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25c9f5a6ff
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unit test for extract() in angle-mm3.yaml
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2024-09-22 20:01:52 +02:00 |
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96d99e3dd6
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unit test for extract() in bond-fene_expand.yaml
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2024-09-22 15:33:46 +02:00 |
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0d6abcb86a
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unit test for extract() in bond-mm3.yaml
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2024-09-22 15:31:01 +02:00 |
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8294bea7a7
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Update angle section of fix_adapt.rst
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2024-09-21 10:02:06 +02:00 |
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68548cbb0d
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Update angle_spica.cpp
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2024-09-20 20:53:22 +02:00 |
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d8c0691684
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Update bond section of fix_adapt.rst
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2024-09-20 19:55:07 +02:00 |
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b2a2cefc02
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add extract() function to bond_fene_expand.cpp
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2024-09-20 19:38:58 +02:00 |
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423b058820
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add extract() function to bond_fene_expand.h
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2024-09-20 19:38:22 +02:00 |
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7f0ff96324
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add extract() function to angle_class2.cpp
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2024-09-20 19:37:12 +02:00 |
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b49f3412df
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add extract() function to angle_class2.h
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2024-09-20 19:36:35 +02:00 |
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c5e62b4a47
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add extract() function to angle_dipole.cpp
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2024-09-20 19:35:46 +02:00 |
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873030982d
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add extract() function to angle_dipole.h
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2024-09-20 19:35:11 +02:00 |
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3ce4c782d1
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add extract() function to angle_spica.cpp
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2024-09-20 19:34:16 +02:00 |
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8e07149593
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add extract() function to angle_spica.h
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2024-09-20 19:33:41 +02:00 |
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8a2564fff1
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add extract() function to bond_mm3.cpp
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2024-09-20 19:32:41 +02:00 |
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4272d4a390
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add extract() function to bond_mm3.h
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2024-09-20 19:32:05 +02:00 |
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83b2e88b73
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add extract() function to angle_mm3.cpp
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2024-09-20 19:31:20 +02:00 |
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c65a6e8b59
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add extract() function to angle_mm3.h
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2024-09-20 19:30:42 +02:00 |
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cc9f45af88
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add extract() function to angle_cosine_squared_restricted.cpp
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2024-09-20 19:29:34 +02:00 |
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25f12bf800
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add extract() function to angle_cosine_squared_restricted.h
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2024-09-20 19:28:56 +02:00 |
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f916a0cc63
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add extract() function to angle_cosine_periodic.cpp
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2024-09-20 19:27:58 +02:00 |
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42f0940aee
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add extract() function to angle_cosine_periodic.h
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2024-09-20 19:27:18 +02:00 |
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7b37f1ae17
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add extract() function to angle_fourier.cpp
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2024-09-20 19:26:25 +02:00 |
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bf9cb26afb
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add extract() function to angle_fourier.h
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2024-09-20 19:25:49 +02:00 |
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1e00249b73
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add extract() function to angle_quartic.cpp
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2024-09-20 19:25:04 +02:00 |
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df533d97cb
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add extract() function to angle_quartic.h
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2024-09-20 19:24:20 +02:00 |
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3b73f56d79
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add extract() function to angle_fourier_simple.cpp
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2024-09-20 19:22:29 +02:00 |
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9d1a0240d6
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add extract() function to angle_fourier_simple.h
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2024-09-20 19:21:32 +02:00 |
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438a8c9335
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add extract() function to angle_charmm.cpp
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2024-09-20 19:19:47 +02:00 |
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cc24f3d240
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add extract() function to angle_charmm.h
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2024-09-20 19:16:55 +02:00 |
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805c2ae131
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Merge pull request #4326 from akohlmey/collected-small-changes
Collected small changes and fixes
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2024-09-17 08:48:46 -04:00 |
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6503f297d4
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support angle style hybrid with fix adapt
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2024-09-16 21:21:20 -04:00 |
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47bb1a8748
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update unit test
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2024-09-16 21:04:22 -04:00 |
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516d988deb
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update fix adapt docs
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2024-09-16 20:59:04 -04:00 |
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5d40a9640d
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add support for bond style hybrid to fix adapt
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2024-09-16 20:49:44 -04:00 |
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11365e7b2e
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add extract method to bond style harmonic/shift
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2024-09-16 20:48:41 -04:00 |
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804aa4ee85
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improve error message
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2024-09-16 20:38:50 -04:00 |
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80cd9ace57
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remove documentation check (for now)
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2024-09-16 01:07:38 -04:00 |
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4a9b7b1ba7
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fix typo
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2024-09-16 00:59:43 -04:00 |
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f8eac87724
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make programming style check and doc info check a github action
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2024-09-16 00:56:09 -04:00 |
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44d86c378b
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relax epsilon or mark unstable based on test results on non-x86 architectures
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2024-09-16 00:34:28 -04:00 |
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8c4e67c10b
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add concurrency group feature to unit test workflows, too.
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2024-09-14 06:07:07 -04:00 |
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79fbd46bd9
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try out concurrency group feature on quick regression as suggested by @junghans
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2024-09-14 06:04:35 -04:00 |
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1587473ab5
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fix comparison for missing arguments when using wildcards
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2024-09-14 05:11:51 -04:00 |
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bdca275f10
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correct indexing when filling lmp_firstneigh array
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2024-09-14 02:25:03 -04:00 |
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fe8611bfc8
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sync author info with LAMMPS home page
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2024-09-13 22:55:05 -04:00 |
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92bd9fc161
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fix linking a URL and fix spelling
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2024-09-13 02:20:26 -04:00 |
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1adaab80aa
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make certain values for LAMMPS variables are initialized
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2024-09-13 00:11:13 -04:00 |
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2995cb76ae
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Merge pull request #4324 from rbberger/cmake_optional_docenv
Make CMake Doc build docenv optional
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2024-09-12 17:57:45 -04:00 |
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9339da075b
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Merge pull request #4299 from evoyiatzis/patch-3
Allow the definition of point in region plane using variables
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2024-09-12 17:52:30 -04:00 |
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