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c19db76eae
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delete_bonds: direct type label support
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2024-05-11 14:05:48 -04:00 |
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6e45a71de3
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restore numerical types example
(duplicated with type labels)
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2024-04-23 10:16:46 -04:00 |
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b227663b3b
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restore numerical examples
(duplicated in type label versions)
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2024-04-23 10:13:50 -04:00 |
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21eeb231ae
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remove bogus example
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2024-04-22 15:27:53 -04:00 |
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44ec209796
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direct type label for group
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2024-04-22 00:29:23 -04:00 |
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cf6522eebb
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type label support for atom/swap
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2024-04-18 14:32:23 -04:00 |
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e84540c626
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fix/mol/swap: direct type label support
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2024-04-17 14:35:00 -04:00 |
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a1826b1364
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fix_deposit: direct type label support
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2024-04-17 00:16:00 -04:00 |
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e590e27faa
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create_atoms: direct type label support
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2024-04-16 19:56:37 -04:00 |
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17d04ce41a
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Merge remote-tracking branch 'github/develop' into restricted-angle
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2024-04-13 02:45:53 -04:00 |
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95779b3504
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add versionadded tags
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2024-04-13 02:39:54 -04:00 |
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9d3e9c6146
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whitespace
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2024-04-10 18:03:01 -04:00 |
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dbb23b6006
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Merge branch 'develop' into pedone-potentials
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2024-04-10 18:02:31 -04:00 |
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e180527f08
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fix typo
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2024-04-10 12:35:09 -04:00 |
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06d579eb51
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improve atomfile variable docs
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2024-04-10 06:29:10 -04:00 |
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e979e8dc01
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spelling add false positives
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2024-04-09 22:36:49 -04:00 |
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b4fa1b07e9
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add version tag
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2024-04-09 22:21:34 -04:00 |
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01917cd117
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add example for Ca-O with Pedone
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2024-04-09 22:08:30 -04:00 |
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7ac84e18dd
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remove references to non-existing pedone/coul/long, complete description
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2024-04-09 21:35:45 -04:00 |
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aeec608be6
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partial docs also for future pedone/coul/long implementation
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2024-04-09 09:13:23 -04:00 |
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1b71576b6f
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Update CMake and docs
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2024-04-05 09:09:44 -06:00 |
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c0abefeacb
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update links in manual to jacobi3() docs
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2024-04-02 23:53:25 -04:00 |
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d73aec6c21
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add OpenMP version of angle style cosine/squared/restricted
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2024-03-29 21:31:40 -04:00 |
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b712e46497
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doc fixes
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2024-03-29 21:00:51 -04:00 |
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9c85e5a99b
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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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2024-03-29 14:27:43 -06:00 |
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b8fc8e5e63
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Update dihedral_style.rst
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2024-03-29 11:18:11 +01:00 |
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a9deb029e3
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Add files via upload
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2024-03-29 11:15:36 +01:00 |
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996f5b9d52
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fix ttm doc formatting fixes
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2024-03-29 02:50:30 -04:00 |
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2a8a7f6365
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Update angle_style.rst
Include link to rst file of the restricted angle potential
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2024-03-28 15:47:37 +01:00 |
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0893a2d0a0
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Add files via upload
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2024-03-28 15:43:01 +01:00 |
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cd154abe73
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add "Incorrect format in ... section of data file" to Error_details and url
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2024-03-26 23:56:38 -04:00 |
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b01efd96a5
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add missing link and expand docs for Unknown identifier in data file error
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2024-03-26 23:27:44 -04:00 |
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f3391199e7
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correct formatting of tables
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2024-03-25 14:26:39 -04:00 |
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d123cd5440
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fix typo
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2024-03-20 04:57:03 -04:00 |
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505f7b3cb4
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add 'append' keyword for appending to output file
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2024-03-17 15:34:32 -04:00 |
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d97c7fffac
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spelling
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2024-03-17 15:13:13 -04:00 |
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1bbe87d9d2
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add 'append' keyword for appending to output file
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2024-03-17 15:13:04 -04:00 |
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fce15bf66f
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add support for appending to files to fix ave/time
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2024-03-17 01:17:01 -04:00 |
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207a14f351
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Merge pull request #4101 from jtclemm/small-patches
Small patches to multi neighbor and fix deform/pressure
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2024-03-15 01:39:04 -04:00 |
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aa7e2da33d
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Misc small patches
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2024-03-13 15:04:19 -06:00 |
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d0d4cf9ad0
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add DOIs for recent stable releases
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2024-03-11 22:40:21 -04:00 |
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8819275824
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Merge pull request #3989 from evoyiatzis/patch-8
Addition of conical geometry in fix indent
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2024-03-08 12:10:52 -05:00 |
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ba5c1a4ac3
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minor modifications in fix_indent.rst
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2024-03-08 15:35:48 +01:00 |
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bd99c2d661
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Merge pull request #4097 from wmbrownIntel/numa_tune
Changes for processors grid numa style
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2024-03-07 14:19:12 -05:00 |
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8ab2544f5b
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Add option to specify # of numa domains for processors grid numa style, simplify numa mapping with more agressive optimization to reduce comm between numa domains.
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2024-03-07 07:07:16 -08:00 |
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ea52699893
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collapse the two /report styles into a single "report" style
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2024-03-05 19:02:11 -05:00 |
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c6f90b2ae3
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Merge branch 'develop' into collected-small-fixes
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2024-03-05 18:27:20 -05:00 |
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7e8b243891
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make use of ..versionadded/..versionchanged consistent with the rest of LAMMPS
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2024-03-05 18:26:41 -05:00 |
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0dc6e156c1
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add balance styles shift/report and rcb/report for reporting imbalances only
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2024-03-05 18:24:38 -05:00 |
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1949953c0c
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Clarifying more variables, enabling offset option with integration style
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2024-03-04 23:38:55 -05:00 |
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