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e2a78cbed6
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SYCL team_reduce to mimic cuda __syncthreads_count
This fixes a suspected out of bounds error later on in the kernel.
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2021-07-02 15:41:32 +01:00 |
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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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9a7e32a924
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Add missing code in Kokkos neighborlist to use custom cutoff
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2021-04-28 13:54:23 -06:00 |
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b6498c8b9b
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Merge pull request #2665 from masterleinad/kokkos_sycl
Allow compiling with SYCL
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2021-03-18 11:27:42 -04:00 |
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42895ac6df
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Merge pull request #2654 from akohlmey/collected-small-changes
Collected small changes
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2021-03-16 19:34:54 -04:00 |
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46b86f3b1e
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Define LAMMPS_DEVICE_FUNCTION
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2021-03-16 22:20:47 +00:00 |
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ec5490e467
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Allow compiling with SYCL
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2021-03-16 21:04:51 +00:00 |
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dc435d8188
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Improve indentation
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2021-03-16 17:53:41 +00:00 |
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1fae21622a
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remove trailing whitespace
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2021-03-16 13:37:15 -04:00 |
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ac32d907c0
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Avoid intrinsics KOKKOS/npair_kokkos
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2021-03-16 17:09:37 +00:00 |
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8c4918457f
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consistently compare atom->molecular against enumerator constants
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2021-03-14 01:25:22 -05:00 |
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51a20175c9
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more code formatting consistency changes for loops and conditionals
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2020-12-30 09:47:45 -05:00 |
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382ade15fe
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more consistent formatting of for/while loops and if statements
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2020-12-30 09:09:08 -05:00 |
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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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94ad6821f7
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Merge pull request #2373 from stanmoore1/kk_wkar
Add workaround for performance regression in Kokkos Package
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2020-09-17 20:24:39 -04:00 |
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d8b6ebdfc8
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Add workaround for performance regression
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2020-09-17 16:33:48 -06:00 |
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7bf177a1c7
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Fast forward porting work to master
Change-Id: Ieb428e4a001efadf880dbe2c64c2a685cebdd4ae
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2020-09-17 10:45:04 -05:00 |
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9d0c3bc665
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replace some numeric constants in Atom and AtomVec classes with enumerators
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2020-09-11 19:07:55 -04:00 |
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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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6778489247
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silence a whole bunch more compiler warnings
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2020-08-13 16:26:50 -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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af3e8b4564
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Add change missed in cb2a9e4
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2020-05-01 13:25:23 -06:00 |
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0588232a34
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Fix rare issue in Kokkos neighlist
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2020-04-29 14:29:18 -06:00 |
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21cb0d394f
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Merge branch 'master' into kk_copycpu
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2020-04-28 11:56:22 -04:00 |
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7863dfa1d2
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Merge pull request #2033 from stanmoore1/kk_stencil
Fix bug in Kokkos occasional neighlist build
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2020-04-28 10:51:34 -04:00 |
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a4b3af7d95
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Fix bug in Kokkos occasional neighlist build
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2020-04-27 10:07:26 -06:00 |
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700bb2e0f4
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Merge branch 'master' of github.com:lammps/lammps into kk_copycpu
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2020-04-24 12:33:05 -06:00 |
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e114a8d15b
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Revert accidental change
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2020-04-24 10:14:31 -06:00 |
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cb2a9e4329
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Clear sharedsize for flat method
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2020-04-24 10:10:22 -06:00 |
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96202ccf56
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remove trailing whitespace
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2020-04-01 20:27:43 -04:00 |
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3ba83de700
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Work around team_size issue in npair_kokkos
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2020-03-30 16:26:46 -06:00 |
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eb80fd3031
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Add method to copy Kokkos neighbor list to CPU list
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2020-02-26 14:26:46 -07:00 |
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b90c372a63
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Fix mismatches in CUDA execution space qualifiers between declarations and
definitions.
Add missing `KOKKOS_INLINE_FUNCTION` to the definition of:
- `FixEnforce2DKokkos::post_force_item`
- `FixNeighHistoryKokkos::zero_partner_count_item`
- `FixNeighHistoryKokkos::pre_exchange_item`
Add missing `KOKKOS_FUNCTION` to the definition of:
- `NeighborKokkosExecute::build_Item`
- `NeighborKokkosExecute::build_Item_Ghost`
- `NeighborKokkosExecute::build_ItemSize`
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2019-12-17 17:27:51 -08:00 |
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b6b022b610
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whitespace cleanup: remove trailing blanks
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2019-11-03 11:03:39 -05:00 |
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9e7ca428aa
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whitespace cleanup: remove (evil) tabs
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2019-11-03 11:01:42 -05:00 |
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b88158fc3b
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Fix issue in npair_kokkos
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2019-05-29 11:16:38 -06:00 |
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179026dd44
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Reduce GPU data movement in npair_kokkos
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2019-03-14 17:13:12 -06:00 |
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71a6227240
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Optimize KOKKOS package for small system sizes
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2019-03-14 15:43:50 -06:00 |
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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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2e70541134
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consistent formatting: replace '}else' with '} else'
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2018-12-29 14:50:26 -05:00 |
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13d562e969
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Removed wrong which variable
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2018-07-06 12:06:09 -06:00 |
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228caa3fab
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Remove randomread from radius to prevent Kokkos runtime error when radius isn't defined
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2018-07-06 11:59:25 -06:00 |
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0a5b027bac
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Porting pair gran/hooke/history to Kokkos.
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2018-07-03 11:10:27 -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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15853a0e38
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Merge pull request #676 from stanmoore1/kokkos_reverse_comm
Add Kokkos threaded reverse communication
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2017-10-05 17:08:49 -06:00 |
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a86572f4fc
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Reduce memory churn in Kokkos package
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2017-09-29 16:20:19 -06:00 |
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9f2740b7f1
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Partially revert 01d0a5c, avoid atomics, safe because of the while loop. Worst case is the resize will happen again because max wasn't accurate
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2017-09-29 13:41:35 -06:00 |
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32e0de7a67
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first pass at implementing atom2bin for KOKKOS neighbor lists
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2017-09-25 14:06:20 -05:00 |
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789812ec3d
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KOKKOS: minor typo fix
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2017-09-25 14:06:20 -05:00 |
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