28641bcbc7
Merge pull request #2402 from ndtrung81/gpu-dpd
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Allowed dpd/tstat/gpu and dpd/gpu to work together in pair style hybrid
2020-10-14 17:18:02 -04:00
67803fe17f
Minor cleanup for dpd/tstat in the GPU library
2020-09-28 11:41:39 -05:00
28812b1ea7
Merge pull request #2381 from akohlmey/collected-small-changes
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Collected small changes
2020-09-24 16:17:28 -04:00
9df1bb4db0
remove obsolete makefiles. Makefile.xk7 is on death watch but Blue Waters still has such nodes
2020-09-22 17:47:14 -04:00
459d51bbea
Do not disable atomics for HIP
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atomics are disabled for NVIDIA 1.0 cards, which should not affect ROCm HIP
2020-09-22 22:34:24 +03:00
7b4304577a
add -std=c++11 flag to compilation of all .cpp files on Linux
2020-09-22 10:58:54 -04:00
2d7b6a9008
remove dead code
2020-09-22 10:12:59 -04:00
2c17652ad6
Created another static instance for dpd/tstat in the GPU library
2020-09-18 10:28:52 -05:00
f1ef7d85a8
T2345: Replace instances of NULL with nullptr
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The following changes have been applied to src and lib folders:
regex replace: ([^"_])NULL ⇒ \1nullptr (8968 chgs in src, 1153 in lib)
Manually find/change: (void \*) nullptr ⇒ nullptr (1 case)
regex find: ".*?nullptr.*?"
Manually ~14 cases back to "NULL" in src, ~2 in lib
regex finds a few false positive where nullptr appears between two
strings in a function call
2020-09-12 09:34:38 -06:00
67a5db03c7
Merge pull request #2326 from ndtrung81/gpu-update-makefiles
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update makefiles in lib/gpu for more recent architectures
2020-08-31 12:30:28 -04:00
ecb1f266b5
More updates
2020-08-30 15:10:29 -05:00
7a5f193c02
Updated several Makefile's in lib/gpu for newer compute capabilities
2020-08-30 15:06:44 -05:00
fdb726629f
revert "fix" for pair style beck/gpu and correct beck and beck/omp instead
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we should consistently apply factor_lj for both, force and energy, or not
2020-08-27 17:14:05 -04:00
a4f1be8fe3
Merge branch 'master' into gpu-bugfix
2020-08-27 17:05:26 -04:00
e4e15157f8
Fixed bugs in the GPU kernels of pair styles beck/gpu and gauss/gpu involving factor_lj
2020-08-26 23:41:00 -05:00
0842911cd8
Rename local buffers 'red_acc' in lal_tersoff*
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Rename __local red_acc in lal_tersoff
2020-08-23 22:22:28 +03:00
7e5e741ea1
update code for ufm/gpu to match changes in base class where uf4 is removed
2020-08-03 08:12:09 -04:00
db47eeb2a9
Fix handling of CL_DEVICE_TYPE flags
2020-07-31 19:21:32 +03:00
29c50671da
Merge pull request #2254 from Vsevak/fix_opencl
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Fix corrupted character in GPU package
2020-07-27 20:08:18 -04:00
2bb5c53a47
remove/replace extended ASCII characters from comments
2020-07-27 17:15:29 -04:00
634f274a04
whitespace cleanup: replace tabs and remove trailing whitespace
2020-07-27 17:14:53 -04:00
93f14e9bba
Fix broken ASCII symbol in GPU package
2020-07-27 20:16:55 +03:00
ebfe7f68af
More cleanup
2020-07-05 00:20:28 -05:00
c488e6208d
Similar bug fixes to vashishta/gpu
2020-07-04 23:52:32 -05:00
adacc7f2a4
Similar bug fixes for tersoff/mod/gpu and tersoff/zbl/gpu; some cleanup for sw/gpu
2020-07-04 19:08:55 -05:00
9f733fb305
Removed unused variables
2020-07-04 00:23:34 -05:00
6de020805f
Fixed a bug with tersoff/gpu with building the short neighbor list
2020-07-03 23:55:26 -05:00
66271448ae
Merge pull request #2167 from Vsevak/master
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Update GPU CMake and Makefile scripts for ROCm v3.5
2020-06-26 13:43:32 -04:00
496bd55dc9
Fix lj/cut/tip4p/long/gpu virial
2020-06-25 17:30:51 +03:00
0ba701acd7
Remove trailing space
2020-06-20 17:25:16 +03:00
723b9e6760
Try to keep compatibility with deprecated ROCm hcc compiler
2020-06-20 15:17:54 +03:00
8eed1b27ff
GPU Makefile cleanup
2020-06-19 00:07:10 +03:00
f75b8e1688
Fix Makefile for GPU ROCm 3.5 backend
2020-06-18 00:33:46 +03:00
622db7053e
Merge remote-tracking branch 'origin/master'
2020-06-15 18:38:40 +03:00
f1aaad2b13
remove trailing whitespace
2020-04-27 09:54:05 -04:00
d53e468ce0
do not mix c++ style and c-style comments
2020-04-26 22:50:24 -04:00
0b6e5be379
cosmetic edit to trigger new CI test runs
2020-04-26 00:25:07 -04:00
1295a9ef46
Fixed bugs with special bonds for ellipsoid gpu pair styles
2020-04-25 10:28:18 -05:00
0608002451
Remove trailing whitespace
2020-04-10 15:10:41 -04:00
19a52dc506
Update lib/gpu/.gitignore
2020-03-30 17:36:22 -04:00
373b57cfdc
Change 'echo -e' to 'printf' for greater compatibility
2020-03-30 17:36:00 -04:00
4f6dd381c3
Merge branch 'master' into gpu_hip
2020-03-30 17:15:55 -04:00
649a8cc01a
Fix typo
2020-03-14 13:57:48 +09:00
5a3a5d86d4
reduce compiler warnings and avoid clash with KOKKOS
2020-03-05 14:27:33 -05:00
3298a86bd9
Reduce redundant copying using UCL_H_Vec::view
2020-02-20 18:32:52 +03:00
d024b3d340
Add shared memory optimization
2020-02-12 01:35:44 +03:00
33fc22b752
Fix echo in Makefile
2020-02-03 01:55:20 +03:00
9e8806bd22
Addition to lib/gpu/README for HIP
2020-01-31 21:26:52 +03:00
66c5fa2abd
Merge 'gpu_hip_port' into master
2020-01-28 20:35:08 +03:00
43a9936241
Fix tagint usage
2020-01-20 03:38:58 +03:00
