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58bf89fda3
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Changing erroneous BIO_PAIR in kernels to BLOCK_PAIR. Default threads per atom is now 1 for all but charged pair styles.
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2011-04-15 20:57:03 -04:00 |
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5ff6092ea1
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Updating all preprocessor defines to be set by a kernel. Adding a threads
per atom option to fix gpu.
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2011-04-13 13:57:56 -04:00 |
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2759b11312
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Adding fixes for OpenCL support and correct constant casting to pppm
kernels.
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2011-04-04 14:27:33 -04:00 |
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a955c52830
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Consolidated block size defines into device header.
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2011-04-04 13:41:31 -04:00 |
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f08932d407
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Switch pencil size in PPPM to arch dependent. Commiting for testing on
yona.
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2011-04-04 12:22:24 -04:00 |
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86f7f6cd42
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Adding better error output to LAMMPS routines.
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2011-04-03 11:51:26 -04:00 |
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a3eca0b125
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Adding stuff to support async charge spread for PPPM.
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2011-03-29 13:23:12 -04:00 |
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71ff7b8096
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Updating all code to use full neighbor lists for all host forces
computations. Changed the load balancing scheme. Added timing estimates
for GPU and driver overhead, cpu idle time.
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2011-03-28 13:18:39 -04:00 |
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8f218cc11d
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Another update for yona testing.
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2011-03-27 19:50:44 -04:00 |
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092ee2eea8
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Temporary commit for testing on yona.
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2011-03-27 12:31:18 -04:00 |
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f0263bf14c
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pppm/gpu now using all gpu kernels.
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2011-03-25 11:49:09 -04:00 |
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e32f0861da
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Fixing pppm/gpu to work with gpu pair styles.
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2011-03-24 19:10:12 -04:00 |
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a56bc868aa
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Fixing bug in GPU selection.
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2011-03-15 16:00:05 -04:00 |
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1fb6410921
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Adding PPPM interp kernel calls and tests.
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2011-03-14 21:39:41 -04:00 |
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a3d6cff836
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CODE USED TO BENCHMARK CHARGE SPREADING FOR PAPER.
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2011-02-21 11:35:26 -05:00 |
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e8da16ff23
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Finishing laptop optimization of PPPM charge spread kernels.
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2011-02-17 13:37:02 -05:00 |
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3e25ee5338
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Adding kernel for rho map; not currently working.
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2011-02-07 20:15:06 -05:00 |
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3e4a467b20
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Adding working GPU particle map for PPPM. Reverting changes to
force.h/cpp.
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2011-02-02 14:12:22 -05:00 |
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343485d592
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Adding pppm stuff and incorporating data transfer.
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2011-01-31 15:06:22 -05:00 |
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c1c9fd47de
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Hybrid working, but not fully tested.
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2011-01-27 17:52:08 -05:00 |
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b9c7e2bb96
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Trying to get hybrid gpu styles to work...
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2011-01-25 17:46:00 -05:00 |
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6018dd02b1
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Untested changes to support hybrid styles.
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2011-01-24 15:58:04 -05:00 |
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3324437866
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Started updating to support multiple GPU styles. Incomplete - non-compilable.
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2011-01-23 20:03:42 -05:00 |
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0232e672eb
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Revert "Removing msm, openmp, and k-space stuff for LAMMPS patch."
This reverts commit fd33d29442.
Conflicts:
src/GPU/Install.sh
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2011-01-21 11:13:30 -05:00 |
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fd33d29442
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Removing msm, openmp, and k-space stuff for LAMMPS patch.
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2011-01-11 12:56:45 -05:00 |
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c1e53cf140
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Final working charmm commit.
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2010-12-30 19:52:32 -05:00 |
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b58bd96444
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Now using LAMMPS communicators.
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2010-12-15 18:42:49 -05:00 |
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aca0eefff1
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More efficient memory usage when particle split>0 and < 1.
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2010-12-15 16:49:37 -05:00 |
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af4911b377
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Adding MSM version of CMM coul/long/gpu style to library.
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2010-12-12 18:17:11 -05:00 |
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4366bfffd3
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Getting rid of extra CR characters at ends of lines.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5285 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-11-23 19:52:03 +00:00 |
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5a82c99485
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Changes from Mike Brown.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5277 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2010-11-23 00:40:35 +00:00 |
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