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981cfd42f6
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Merge pull request #2120 from lammps/next_lammps_version
Update version strings for the next patch release
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2020-06-01 15:08:09 -04:00 |
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b81826131b
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Merge branch 'master' into bond/react-molecule-fragment-support
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2020-05-31 16:34:41 -04:00 |
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09ce0d1198
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rephrase to use more common term
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2020-05-31 16:33:37 -04:00 |
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acf280811a
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step version strings for next patch release
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2020-05-31 11:14:50 -04:00 |
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2a4bd9ef53
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small tweaks and documentation update to coverage cleaning targets
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2020-05-29 08:33:34 -04:00 |
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7bcf50b129
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mention reset_coverage data
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2020-05-29 08:26:26 -04:00 |
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c2ab177c3a
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add some explanations and figures for code coverage
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2020-05-29 08:24:05 -04:00 |
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b0f6eafac8
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minor doc clarification
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2020-05-27 23:37:35 -06:00 |
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315463e65f
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Merge pull request #2108 from akohlmey/more-pair-style-tests
Add unit tests for manybody pair styles
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2020-05-27 18:48:22 -04:00 |
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9bc03034ef
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add some initial documentation about the included tests
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2020-05-27 18:02:32 -04:00 |
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2e3f03f9ca
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remove pair style eam/cd/omp which seems broken beyond repair
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2020-05-26 20:55:57 -04:00 |
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5d6c18dbed
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one more correction for cmake --build
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2020-05-26 12:29:03 -04:00 |
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31a3e84950
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correct documentation about cmake --build with targets
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2020-05-26 12:26:44 -04:00 |
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375fb4b314
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bond/react: change 'general name' for method
and update contact info
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2020-05-23 23:32:49 -06:00 |
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60e0a8a6a8
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Update fix_bond_react.rst
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2020-05-23 23:12:16 -06:00 |
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2371db3242
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add missing "reciprocal"
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2020-05-21 07:41:07 -04:00 |
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2dad3cbb2f
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update false positives list for time units correction to the docs
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2020-05-21 01:37:11 -04:00 |
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e784afd60f
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use proper units (fmsec -> fs, psec -> ps and so on)
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2020-05-21 01:13:15 -04:00 |
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293bfa0485
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fix typo
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2020-05-21 01:13:03 -04:00 |
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c04a71a239
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add unit test framework for pair, bond, angle styles from progguide branch
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2020-05-19 22:24:31 -04:00 |
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a6cfe8f642
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update Kokkos related documentation about JIT compilation and UVM.
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2020-05-11 18:07:51 -04:00 |
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8301c7a9c6
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Merge branch 'master' of ssh://github.com/lammps/lammps into atomvec-custom
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2020-05-06 15:53:21 -06:00 |
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260e6bafd5
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Merge pull request #2064 from akohlmey/next_lammps_version
Update version strings for the next patch release
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2020-05-04 19:43:12 -04:00 |
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1329603184
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Merge pull request #2019 from z-gong/viscosity
Fix and compute styles for calculating viscosity with periodic perturbation method
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2020-05-04 17:42:31 -04:00 |
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6d0ef85671
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Merge pull request #2055 from akohlmey/reaxc-runtime-adjust
Make MIN_HBONDS define for reax/c configurable via an input option
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2020-05-04 10:28:13 -04:00 |
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48262fd0a9
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Merge pull request #2051 from akohlmey/collected-small-changes
Collected small changes for the next patch release
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2020-05-04 10:06:45 -04:00 |
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bed6ad4660
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manually incorporate fixes for ave/correlate/long from PR #2066
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2020-05-04 08:18:56 -04:00 |
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7295e93e9b
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step version strings for the next patch release
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2020-05-03 07:28:38 -04:00 |
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4bf9c47317
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support diskfree option to "fix halt" also on BSD variants
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2020-05-03 02:34:40 -04:00 |
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1418ec4ace
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make MIN_HBONDS define for reax/c configurable via an input option
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2020-05-01 23:22:48 -04:00 |
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3ccab20e9e
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add new false positives
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2020-05-01 14:34:27 -04:00 |
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5cb9d12538
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whitespace cleanup
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2020-05-01 14:34:20 -04:00 |
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8e32f623f1
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reformatted table for per-atom fields
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2020-05-01 11:48:08 -06:00 |
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807b0fce7e
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fix broken doc page links to new fix sph commands
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2020-05-01 09:48:01 -06:00 |
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0cf5636034
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Add missing paramemter to compute_orientorder_atom docs
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2020-05-01 08:01:29 -06:00 |
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6817355a41
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Update docs
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2020-05-01 07:53:41 -06:00 |
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25b6d98658
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correct references and table format
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2020-04-30 20:19:23 -04:00 |
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8689b7a404
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Merge branch 'master' into atomvec-custom
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2020-04-30 20:09:23 -04:00 |
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5e619b65f6
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USER-SPH doc tweak
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2020-04-30 17:08:05 -06:00 |
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ec9b7c787d
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more doc changes for USER-SPH
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2020-04-30 16:52:32 -06:00 |
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4eb4839f6d
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renaming of variables and command names in USER-SPH
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2020-04-30 16:40:09 -06:00 |
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5ec357adfc
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spelling errors
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2020-04-30 15:06:59 -06:00 |
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ecd3652f61
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update to current master
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2020-04-30 11:57:17 -06:00 |
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ae3c804cd2
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Minor fix in doc
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2020-04-30 19:00:37 +02:00 |
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0b02108ba1
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add add check to refuse running with 2d systems and document it.
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2020-04-30 12:46:16 -04:00 |
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859f644481
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make spellchecker and sphinx happy
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2020-04-30 12:45:36 -04:00 |
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5062d57ccb
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Merge branch 'master' into viscosity
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2020-04-30 12:32:06 -04:00 |
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26321d49c4
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Update How-to viscosity and put the example together with other viscosity examples.
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2020-04-30 17:05:01 +02:00 |
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18c63ade92
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clarified AMD quote from review paper
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2020-04-29 16:14:52 -06:00 |
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754d9fabc6
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Merge branch 'ubuntu-install-docs' of github.com:ellio167/lammps into ubuntu-install-docs
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2020-04-28 17:27:49 -04:00 |
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