt
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2024-10-09 17:26:30 -04:00 |
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147cf7face
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-diag_suppress (single dash)
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2024-10-09 17:22:35 -04:00 |
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8a176ac488
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use MKL for FFTs and on Intel GPU
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2024-10-06 15:09:06 -04:00 |
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1f61c42745
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add GroupKokkos
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2024-10-05 16:40:10 -04:00 |
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4da644958e
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IntelLLVM is not ABI compatible with generic BLAS libraries. Use linalg instead
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2024-10-05 03:39:00 -04:00 |
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248070c4b8
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use -fp-model precise for IntelLLVM to avoid miscompilation
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2024-10-05 02:41:03 -04:00 |
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39f42d4c12
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simplify
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2024-10-05 01:56:31 -04:00 |
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a73baf81b1
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update settings
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2024-10-05 01:04:39 -04:00 |
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166f0cb5ea
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print warning only when package selected
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2024-10-05 01:04:26 -04:00 |
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