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f9a55c0f49
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update reference data in test which was updated in KIM database
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2025-04-29 08:40:47 -04:00 |
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053792ed47
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fix typo detected by copilot
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2025-04-28 23:14:54 -04:00 |
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2fc7d287d4
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Merge branch 'develop' into collected-small-fixes
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2025-04-28 22:27:32 -04:00 |
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440e24c60e
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Merge pull request #4559 from lammps/gcmc-eatom
Added atomic energy option for energy change calculation in fix sgcmc
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2025-04-28 22:26:15 -04:00 |
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c886fff624
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Merge branch 'develop' into gcmc-eatom
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2025-04-28 17:55:48 -06:00 |
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e5854ced41
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backward compatibility not needed here
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2025-04-28 18:56:32 -04:00 |
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0768aac1fd
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update Qt platform version for flatpak build to latest 5.15 branch
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2025-04-28 18:45:57 -04:00 |
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75d3d79fca
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open available error URLs with double click or from context menu
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2025-04-28 18:25:40 -04:00 |
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db3d93210d
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highlight error URLs in logwindow
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2025-04-28 10:56:37 -04:00 |
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7151f261a0
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address sphinx formatting issue due to added paragraph
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2025-04-27 10:04:41 -04:00 |
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31b18ad24e
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update help index table
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2025-04-27 10:03:35 -04:00 |
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bef695f70b
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fix copy-n-paste error
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2025-04-27 07:39:58 -04:00 |
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5169a633e5
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make sure cut_respa is initialized
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2025-04-26 17:04:14 -04:00 |
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2c27ea3706
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Fix spelling in comment
Co-authored-by: Copilot <175728472+Copilot@users.noreply.github.com>
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2025-04-26 13:32:21 -04:00 |
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1a1f4b1a82
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correct reference
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2025-04-26 02:17:54 -04:00 |
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092df8ed8f
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add copyright header
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2025-04-26 00:56:47 -04:00 |
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4897fbb210
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Merge branch 'develop' into collected-small-fixes
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2025-04-26 00:50:58 -04:00 |
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40d8e1b95f
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Merge pull request #4535 from Bibobu/plot_forces_tool
Adding python tool to plot tabulated forces
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2025-04-26 00:50:32 -04:00 |
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4b2163666c
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Merge pull request #4545 from jtclemm/rheo
Small patches to various packages
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2025-04-26 00:46:49 -04:00 |
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7102cc2588
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use bold font for column titles
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2025-04-25 20:31:16 -04:00 |
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f1edc7f222
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whitespace
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2025-04-25 20:15:36 -04:00 |
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706aa19710
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Use type/ratio instead of type/fraction to select charged types
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2025-04-25 20:05:09 -04:00 |
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67c6dc492b
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update to ScaFaCoS version 1.0.4
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2025-04-25 20:03:06 -04:00 |
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d406289a7a
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propagate changes from library.cpp/library.h to swig and plugin interface
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2025-04-25 17:04:32 -04:00 |
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1969c28e0c
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delete unused variables
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2025-04-25 16:35:54 -04:00 |
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f577dcb28b
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Merge pull request #4570 from akohlmey/collected-small-changes
More small changes to recover builds of "develop"
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2025-04-25 16:30:16 -04:00 |
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d416202b71
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restore missing blank
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2025-04-25 16:16:15 -04:00 |
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46f4f5a3c0
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move JSON class back to try recover legacy builds
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2025-04-25 16:11:11 -04:00 |
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9b258d4c82
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try another variant
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2025-04-25 15:51:39 -04:00 |
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1597019419
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another small tweak
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2025-04-25 15:44:52 -04:00 |
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c8b841b08e
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small tweak
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2025-04-25 15:31:32 -04:00 |
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3b9ddf7a1f
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spelling
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2025-04-25 14:59:42 -04:00 |
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cab78b2c0d
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correct docs related to adding explicit Coulomb interactions
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2025-04-25 14:15:01 -04:00 |
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734bc915e2
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must include third_party folder with legacy build
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2025-04-25 14:14:20 -04:00 |
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3c5e85a7c0
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Merge pull request #4550 from akohlmey/collected-small-fixes
Collected small changes and fixes
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2025-04-25 13:46:59 -04:00 |
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9e26d8b569
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Missing derivative for RK0
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2025-04-25 10:19:28 -06:00 |
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43fcf6eccc
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use ioffset variable.
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2025-04-25 11:44:03 -04:00 |
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d25d0cbc7e
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Merge pull request #4562 from mateors6/lj/pirani
Add pair style lj/pirani
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2025-04-25 11:27:58 -04:00 |
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8e07d48518
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GitHub has stopped support for subversion in 2024. Remove note from 2016.
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2025-04-24 18:42:19 -04:00 |
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d4ba5d1fe6
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Fixing bug in minimum density
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2025-04-24 10:53:17 -06:00 |
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a1fc036e25
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Fix typo in src/timer.cpp
Co-authored-by: Copilot <175728472+Copilot@users.noreply.github.com>
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2025-04-24 07:53:05 -04:00 |
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20d3d47fe3
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Update pair_lj_pirani.rst
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2025-04-24 09:18:41 +02:00 |
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2d70947044
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two more workarounds for compilation with -DFMT_STATIC_THOUSANDS_SEPARATOR
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2025-04-23 21:00:40 -04:00 |
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4126c9ed75
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implement workaround for compilers that require -DFMT_STATIC_THOUSANDS_SEPARATOR
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2025-04-23 14:20:10 -04:00 |
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2e8b95f0c1
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Update pair_lj_pirani.rst
Documentation update
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2025-04-23 19:34:06 +02:00 |
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f9dc879033
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add comment to indicate that setting the pointer to null has no effect in sfree.
You need Memory::destroy() but that can't be applied to all use cases.
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2025-04-23 08:41:56 -04:00 |
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b1159dc528
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fix up to Copilot suggested code change
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2025-04-23 05:58:10 -04:00 |
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1352257cf4
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Use modern C++ code pattern to build c-style argument list
This was suggested by GitHub Copilot
Co-authored-by: Copilot <175728472+Copilot@users.noreply.github.com>
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2025-04-23 05:51:53 -04:00 |
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6629ecff2d
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implement function to add request for single occasional neighbor list
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2025-04-22 21:44:45 -04:00 |
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9e9caf7d14
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dummy implementation of single neighbor list build
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2025-04-22 16:02:51 -04:00 |
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