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49e6c2eb7d
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remove references to Make.py from the manual and instead refer to section 4
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2017-07-18 13:14:03 -04:00 |
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1b34bec81a
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Prefer DeviceType specification over RangePolicy
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2017-07-18 10:59:34 -06:00 |
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a92d792537
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update manual links that got broken when removing and renumbering a section
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2017-07-18 12:55:55 -04:00 |
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9df61b642e
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Removing stray file
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2017-07-18 10:44:45 -06:00 |
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3c88b2a980
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Fixing execution space issues in KOKKOS package
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2017-07-18 09:53:26 -06:00 |
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085cbee116
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protect LAMMPS from calling incompatible QUIP library with -DLAMMPS_BIGBIG
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2017-07-18 11:17:25 -04:00 |
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4ad9528999
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safer handling of memory management for lists in reax/c
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2017-07-18 07:37:14 -04:00 |
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358915d16e
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avoid division by zero in peri pair styles
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2017-07-18 07:26:45 -04:00 |
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d9186c8fde
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Revert "use neighbor list exclusions instead of a zero cutoff"
This reverts commit bbb4d63db9.
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2017-07-18 01:17:34 -04:00 |
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bc5186bc30
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fix unitialized pointer issue in USER-OMP with pppm/disp
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2017-07-18 00:44:24 -04:00 |
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c083d5d6f3
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fix memory leak in list of neighbor list requests
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2017-07-18 00:18:03 -04:00 |
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c3a2ed0d1b
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plug small memory leak in USER-OMP variants of pppm kspace styles
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2017-07-17 23:56:38 -04:00 |
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23033404b0
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skip table consistency check for bitmapped tables
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2017-07-17 18:18:21 -04:00 |
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3c3baf34c4
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GPU: added cuda includedir
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2017-07-17 15:04:07 -06:00 |
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8bc3184611
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added support for LAMMPS_FFMPEG
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2017-07-17 14:01:05 -06:00 |
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050a82af58
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fix LAMMPS_LONGLONG_TO_LONG description
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2017-07-17 13:28:34 -06:00 |
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99f5f82b02
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added support for LAMMPS_MEMALIGN and LAMMPS_LONGLONG_TO_LONG
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2017-07-17 13:26:46 -06:00 |
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a3885b78ad
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added support -DLAMMPS_XDR and -DPACK_*
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2017-07-17 13:21:42 -06:00 |
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08c920029f
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added lammps size option
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2017-07-17 12:22:28 -06:00 |
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2411192ab4
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cmake: add cross-configure warning
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2017-07-17 11:52:06 -06:00 |
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5ee2c31038
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split PACKAGES, get ENABLE-ALL right
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2017-07-17 11:01:08 -06:00 |
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bda0730169
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Modified the quip/lammps interface to pass lammps atom ids
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2017-07-17 16:55:05 +01:00 |
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1c1a1db366
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Fix typo
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2017-07-17 11:55:05 -04:00 |
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80e4448614
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added GPU
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2017-07-16 23:03:11 -06:00 |
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385c6f7f2b
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cmake: clean up
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2017-07-16 22:53:53 -06:00 |
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fc1be074b2
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added USER-INTEL
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2017-07-16 22:52:59 -06:00 |
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7605f72c9a
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finish USER-QMMM
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2017-07-16 22:37:51 -06:00 |
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22ecd9b8d2
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started on USER-QMMM
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2017-07-16 22:07:21 -06:00 |
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7dd5068740
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allow internal lapack
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2017-07-16 21:43:29 -06:00 |
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fa0f8a9e2a
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added USER-QUIP
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2017-07-16 21:31:57 -06:00 |
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d6f05ea309
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USER_OMP -> USER-OMP
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2017-07-16 20:19:20 -06:00 |
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b6385d6ce2
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add OpenKIM support
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2017-07-16 20:17:41 -06:00 |
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2978cce8db
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Added OPT
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2017-07-16 20:52:38 -04:00 |
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9991f679ae
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added USER-VTK
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2017-07-16 20:41:42 -04:00 |
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fc2e8b3c5e
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more USER packages
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2017-07-16 17:52:43 -06:00 |
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bb87bd4ac7
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enable more user packages
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2017-07-16 17:01:28 -06:00 |
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d50b62837b
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add USER-AWPMD
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2017-07-16 16:45:28 -06:00 |
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c64424754d
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added USER-ATC
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2017-07-16 16:18:58 -06:00 |
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992ce79701
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add sanity checks to EAM potential file reader subroutine
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2017-07-16 14:37:30 -04:00 |
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c549a16a85
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enable REPLICA RIGID SHOCK SNAP SRD VORONOI
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2017-07-16 11:30:09 -06:00 |
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140182fb0b
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added support for QEQ
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2017-07-16 11:14:08 -06:00 |
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742eee1966
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added support for POEMS
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2017-07-16 11:07:36 -06:00 |
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4812d4c659
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enable PERI
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2017-07-16 10:48:29 -06:00 |
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95d9d32307
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add support for MSCG
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2017-07-16 10:37:24 -06:00 |
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f50a757dc6
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added MPIIO support
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2017-07-16 08:32:14 -06:00 |
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01f5136584
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cmake: clean up
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2017-07-16 08:22:19 -06:00 |
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fa1f38596c
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Add support for PYTHON in CMake build
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2017-07-15 18:29:33 -05:00 |
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23540cfc94
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enable MISC
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2017-07-15 16:54:27 -06:00 |
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fdb5ccefc7
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Merge branch 'cmake' of github.com:junghans/lammps into cmake
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2017-07-15 17:47:53 -05:00 |
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629f112915
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add support for MEAM
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2017-07-15 16:44:03 -06:00 |
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