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9fefb92b8a
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Merge branch 'lammps:develop' into doc-fixes
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2022-08-30 21:48:22 -05:00 |
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d874976222
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Merge branch 'develop' into collected-small-changes
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2022-08-30 14:59:07 -04:00 |
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85965f01ce
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spelling
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2022-08-30 14:44:01 -04:00 |
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1139cb9345
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formatted mesocnt doc files
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2022-08-30 17:53:35 +01:00 |
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8a058ec2a0
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fixed whitespace
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2022-08-30 15:14:34 +01:00 |
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4e5604daef
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Merge remote-tracking branch 'official/fix-pair-dump-skip' into feature/pace-al
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2022-08-30 16:07:10 +02:00 |
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2c0eb10d62
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label electron spin with "espin" instead of "spin" but be backward compatible
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2022-08-30 06:20:53 -04:00 |
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bfb15c6cc6
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support setting electron spin and radius with the set command
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2022-08-30 06:11:17 -04:00 |
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978165377d
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clarify and correct units of "k"
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2022-08-30 05:00:06 -04:00 |
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e3c0b04c39
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Doc tweaks to make it easier to parse for a non-human
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2022-08-30 00:09:18 -05:00 |
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118b464a53
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add example for a 1-d pressure profile
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2022-08-29 17:04:48 -04:00 |
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d34f583ae6
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Update doc/src/Packages_details.rst
Co-authored-by: Axel Kohlmeyer <akohlmey@gmail.com>
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2022-08-29 22:04:09 +01:00 |
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bdac6d3e05
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Merge branch 'develop' into more-set-options
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2022-08-29 12:21:17 -04:00 |
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756a8fab18
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Merge branch 'lammps:develop' into mesocnt_stable
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2022-08-29 12:45:20 +01:00 |
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74bbbb9e17
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rename "set spin" to "set spin/atom" and "set spin/random" to "set spin/atom/random"
this also adds unit tests and improves error checking and messages
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2022-08-28 19:24:32 -04:00 |
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6e71318086
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fix typo
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2022-08-28 11:21:38 -04:00 |
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b631a3c553
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Merge branch 'lammps:develop' into fortran-tinkering
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2022-08-27 20:10:59 -05:00 |
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69b32aef13
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Merge remote-tracking branch 'github/develop' into collected-small-changes
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2022-08-27 10:12:58 -04:00 |
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4069aa3658
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Fixed non-existent dump_custom attribute in dump_modify thresh example
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2022-08-26 00:13:31 -05:00 |
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6a3726425d
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update MEAM to state of latest PR #3412
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2022-08-23 14:20:45 -04:00 |
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60e5ce0dc2
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refer to temperature more consistently with :math:T instead of *T*
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2022-08-23 05:26:07 -04:00 |
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0b22ad5189
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correctly use versionchanged directive
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2022-08-23 01:04:49 -04:00 |
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54c928dbce
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improve typesetting, record version change, a few more k_B changes
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2022-08-23 00:51:36 -04:00 |
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007f7fbbfb
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Fixed kT vs k_B T in a couple of places and associated description
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2022-08-22 23:46:49 -05:00 |
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0f3c4357c8
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Merge branch 'doc-fixes' of github.com:hammondkd/lammps into doc-fixes
Changed some "dof" to "DOF" as per Axel's preference
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2022-08-22 23:29:34 -05:00 |
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5d04e88e28
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Changed a couple of "dof" to "DOF" as per Axel's preference
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2022-08-22 23:29:24 -05:00 |
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c135eb0a5f
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fix spelling
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2022-08-23 00:05:17 -04:00 |
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18f10a6a0d
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use k_B for Boltzmann constant
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2022-08-23 00:04:25 -04:00 |
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0eefdf8a87
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Fixed typos; evidently make html is more forgiving than make pdf
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2022-08-22 22:03:18 -05:00 |
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88f7e4c7b6
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After running "make fix-whitespace"
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2022-08-22 21:41:12 -05:00 |
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4d8dc03a3f
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Edits to fix.rst and additions for missing styles
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2022-08-22 21:13:59 -05:00 |
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4b842d52e6
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Merge branch 'develop' into type-labels
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2022-08-22 10:45:48 -04:00 |
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57346a359a
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permit asterisk in type labels
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2022-08-22 10:39:05 -04:00 |
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842266cbe5
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avoid referencing a suggested type label format
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2022-08-22 10:35:09 -04:00 |
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b96398e5e9
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Minor edits to doc pages for echo group if
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2022-08-21 22:19:30 -05:00 |
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2259947d52
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Edits to documentation files for consistency and math
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2022-08-19 23:49:44 -05:00 |
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de0b7bf737
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Tweaks to documentation to make it more consistent and machine-readable
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2022-08-19 19:25:15 -05:00 |
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7a35ec3527
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Merge branch 'lammps:develop' into fortran-tinkering
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2022-08-19 08:52:30 -05:00 |
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d32b303a82
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Finished edits on computes (whew!); builds with no errors or warnings
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2022-08-19 00:25:06 -05:00 |
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d03f0a6716
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More cosmetic edits to documentation
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2022-08-18 19:25:06 -05:00 |
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8a9cd4b2b5
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Merge branch 'lammps:develop' into doc-fixes
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2022-08-18 17:48:47 -05:00 |
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1b979be939
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Merge pull request #3392 from akohlmey/minimize-neighbor-check
Update test for neighbor list settings during minimization
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2022-08-17 20:55:23 -04:00 |
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c3f57037e6
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Merge pull request #3391 from akohlmey/refactor-find-xxx
Continued refactoring of internal APIs and their use
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2022-08-17 19:37:20 -04:00 |
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d1e0af7ef5
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discuss why one would want to use check = no during minimization
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2022-08-17 16:00:00 -04:00 |
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daa6b78c43
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update documentation
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2022-08-17 15:22:59 -04:00 |
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a2714d6cc7
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updated documentation for mesocnt styles
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2022-08-17 17:25:22 +02:00 |
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6aa1d1fb95
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Edited compute reduce and reduce/chunk to make easier to parse and more consistent
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2022-08-16 23:26:13 -05:00 |
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fe8a7a3799
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Math replacements; code-block LAMMPS; clarity and parsing-friendly edits
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2022-08-16 20:29:12 -05:00 |
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19e3af893f
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updated package detail documentation
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2022-08-16 14:50:46 +02:00 |
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953f63bb8f
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More math and code-block edits
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2022-08-15 23:48:30 -05:00 |
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