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63e674cc3e
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simplify and remove redundant or dead code
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2023-10-24 18:37:29 -04:00 |
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d1980031ef
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remove more duplicate semicolons
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2023-06-25 06:02:17 -04:00 |
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27da716852
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getting out of the insurance business :-)
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2023-01-23 16:45:41 -05:00 |
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f88bfbb6af
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use enumerators for symbolic constants to flag integrator and linesearch styles
also a small update to error, warning, and info output
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2023-01-09 13:32:04 -05:00 |
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13e5b12f21
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Merge pull request #3555 from stanmoore1/kk_atom_vec
Refactor Kokkos `AtomVec`
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2022-12-14 13:43:07 -05:00 |
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bd2001578b
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Remove more redundant variables
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2022-12-13 10:56:56 -07:00 |
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6d8e7e1ece
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Refactor Kokkos AtomVec
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2022-12-12 17:34:18 -07:00 |
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b30ce3ff32
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next round of IWYU updates
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2022-12-12 01:07:46 -05:00 |
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2132b1d904
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update developer reference text
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2022-10-24 11:08:26 -04:00 |
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cccf3f6f78
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change email for contacting LAMMPS developers, add to homepage checker
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2022-10-20 20:36:03 -04:00 |
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0af2f153de
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check for and replace *really* old LAMMPS home page URL. apply fixes.
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2022-10-20 20:07:12 -04:00 |
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1eb3d50c22
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simplify/modernize
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2022-09-26 13:38:35 -04:00 |
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5ea37448b6
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whitespace
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2022-09-26 13:12:04 -04:00 |
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ac6cb062e6
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Completing the correction in fix langevin/spin.
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2022-09-26 07:44:32 +02:00 |
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1ef2c8c5dc
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improving the energy computation model in SPIN/compute_spin.cpp
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2022-09-21 10:06:41 +02:00 |
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7e8e40fefa
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correcting memory issue in SPIN/compute_spin.cpp
removing incorrect line in compute_property_atom.cpp
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2022-09-21 09:34:30 +02:00 |
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293a70b719
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JT190922, C1:
- correction of a memory issue in compute_spin.cpp
- correction of the Langevin calculation in fix_langevin_spin.cpp
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2022-09-19 09:02:00 +02:00 |
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67f6adebb7
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whitespace fixup with dynamic casts
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2022-09-10 13:26:38 -04:00 |
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ea254d9105
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remove bogus else branch
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2022-09-01 16:03:23 -04:00 |
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1d89c3f5d7
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Fixed remaining BibTeX entries, checked all entries in issue #2597
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2022-08-13 13:45:39 -05:00 |
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1473f760f8
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Fixed a few oversights and typos
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2022-08-13 13:07:31 -05:00 |
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29e1595fb4
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Updates to BibTeX syntax for anything that needed it that I caught and fixes to address Issue #2597
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2022-08-13 04:51:54 -05:00 |
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78c10bac4a
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clang-format update
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2022-04-23 13:08:11 -04:00 |
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115962db88
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Merge branch 'develop' into remove-error-docs-in-header
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2022-04-23 12:46:54 -04:00 |
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79a7d2abf6
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remove error docs from header files
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2022-04-22 23:31:15 -04:00 |
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47564ab6bc
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Merge branch 'develop' into region-lookup-refactor
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2022-04-22 22:11:41 -04:00 |
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69d9c5187e
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refactor group access, enable and apply clang-format
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2022-04-15 15:29:43 -04:00 |
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b16d48aa41
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"stringify" and "vectorize" processing of per-atom attributs in AtomVec classes
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2022-04-14 11:06:10 -04:00 |
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200b4f13c7
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use dynamic cast instead of c-style cast when casting from base type to derived class
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2022-04-10 18:18:06 -04:00 |
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39b316729b
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use auto type when assigning from cast or using new
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2022-04-10 18:16:36 -04:00 |
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c7a9a3e2f6
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simplify and replace use of XXXINT_FORMAT macros
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2022-03-30 16:13:38 -04:00 |
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080662683d
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use tokenizer to read neb initial replica files
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2022-03-22 20:54:42 -04:00 |
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1db981c784
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convert a few more styles to the new neighbor request API
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2022-03-08 18:20:28 -05:00 |
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79a9829e92
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Apply override to remaining classes
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2022-01-22 09:56:01 -05:00 |
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06beb28d7d
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Apply override to Pair classes
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2022-01-21 16:13:49 -05:00 |
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ff3f762499
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Apply override to Fix classes
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2022-01-21 14:45:53 -05:00 |
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f83271aa40
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Apply override to Compute classes
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2022-01-21 13:23:36 -05:00 |
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c9776dad6f
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Apply override to Command classes
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2022-01-20 16:35:59 -05:00 |
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b45a6d7720
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Apply override to AtomVec classes
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2022-01-19 17:31:41 -05:00 |
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c8512249b7
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Merge branch 'develop' into modify-fix-compute-accessors
# Conflicts:
# src/PLUGIN/plugin.cpp
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2021-10-27 21:14:05 -04:00 |
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85433e8bd1
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use true/false instead of 1/0 detected and changed by clang-tidy
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2021-10-20 12:41:02 -04:00 |
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241c816ad3
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adapt fix shake and pair style spin
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2021-10-18 17:29:25 -04:00 |
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2fba6b44e4
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use '= default' when default functions should be used
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2021-10-13 23:59:05 -04:00 |
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6a9bb577cf
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rename "zip" functions to "compress" functions. update related docs
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2021-10-07 12:38:11 -04:00 |
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b8d6df6461
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add missing platform scope
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2021-10-06 20:44:42 -05:00 |
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ec1a55b35b
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use platform code for reading/writing of compressed text file via a pipe
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2021-10-06 15:04:48 -04:00 |
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f641b1c659
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final chunk of changes to apply utils::logical()
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2021-09-23 07:30:40 -04:00 |
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914f035475
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a few more converted commands and updates for unit tests
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2021-09-21 17:23:41 -04:00 |
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bca99f684f
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update list and order of include files from include-what-you-use analysis
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2021-09-18 14:16:48 -04:00 |
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707d9f0ad2
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use correct data type for MPI calls
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2021-09-16 00:11:16 -04:00 |
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