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cb0af02748
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Merge pull request #4193 from akohlmey/extra-command-package
Create new EXTRA-COMMAND package
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2024-06-19 15:06:20 -04:00 |
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629a9cbe3d
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Merge pull request #4188 from Eddy-Barraud/dpd_charged
add pair styles dpd/coul/slater/long and dpd/coul/slater/long/gpu
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2024-06-19 13:50:46 -04:00 |
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397dc9a7f6
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build system and maintenance updates
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2024-06-13 09:13:55 -04:00 |
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d61c94c0f3
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move group2ndx and ndx2group to new EXTRA-COMMAND package. update docs.
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2024-06-10 14:14:36 -04:00 |
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9a23ddf88a
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Added ml-uf3 to cmake and make files
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2024-03-25 12:08:51 -04:00 |
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b22ce0f4be
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use platform neutral CMake property to export symbols
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2024-02-25 21:58:35 -05:00 |
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725156753a
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remove superfluous warning
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2024-02-25 21:51:34 -05:00 |
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86ea5271d6
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portability
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2024-02-25 21:19:13 -05:00 |
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b8c8b4d19b
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use -rdynamic for re-exporting symbols when using plugins
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2024-02-25 21:11:31 -05:00 |
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c869783e72
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warn about building LAMMPS with shared lib support for plugins
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2024-02-24 09:21:20 -05:00 |
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072b0374e7
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do not check for cmath with Intel compilers but assume it is there
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2024-02-14 18:55:19 -05:00 |
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57321b308f
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OpenMP library is not (yet) properly detected for CrayClang. Work around it.
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2024-02-14 13:40:57 -05:00 |
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5b645b631b
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add detection for CrayClang to the OpenMP compatibility check
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2024-02-13 11:09:25 -05:00 |
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960b22763d
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Merge branch 'develop' into issue3775_fft_kokkos
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2024-02-05 16:05:59 -05:00 |
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ccd50a8958
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add workaround for Cray's Clang based compiler to compile fmtlib
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2024-02-01 12:12:03 -05:00 |
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677c8258e2
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fix cmake issues: always build static heFFTe libs, fixup git hash, cmake output
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2024-01-31 16:19:55 -05:00 |
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b47ad7acf4
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Revert "make delete_bonds command code compatible with BPM package not being installed"
This reverts commit 715b030bd6.
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2024-01-17 15:46:03 -05:00 |
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a131b90962
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make delete_bonds command code compatible with BPM package not being installed
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2024-01-12 16:19:11 -05:00 |
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bc7050ab50
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Added LMP_HEFFTE to CMakeLists.txt to attempt to fix a merge conflict
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2023-12-18 12:11:31 -05:00 |
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c45183d45c
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Updated CMake build system to allow for FFT_KOKKOS parameter. Updated CMakeLists.txt to print the correct value when summarizing.
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2023-12-14 15:38:45 -05:00 |
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d0ae489dda
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addressed some pr comments
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2023-12-01 15:12:23 -05:00 |
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a6e629f4e4
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update variable names
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2023-12-01 15:12:23 -05:00 |
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77ad067458
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added documentation
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2023-12-01 15:12:23 -05:00 |
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fc28fc318b
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Update CODEOWNERS for cmake
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2023-11-21 10:57:33 -07:00 |
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c66710934d
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reduce warnings when compiling with intel classic compilers
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2023-11-18 06:22:16 -05:00 |
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be286d2c7d
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lower the C++ standard to 14 for some files when compiling with intel classic compiler
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2023-11-18 06:21:28 -05:00 |
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ceed4c7db8
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for consistency with CMake 3.12+ we should set Python_EXECUTABLE instead of PYTHON_EXECUTABLE
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2023-10-24 07:51:54 -04:00 |
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df1e2a64d2
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the MESONT package depends on the MOLECULE package since the last upgrade
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2023-08-23 19:03:34 -04:00 |
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351a9dd11f
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Merge remote-tracking branch 'github/develop' into collected-small-changes
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2023-08-23 03:02:29 -04:00 |
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a81412f015
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remove MPIIO sources and references to them. update Purge.list and build systems
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2023-08-20 21:51:33 -04:00 |
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a86c0ed671
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suppress pointless warning by MSVC++ compilers
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2023-08-19 17:48:03 -04:00 |
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951b344a07
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Merge branch 'develop' into cmake-3.16
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2023-08-04 13:05:08 -04:00 |
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1a5b947593
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flag if we are cross-compiling
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2023-08-04 08:02:06 -04:00 |
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e958cc0ef1
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silence warning about a setting that was added to silence warnings
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2023-08-04 08:01:57 -04:00 |
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ecb28e8e2e
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Merge branch 'develop' into cmake-3.16
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2023-08-04 04:26:30 -04:00 |
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a10aab440f
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report LAMMPS GUI build choices in CMake config summary
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2023-08-03 22:09:36 -04:00 |
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e467461cac
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Merge pull request #3736 from lammps/always-exceptions
Always throw exceptions for errors
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2023-08-03 21:00:19 -04:00 |
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2305c4cb30
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Merge branch 'develop' into cmake-3.16
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2023-08-03 17:39:15 -04:00 |
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794e3d11df
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Merge pull request #3670 from stanmoore1/kk_update_4.0
Update Kokkos library in LAMMPS to v4.1.0
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2023-08-03 17:36:22 -04:00 |
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6e9a6e6b0b
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Merge pull request #3856 from akohlmey/remove-mscg-package
Remove MSCG package from LAMMPS distribution
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2023-08-03 17:29:56 -04:00 |
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4ed98083e0
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Merge branch 'develop' into always-exceptions
# Conflicts:
# src/library.cpp
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2023-08-03 16:50:50 -04:00 |
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e0055ea929
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Merge branch 'develop' of github.com:lammps/lammps into kk_update_4.0
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2023-08-03 13:42:48 -06:00 |
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6b50daf5b7
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Merge branch 'collected-small-fixes' into lammps-gui
# Conflicts:
# cmake/CMakeLists.txt
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2023-08-01 03:07:56 -04:00 |
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d9f4ce04af
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integrate packaging related changes, build script for GUI
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2023-07-29 21:03:24 -04:00 |
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b87ced52b4
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first minimal stab at LAMMPS GUI
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2023-07-24 19:07:33 -04:00 |
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c42ec8a647
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create toplevel README file when building for static Linux or macOS multiarch
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2023-07-19 18:14:03 -04:00 |
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f26064d9a5
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also install the bench folder into ${datadir}
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2023-07-19 17:46:21 -04:00 |
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9b7bd71ab6
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remove MSCG package from LAMMPS distribution
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2023-07-16 21:04:58 -04:00 |
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4a46083e88
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add git commit descriptor to LAMMPS version output
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2023-06-30 23:29:17 -04:00 |
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b50fc0be78
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remove obsolete CONFIGURE_DEPENDS backward compatibility hack
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2023-06-30 23:19:53 -04:00 |
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