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7e31a4f482
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Simplify view deallocation code
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2024-09-23 16:14:06 -06:00 |
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34cd8ad3bc
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Small cleanup
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2024-02-06 11:01:42 -07:00 |
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d3b48a9346
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kokkos: use std::enable_if_t and std::is_same_v
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2023-04-22 16:20:04 -06:00 |
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3ac4202de2
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Fix GPU tag issues in other Kokkos styles
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2022-11-29 10:25:43 -07:00 |
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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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598e8cc488
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Port changes to other Tersoff styles
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2022-10-17 15:31:34 -06:00 |
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ad048a20d7
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Remove unused variables
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2022-10-17 14:42:09 -06:00 |
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0cfb26799c
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Fix copy/paste error
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2022-04-14 13:47:57 -06:00 |
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c5565a4e02
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Small tweaks
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2022-04-14 13:16:44 -06:00 |
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44f67330e2
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Port changes to other flavors of Tersoff
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2022-04-13 13:50:49 -06:00 |
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86b686f159
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correct handling of neighflag member variable in KOKKOS styles
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2022-03-10 00:52:16 -05:00 |
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3ef02edb48
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adapt KOKKOS package styles to use new neighbor list request API
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2022-03-09 22:43:38 -05:00 |
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a7084c8fdb
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Merge remote-tracking branch 'origin/develop' into kokkos_unittests
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2022-02-07 13:04:59 -05:00 |
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b2916339a4
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Add NeedDup_v and AtomicDup_v helpers to KOKKOS
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2022-01-31 13:42:03 -05:00 |
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735d6926a1
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Update to KK tersoff styles for consistent nofdotr
Inspired by f82096c46c
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2022-01-27 14:36:45 -05:00 |
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09c19a936b
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update URLs in source code and manual
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2021-05-24 14:18:20 -04:00 |
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d1941392d3
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disable clang-format for all existing .cpp files (for now)
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2021-05-05 23:53:38 -04:00 |
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0b73ab96d2
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avoid replicated code, consolidate variables and element mapping
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2021-03-27 12:09:36 -04:00 |
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cbca189490
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Merge branch 'master' into tersoff-shift
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2021-01-11 04:30:11 -05:00 |
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7ca7dfe179
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add check to error out if an accelerated variant is used that does not support the shift flag
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2021-01-04 23:03:40 -05:00 |
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8efd1c93ec
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Add more granular control of Kokkos pair and fix comm
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2020-12-22 09:19:01 -07:00 |
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adf74b3a22
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use https://lammps.sandia.gov based URLs consistently
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2020-10-21 16:45:30 -04:00 |
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b8f59fd37c
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Update from master
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2020-08-25 20:29:03 -06:00 |
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450fd12d31
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Changes needed for Kokkos v3.2
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2020-08-21 14:45:12 -05:00 |
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f0e36c74a8
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silence more signedness comparison warnings
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2020-08-15 18:10:13 -04:00 |
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4227c5e9e1
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silence more compiler warnings about unused parameters and variables
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2020-08-13 18:19:35 -04:00 |
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ed566bf6af
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First set of changes for Kokkos HIP
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2020-08-04 12:16:26 -05:00 |
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7a5f73137a
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Fix runtime issues with Kokkos vatom
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2020-03-26 16:21:06 -06:00 |
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e298978da0
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Change Kokkos::Impl to std namespace
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2020-03-25 13:58:12 -06:00 |
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2b5a6d3b7f
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clean up (some) includes in KOKKOS package
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2019-07-15 18:05:20 -04:00 |
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5b3a15bd94
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putting implementation header first in package folder sources
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2019-07-03 19:58:25 -04:00 |
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06a57dd659
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use ev_unset for all pair styles
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2019-03-13 17:49:16 +01:00 |
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f0e48931e4
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Remove deprecated KOKKO_HAVE macros
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2019-03-07 10:17:32 -07:00 |
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9f058f19bc
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Deallocate duplicated memory
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2018-08-10 12:49:02 -06:00 |
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d9fb37e25e
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Add data duplication to pair_tersoff_kokkos and variants
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2018-08-10 12:30:03 -06:00 |
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e4071d7f46
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replace C-style include files with their C++ equivalents
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2018-04-27 18:00:24 -04:00 |
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a6d10ba91d
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Remove deprecated Kokkos code
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2018-03-22 11:19:17 -06:00 |
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ee862d8bf5
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replace leading tabs
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2018-03-16 12:34:33 -04:00 |
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15a3364c2c
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Make memory_kokkos its own class
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2017-12-01 09:13:31 -07:00 |
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f4b6b67f6e
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Fixing more execution space issues in KOKKOS package
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2017-07-21 15:04:14 -06:00 |
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b889776557
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Fixing memory leak in Kokkos neighborlist
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2017-06-26 10:51:26 -06:00 |
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1f6c1942b3
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Disable allocation of per-atom arrays in ev_setup for Kokkos styles
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2017-03-08 12:42:44 -07:00 |
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a5f830c40c
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fix typo
(cherry picked from commit 6410797697)
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2017-02-08 14:33:45 -05:00 |
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207adc3968
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Merge pull request #373 from stanmoore1/kk_more_bugfixes
Fixing Kokkos per-atom energy/virial issues
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2017-02-03 14:45:31 -07:00 |
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1834a5e46c
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Fixing more Kokkos per-atom and fdotr issues
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2017-02-02 15:21:21 -07:00 |
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daf9f95381
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Fixing Kokkos per-atom e/v issue
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2017-02-02 13:09:52 -07:00 |
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7ee45ec5f3
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Fixing tagint and imageint issues in Kokkos package
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2017-02-01 11:52:27 -07:00 |
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eca9539f84
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Disallowing full neighborlist for pair_tersoff_kokkos styles until a bugfix is released
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2016-12-28 10:59:53 -07:00 |
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a31b00965a
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Updating to master
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2016-12-12 09:18:20 -07:00 |
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