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fa73fab5df
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patch 16Jul18
patch_16Jul2018
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2018-07-16 18:12:15 -06:00 |
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a3b6f38a42
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Merge pull request #1003 from akohlmey/restart_extra_flags
include support for 'extra/XXX/per/atom' info in restart files
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2018-07-16 15:07:43 -06:00 |
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783839e985
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add support for restarting extra/XXX/per/atom settings in binary restarts
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2018-07-16 15:21:52 -04:00 |
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c589029219
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Merge pull request #1002 from rbberger/set_velocity_command
Allow 'set' command to change atom velocities
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2018-07-16 08:50:15 -06:00 |
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140767be16
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Merge pull request #1001 from stanmoore1/kk_bugfix
Fix rare crash in Kokkos ReaxFF on GPUs
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2018-07-16 08:49:30 -06:00 |
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1c007ce7a1
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Merge pull request #1000 from HaoZeke/fixDocs
docs: Fix sneaky unicode character
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2018-07-16 08:49:13 -06:00 |
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6f1b6e7abd
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Merge pull request #999 from junghans/cmake_doc
cmake/README.md: fix GPU_ARCH options
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2018-07-16 08:48:48 -06:00 |
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5fc4aaef06
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Merge pull request #940 from Pakketeretet2/port-enforce2d-kokkos
Port enforce2d kokkos
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2018-07-16 08:48:21 -06:00 |
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aa3d3213c9
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Update set command documentation
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2018-07-13 23:06:42 -04:00 |
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d00eaef070
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Allow 'set' command to change atom velocities
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2018-07-13 23:05:44 -04:00 |
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d4f8940ff2
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Update command doc page for Kokkos enforce2d
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2018-07-13 07:40:06 -06:00 |
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16381a52b1
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Fix crash in ReaxFF on GPUs
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2018-07-12 20:22:38 -06:00 |
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85511a4db8
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docs: Fix sneaky unicode character
Fixes the `pdf` target of the `Makefile`.
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2018-07-13 00:44:04 +05:30 |
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4ac47ba037
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cmake/README.md: fix GPU_ARCH options
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2018-07-12 07:27:11 -06:00 |
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6dfb74f23e
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Merge pull request #997 from lammps/balance-bug-fix
2 small bug fixes to load balancing
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2018-07-11 16:13:22 -06:00 |
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b31f0245d0
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2 small bug fixes to load balancing
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2018-07-11 15:55:16 -06:00 |
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f288331874
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Merge pull request #993 from lammps/doc-plus-makefile
better rRESPA doc page, also a new Makefile.theta
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2018-07-11 12:53:31 -06:00 |
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71f6991233
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Small tweaks to fix_enforce2d_kokkos
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2018-07-11 12:39:04 -06:00 |
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5d13321425
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Standardize suffix paragraph in fix_enforce2d.txt
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2018-07-11 12:15:50 -06:00 |
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acdc240cdd
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better rRESPA doc page, also a new Makefile.theta
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2018-07-11 08:42:28 -06:00 |
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69baaaec16
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Merge pull request #991 from akohlmey/collected-small-updates
Collected small updates for the next patch release
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2018-07-11 07:50:31 -06:00 |
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1f1447c3ac
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need to update exclusions with the new atom IDs in case of molecular systems
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2018-07-11 07:22:47 -04:00 |
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1ed25d195b
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convert c-style includes for c-library calls to c++-style
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2018-07-10 09:48:49 -04:00 |
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792b182cb0
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whitespace cleanup
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2018-07-10 09:46:08 -04:00 |
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ade9b7bfc3
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Commit2 JT 070918
- modified the citeme reference (replaced by the JCP one)
- same modification in doc and src/SPIN
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2018-07-10 09:44:14 -04:00 |
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9d5dc561ca
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Commit1 JT 070918
- created README in examples/SPIN
- modified doc/src/set.txt to define 'spin' and 'spin/random' keywords
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2018-07-10 09:44:14 -04:00 |
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199c96f985
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update and clarify the choice of atom ids for angle style dipole (which is not really an angle potential)
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2018-07-10 09:22:41 -04:00 |
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ad4f61a5ce
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update fatbin makefile for libgpu.a to latest additions
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2018-07-10 09:07:54 -04:00 |
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0c1dcfb617
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Favor copymode instead of cleanup_copy
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2018-07-06 17:06:37 -06:00 |
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db75232957
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Removed debug print and comment.
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2018-07-06 11:31:48 -04:00 |
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24405217d0
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Updated Install.sh in KOKKOS.
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2018-07-05 11:20:27 -04:00 |
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a52ddf8759
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patch 29Jun18
patch_29Jun2018
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2018-06-30 08:03:24 -06:00 |
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0f71ed1fec
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Merge pull request #983 from akohlmey/python-module-typo
fix typo in python module
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2018-06-29 17:23:45 -06:00 |
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43ffee980d
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fix typo in python module
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2018-06-29 19:07:14 -04:00 |
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560b34aad0
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Merge pull request #982 from lammps/doc-tweak-again
couple more doc tweaks - sigh
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2018-06-29 16:35:46 -06:00 |
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ea35235ca0
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couple more doc tweaks - sigh
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2018-06-29 16:12:25 -06:00 |
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474b59a1f3
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Merge pull request #981 from lammps/latte-tweak
fix glitch in ABIVERSION in fix latte
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2018-06-29 16:03:45 -06:00 |
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c63d77d0b8
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Merge pull request #980 from lammps/spin-doc
added SPIN package to Section_packages doc
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2018-06-29 15:26:36 -06:00 |
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bf9646cbbe
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fix glitch in ABIVERSION in fix latte
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2018-06-29 15:08:19 -06:00 |
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d2dd76e655
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added SPIN package to Section_packages doc
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2018-06-29 14:56:27 -06:00 |
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d649a6fe38
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Merge pull request #979 from rbberger/small-python-fix
Fixes issue #975
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2018-06-29 14:55:25 -06:00 |
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a8b7153f4e
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Fixes issue #975
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2018-06-29 16:03:38 -04:00 |
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c3fe26a614
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Merge pull request #977 from akohlmey/collected-small-changes
Collected small changes for the next patch release
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2018-06-29 13:57:14 -06:00 |
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bbe77e4c31
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Merge branch 'collected-small-changes' of github.com:akohlmey/lammps into collected-small-changes
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2018-06-29 15:33:23 -04:00 |
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b819018084
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Revert change to CMakeLists.txt which only works with 3.9+
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2018-06-29 15:31:15 -04:00 |
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6900f9edf9
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Merge branch 'master' into collected-small-changes
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2018-06-29 14:59:02 -04:00 |
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11a8d4e1c3
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Merge pull request #978 from lammps/new-makefiles
new ARM makefiles, also some doc tweaks
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2018-06-29 12:53:58 -06:00 |
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d9396df5b9
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Merge pull request #976 from akohlmey/collected-cmake-changes
Collected cmake changes
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2018-06-29 12:53:18 -06:00 |
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0e047f2786
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Merge branch 'collected-small-changes' of github.com:akohlmey/lammps into collected-small-changes
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2018-06-29 12:05:28 -04:00 |
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e08ccd0a7c
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Forgot to include change in fix_enforce2d to access fixlist in kokkos port.
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2018-06-29 11:58:27 -04:00 |
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