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a83b45c0fb
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use simpler std::string concatenation instead of implicit fmt::format() processing
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2025-01-31 17:49:59 -05:00 |
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dc7f28c4c0
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Merge branch 'develop' into add-error-explanations
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2025-01-13 01:27:34 -05:00 |
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2df402c4ff
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Merge branch 'develop' into cmake-cpp-std-deprecation
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2025-01-12 21:47:02 -05:00 |
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a17213fc62
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add link and description paragraph for the "Out of range atoms" error
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2025-01-09 12:29:54 -05:00 |
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916e5a81fb
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more fix::init() checks and some clang-formatting for NH style classes
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2024-12-27 08:44:02 -05:00 |
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0ae0afbae9
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Merge branch 'develop' into cmake-cpp-std-deprecation
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2024-10-12 20:11:28 -04:00 |
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482a6632e9
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consolidate kspace communication enumerators in kspace.h
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2024-10-10 05:35:01 -04:00 |
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906ae818da
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add package removal warnings and GNU make deprecation warnings
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2024-09-18 15:43:56 -04:00 |
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66d6804d23
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apply clang-format to some pair style headers
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2024-08-22 15:43:55 -04:00 |
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45508baee5
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major refactor for restart, data file handling. removal of dead code.
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2024-06-19 11:09:56 -04:00 |
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4be1b41aef
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class n func rename
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2024-06-17 10:03:06 +02:00 |
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575853b27a
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correct headers' author
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2024-06-13 17:11:54 +02:00 |
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1b040d7108
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white space fix
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2024-06-13 13:49:18 +02:00 |
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99263ed7d7
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init_atomic with new pair name
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2024-06-12 15:41:38 +02:00 |
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2470d621c8
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wrong header name...
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2024-06-12 15:31:28 +02:00 |
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84ed769ca3
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changing the fix name and file names for coherence
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2024-06-12 15:12:55 +02:00 |
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e0c2009525
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update conditions, comments, better eflag handle
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2024-06-10 11:33:58 +02:00 |
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5c9ac8e569
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Update pair_dpd_charged_gpu.cpp
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2024-06-06 11:14:28 +02:00 |
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71d8fe564f
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wrong init var and still force...
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2024-06-06 10:55:26 +02:00 |
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2da4f23743
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debug
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2024-06-06 10:23:32 +02:00 |
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eb7f947a0c
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cuda forces + init var
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2024-06-05 17:49:27 +02:00 |
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9ea57acf54
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pack4 cutoffs
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2024-06-05 11:40:24 +02:00 |
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b187001f38
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atom charge and dpd/slater cutoff passing
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2024-06-04 19:13:56 +02:00 |
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9b14a880dc
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charge pointer and corrections
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2024-05-31 17:07:22 +02:00 |
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fcdcf65995
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creation + working CPU
new pair style dpd/charged which is the combination of dpd and coul/slater/long
Working on CPU, GPU in progress
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2024-05-31 15:12:37 +02:00 |
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6a28e8d5f6
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Fixed bugs with sph gpu pair styles
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2024-03-18 13:27:21 -05:00 |
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d38b3ffd82
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remove dead code
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2024-02-20 05:14:58 -05:00 |
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a48da5b1e4
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move ewald_const.h to src and apply it to a few more files
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2024-02-13 08:02:32 -05:00 |
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eb9412f507
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even more constant cleanup
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2024-02-06 00:57:46 -05:00 |
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2760480630
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more constant cleanups
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2024-02-06 00:28:58 -05:00 |
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ad855ad7ea
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remove unused constants
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2024-02-05 20:26:23 -05:00 |
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4082ca077e
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Merge branch 'develop' into consolidate-sphere-omega-flag
# Conflicts:
# src/compute_temp_sphere.cpp
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2024-01-25 17:57:53 -05:00 |
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6442e05988
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even more define to static constexpr conversions
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2024-01-25 02:17:28 -05:00 |
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a6261d75b9
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some more define to static constexpr conversions
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2024-01-24 21:14:19 -05:00 |
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1f863cd4a3
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simplify since constexpr should conver to FFT_SCALAR at compile time
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2024-01-21 15:59:09 -05:00 |
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12422ff510
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replace defines with static constexpr declarations
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2024-01-21 15:53:35 -05:00 |
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0d8f549e33
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remove sphere_flag and replace with radius_flag and omega_flag as needed
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2024-01-19 12:50:31 -05:00 |
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48e83b2298
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remove unused parameter and silence compiler warnings
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2024-01-18 22:55:02 -05:00 |
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768163865e
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avoid 32-bit integer overflow for PPPM grid
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2024-01-10 19:54:29 -05:00 |
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569c23a1e6
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Fixed typo with the kernel names in lj/cut/coul/cut/soft
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2023-12-12 22:54:50 -06:00 |
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8f7d7f9178
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Fixed typo in the pair style lj/cut/coul/cut/soft/gpu header
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2023-12-12 20:15:05 -06:00 |
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7881eeaa1c
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silence warnings about unused variables
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2023-12-11 23:15:13 -05:00 |
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15f8488fc4
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update developer contact email
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2023-12-11 13:43:13 -05:00 |
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267e360bac
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Fixed bugs with acquiring depsh from lib/gpu, updated the doc page
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2023-12-09 15:39:54 -06:00 |
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3830711dec
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Added the GPU version of sph/heatconduction
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2023-12-09 15:15:13 -06:00 |
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46a670889d
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Added BaseSPH for sph pair styles, fixed bugs with per-type arrays
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2023-12-08 14:09:39 -06:00 |
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0f78afc66f
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Added atom tag for dpd to work with tag and v
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2023-12-08 00:20:53 -06:00 |
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7fad795141
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Added pair sph/taitwater/gpu in src/GPU
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2023-12-08 00:10:01 -06:00 |
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cad4c25750
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Adding sph/taitwater in lib/gpu
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2023-12-07 17:22:45 -06:00 |
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6fe16c7606
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Added pair style sph/lj/gpu in src/GPU, removed commented codes
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2023-12-07 14:33:47 -06:00 |
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