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d27026c364
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Update fix_nve_limit.rst
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2024-10-04 13:05:26 -04:00 |
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39def85b48
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Update fix_cmap.rst
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2024-10-04 13:04:52 -04:00 |
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130548156d
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Merge branch 'develop' of github.com:lammps/lammps into alphataubio-kokkos-fixes
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2024-10-04 09:30:33 -06:00 |
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2ae4062a6b
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Merge pull request #4343 from akohlmey/collected-small-changes
Collected small changes and fixes
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2024-10-04 03:59:49 -04:00 |
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01468e2720
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Merge branch 'collected-small-changes' of github.com:akohlmey/lammps into collected-small-changes
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2024-10-04 01:41:57 -04:00 |
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6d8529f1f7
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Merge branch 'develop' into collected-small-changes
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2024-10-04 01:24:30 -04:00 |
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1263a23e9c
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Merge pull request #4345 from akohlmey/update-fmtlib
Update embedded copy of libfmt to version 11.0.2
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2024-10-04 01:22:51 -04:00 |
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d1a1a57bd9
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Merge pull request #4339 from jtclemm/small-patches
Fixing bugs in GRANULAR and mistakes in RHEO documentation
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2024-10-03 22:01:21 -04:00 |
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13ceebe82c
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fix recenter test skipped for respa
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2024-10-03 18:45:52 -04:00 |
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70dad28481
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Update fix_recenter.cpp
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2024-10-03 18:45:12 -04:00 |
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1799f887d2
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Update test_atom_styles.cpp
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2024-10-03 18:36:39 -04:00 |
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59db2e0af8
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Update atom_vec_template.cpp
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2024-10-03 18:35:28 -04:00 |
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86fc79d2de
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Update fix-timestep-wall_lj93_const.yaml
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2024-10-03 18:20:09 -04:00 |
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6f068fc067
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Update fix-timestep-wall_region_harmonic.yaml
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2024-10-03 18:19:53 -04:00 |
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bf12caf37a
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Update fix-timestep-wall_region_lj126.yaml
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2024-10-03 18:18:02 -04:00 |
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c059961b8f
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Update fix-timestep-wall_region_lj1043.yaml
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2024-10-03 18:17:39 -04:00 |
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81db0a4a80
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Update fix-timestep-wall_region_morse.yaml
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2024-10-03 18:16:41 -04:00 |
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0e10ed24fe
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fix compilation issue with MSVC++
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2024-10-03 15:19:56 -04:00 |
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f25c530c04
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recover compilation with MSVC++
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2024-10-03 14:56:28 -04:00 |
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fbc6ba4ef4
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import libfmt 11.0.1
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2024-10-03 14:43:19 -04:00 |
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4ee07bcdaf
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Recreate dump file for MS-MEAM due to changes to the code.
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2024-10-03 11:54:26 -06:00 |
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2c2ce1b327
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Update create_atoms.cpp
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2024-10-03 13:15:13 -04:00 |
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9ad3e59c8f
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Update test_atom_styles.cpp
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2024-10-03 12:38:32 -04:00 |
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5c8552f4ce
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Update atom_vec_template.cpp
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2024-10-03 12:21:10 -04:00 |
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3c5b4ebccb
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Delete charmm36.py
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2024-10-03 11:43:08 -04:00 |
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4b43f90bd6
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revert changes requested by @akohlmey
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2024-10-03 11:39:24 -04:00 |
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b5fdd8f0ae
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Revert "update atom_style template test for added charge"
This reverts commit 3ea74b1725.
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2024-10-03 10:26:24 -04:00 |
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29eafa999b
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Update src/region_sphere.h
Co-authored-by: Axel Kohlmeyer <akohlmey@gmail.com>
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2024-10-03 09:49:56 -04:00 |
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9c06e8265f
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Update src/create_atoms.cpp
Co-authored-by: Axel Kohlmeyer <akohlmey@gmail.com>
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2024-10-03 09:48:12 -04:00 |
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a9dd61f62e
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detect C++23 standard
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2024-10-03 07:38:44 -04:00 |
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adebe773d0
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bump check to C++23 and rename workflow file
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2024-10-03 07:26:40 -04:00 |
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e4aedfda85
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add test for C++20 compatibility
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2024-10-02 21:56:15 -04:00 |
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7e02951fc4
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disable making functions in libfmt consteval with C++20 and beyond
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2024-10-02 21:48:54 -04:00 |
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0f8b825424
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fix up spelling issues in CTIP
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2024-10-02 19:43:43 -04:00 |
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a1bb42bd6e
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Merge remote-tracking branch 'github/develop' into collected-small-changes
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2024-10-02 19:29:35 -04:00 |
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8a7572fd5a
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Merge pull request #4181 from gplummer317/ctip
Charge Transfer Interatomic Potential (CTIP) pair style and qeq fix
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2024-10-02 19:26:09 -04:00 |
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cac22c216a
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update kk index entries
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2024-10-02 14:37:03 -04:00 |
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26aadc25ad
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Update fix_cmap.rst
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2024-10-02 14:31:54 -04:00 |
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26b83602be
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Update Commands_fix.rst
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2024-10-02 13:56:21 -04:00 |
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8a25871db5
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Update region.rst
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2024-10-02 13:45:59 -04:00 |
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fff1456553
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Update fix_wall_region.rst
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2024-10-02 13:43:23 -04:00 |
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89346740e1
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Update fix_recenter.rst
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2024-10-02 13:42:13 -04:00 |
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a8acd9b573
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Update fix_nve_limit.rst
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2024-10-02 13:41:41 -04:00 |
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e61d9f08ee
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regenerate fix wall/region tests
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2024-10-01 13:00:59 -04:00 |
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8332d89a4a
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regenerate fix recenter tests
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2024-10-01 12:46:33 -04:00 |
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384d8cf51f
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compute_vector() bugfix
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2024-10-01 12:43:57 -04:00 |
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51e273affd
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punt drude too
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2024-10-01 03:30:05 -04:00 |
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e32a2fa71a
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punt again
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2024-10-01 02:39:17 -04:00 |
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e29b06095d
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remove whitespace
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2024-10-01 02:36:22 -04:00 |
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91fc94fc1e
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Merge branch 'alphataubio-kokkos-fixes' of https://github.com/alphataubio/lammps-alphataubio into alphataubio-kokkos-fixes
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2024-10-01 02:31:56 -04:00 |
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