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ec5dfcd0fb
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remove note that was obsoleted 5 years ago
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2024-10-22 09:50:30 -04:00 |
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34ab2f862a
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small tweaks
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2024-10-18 22:09:25 -04:00 |
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f128abe002
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improve OPLS description
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2024-10-18 21:51:43 -04:00 |
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2074b0c400
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add check to allow only valid swaps between hybrid sub-styles and document it
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2024-10-18 21:49:55 -04:00 |
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86e18b8a24
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fix copy-n-modify issue
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2024-10-16 10:23:16 -04:00 |
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2ce934fdb9
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added section on OPLS-AA taken from https://matsci.org/t/issues-with-opls-force-field-for-ethylene-glycol-simulation/58296/11
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2024-10-16 10:05:26 -04:00 |
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9abfe38120
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Merge branch 'develop' into collected-small-changes
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2024-10-14 22:54:22 -04:00 |
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59bbc5bcc1
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Merge pull request #4356 from evoyiatzis/patch-1
add extract() function to few angle and bond styles
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2024-10-14 19:25:29 -04:00 |
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db3416c4b3
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Apply corrections from code review by @simongravelle
Co-authored-by: Simon Gravelle <simon.gravelle@live.fr>
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2024-10-14 08:19:53 -04:00 |
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8156e56617
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be more paranoid about Sphinx updates breaking extensions we use
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2024-10-13 19:31:40 -04:00 |
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c15c4d23bb
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fix spelling/syntax issues
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2024-10-13 19:30:30 -04:00 |
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b3b9d032fa
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cleanup, clarification and re-wrap of doc file sections
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2024-10-13 18:56:41 -04:00 |
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03d10e6bbc
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correct documentation to add "inputs local" to compute reduce commands on local data
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2024-10-13 18:56:07 -04:00 |
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f1a79e7df5
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Update fix_adapt.rst
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2024-10-11 19:55:28 +02:00 |
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df50691488
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small correction and clarifications
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2024-10-11 06:54:46 -04:00 |
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6d30557ec2
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Update partially fix_adapt.rst
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2024-10-11 11:08:32 +02:00 |
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5c82063376
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Merge branch 'electrode' of github.com:robeme/lammps into collected-small-changes
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2024-10-10 17:32:28 -04:00 |
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9adf51f18e
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ignore python wheel build folder
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2024-10-10 17:29:33 -04:00 |
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7693e96828
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change globbed toc script from bash to python
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2024-10-10 17:24:23 -04:00 |
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9835adcbfc
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allow use of Sphinx version 8.x as interface with breathe seems to have been updated
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2024-10-10 13:36:53 -04:00 |
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766ba94396
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use script instead of globbing to avoid entering commands in multiple toctrees
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2024-10-10 13:36:48 -04:00 |
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505d519be2
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Update affiliation for ELECTRODE in package details
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2024-10-10 16:18:05 +02:00 |
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7da8748e90
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add region command to list of exceptions needing the accelerator include
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2024-10-05 22:49:13 -04:00 |
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aec43d0f00
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Merge branch 'develop' into lubricate_patch
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2024-10-04 17:09:27 -04:00 |
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0a6d25881b
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update documentation according to accelerated style include check
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2024-10-04 13:54:04 -04:00 |
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25afdcc325
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add check for missing or unneeded accelerated style include
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2024-10-04 13:52:12 -04:00 |
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9108168ea3
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doc
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2024-10-04 11:35:46 -05:00 |
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08266b65e4
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doc
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2024-10-04 15:45:16 +00:00 |
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f7cf859670
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doc
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2024-10-04 15:32:47 +00:00 |
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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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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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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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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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b25e370e63
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some more fixes and rewording
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2024-09-30 15:42:34 -04:00 |
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a31f083bab
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update read_dump docs with respect to reading xyz style dump files
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2024-09-30 14:54:35 -04:00 |
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d33ecd6bbf
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reorder ctip style
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2024-09-29 05:58:02 -06:00 |
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ba071fe55a
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Merge branch 'develop' into small-patches
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2024-09-27 15:30:31 -06:00 |
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13591dbdb0
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Changing pour insertion note box
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2024-09-26 20:02:47 -06:00 |
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4436197081
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PAdding possible note to fix pour doc
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2024-09-26 16:14:57 -06:00 |
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5ee63d7afe
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documenting fix nonaffine/disp's incompatability with rerun
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2024-09-26 13:06:32 -06:00 |
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15e513958e
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clarification of min/max keywords in fix gcmc
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2024-09-26 11:08:59 -04:00 |
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385a0da892
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update and correct description of running LAMMPS on Windows
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2024-09-25 12:29:26 -04:00 |
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b9600c5a67
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Merge remote-tracking branch 'github/develop' into collected-small-changes
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2024-09-23 14:50:45 -04:00 |
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d787ecdcb3
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clarify docs for XYZ file format
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2024-09-23 14:44:16 -04:00 |
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cfe96064e8
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Fixing errors in RHEO doc files
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2024-09-23 12:39:16 -06:00 |
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b95f7c2ab2
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Merge pull request #4333 from evoyiatzis/patch-4
add extract() function to several angle styles
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2024-09-23 14:27:47 -04:00 |
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061c80104a
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add docs to mention using a type labels for xyz files with string labels
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2024-09-21 12:24:41 -04:00 |
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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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5290779554
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Merge branch 'develop' into collected-small-changes
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2024-09-21 00:01:28 -04:00 |
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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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