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8fc48ad374
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backport support for building PLUMED as plugin
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2024-08-28 16:14:22 -04:00 |
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112f311591
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throw error when trying to use neigh_modify exclude with dynamic groups
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2024-08-21 10:34:46 -04:00 |
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14d9e2b722
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not using sphinx-design
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2024-08-16 18:06:24 -04:00 |
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78fe9585a4
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populate dump style index by moving commands off of commands_list.rst
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2024-08-16 17:58:55 -04:00 |
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f0f8b49afb
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distribute additional LaTeX files for better looking manual
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2024-08-16 17:57:48 -04:00 |
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b1654f11c1
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fix issues with compute smd/vol and related docs
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2024-08-16 17:53:39 -04:00 |
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5fa0c4951a
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sync with upstream
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2024-08-08 21:28:27 -04:00 |
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910bb4e111
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sphinx 7.4.x is the last series with compatbility for current breath
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2024-07-30 22:29:34 -04:00 |
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4c18b2fe99
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use suitable technical term
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2024-06-22 14:26:07 -04:00 |
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453469d6fe
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breathe is currently not compatible with sphinx 7.3
# Conflicts:
# doc/utils/requirements.txt
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2024-04-16 19:52:20 -04:00 |
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d5c7da1b0e
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fix bug in option arg parsing of fix ave/correlate, also update doc page for fix ave/correlate/long
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2024-04-04 20:51:13 -04:00 |
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ee5ee22b47
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Revert "Added comment about not using ialloy with meam/ms"
This reverts commit a6c5f3f714.
# Conflicts:
# doc/src/pair_meam.rst
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2024-03-01 18:33:30 -05:00 |
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b7820bfd0e
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whitespace
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2024-03-01 17:22:18 -05:00 |
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8fa42612e6
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Added override for ialloy default with MS-MEAM
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2024-03-01 17:12:33 -05:00 |
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a6c5f3f714
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Added comment about not using ialloy with meam/ms
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2024-03-01 16:50:56 -05:00 |
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a7aacd2440
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document requirement of per-type masses
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2024-02-22 04:34:41 -05:00 |
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9d360af2c5
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this limitation no longer applies
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2024-01-15 12:16:11 -05:00 |
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2808e6fc52
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fix typo
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2023-12-06 06:58:55 -05:00 |
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ba8ca9258b
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correct dpi to get proper image scaling in PDF output
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2023-12-02 16:35:01 -05:00 |
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07257595ff
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use r_c consistently
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2023-12-01 05:52:49 -05:00 |
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413d485617
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recreate compute xrd mesh image with reasonable dpi setting and used PNG format
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2023-12-01 01:32:28 -05:00 |
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f79e9a113f
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error out when no per-type masses are set. warn if both per-type and per-atom masses are used.
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2023-11-27 07:47:55 -05:00 |
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77db8e422a
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add check and document that "scale yes" is not supported for scaling atomic parameters with fix adapt/fep
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2023-11-23 12:38:27 -05:00 |
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854c6d93e2
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more checks for misformatted ReST roles
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2023-10-26 05:07:45 -04:00 |
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c90f874a0d
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avoid invalid escape warnings for regexp expressions with python 3.12
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2023-10-22 20:01:55 -04:00 |
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62d41c6afb
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fix cut-n-paste issue
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2023-09-14 00:29:00 -04:00 |
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5480d25e36
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add missing newline
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2023-09-13 16:35:10 -04:00 |
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a4145ec852
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reorder to have sections in alphabetical order again
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2023-09-13 16:34:11 -04:00 |
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5b16f15b25
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change refereces to lib/smd and smd to lib/machdyn and machdyn
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2023-09-13 16:33:55 -04:00 |
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f62b129dec
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update docs with settings for building tools with CMake
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2023-09-01 18:54:42 -04:00 |
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db967a5bbf
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there is no "thermo_extract" tool (anymore)
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2023-09-01 18:54:28 -04:00 |
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c6cbc1f965
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list manual versions on Manual home page
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2023-08-28 15:35:02 -04:00 |
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88e58e9189
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fix typo
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2023-08-28 13:12:36 -04:00 |
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ee16f6503e
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update LAMMPS GUI code with PR 3890 content
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2023-08-17 22:50:10 -04:00 |
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8a5fd08fa1
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update documentation for LAMMPS GUI v1.2
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2023-08-16 03:42:12 -04:00 |
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c105a187d9
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fix duplicate implicit reference
# Conflicts:
# doc/src/Speed_kokkos.rst
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2023-08-14 11:54:22 -04:00 |
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27d065a682
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sync with develop
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2023-08-03 11:33:14 -04:00 |
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f1dd7f1415
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Merge tag 'patch_2Aug2023' into maintenance
LAMMPS feature release 2 August 2023
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2023-08-03 11:14:29 -04:00 |
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554db7daaf
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Merge pull request #3873 from akohlmey/next_patch_release
Step version strings for next release
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2023-08-03 08:14:14 -04:00 |
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07b36025e2
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small doc fix from @sjplimp
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2023-08-02 17:56:02 -04:00 |
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e493519c12
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more hotkeys and have Ok/Cancel on preferences dialog handled properly
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2023-08-02 11:05:35 -04:00 |
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f76300c4f8
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do not build packages automatically but use explicit targets
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2023-08-01 20:42:10 -04:00 |
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22a9f869ea
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change version date
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2023-08-01 18:39:42 -04:00 |
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4f1946f307
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update LAMMPS GUI docs
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2023-08-01 18:19:18 -04:00 |
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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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72ea2673dd
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update LAMMPS manual and README file
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2023-07-31 00:07:32 -04:00 |
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739bffa5e6
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accept sphinx 7.1
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2023-07-27 19:20:35 -04:00 |
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732566c8a9
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mention that class members should be initialized in the constructor, not the header.
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2023-07-21 19:32:47 -04:00 |
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c441a999f1
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fix typos
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2023-07-20 17:59:40 -04:00 |
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e299fa9aab
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add option to skip building for multiple GPU archs
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2023-07-20 14:00:21 -04:00 |
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