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0a27b7065b
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bug fixes: ScaFaCoS returns virial as 9-value array, requires copies to Lammps 6-value array; fixed error in compuation of per-atom energy calculation
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2018-08-06 16:01:39 -06:00 |
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953b283773
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updated URL for tarball download
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2018-08-06 15:59:46 -06:00 |
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b97195d48f
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CMake: download ScaFaCoS, compile and link it - required resorting, as Fortran MPI is required
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2018-08-06 15:58:53 -06:00 |
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4d75d2d611
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more changes to ATM source and doc file
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2018-08-06 20:49:05 +01:00 |
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32917f4caa
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Workaround for issue 1037
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2018-08-06 10:50:06 -06:00 |
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c1dffe40dc
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Merge branch 'master' of https://www.github.com/lammps/lammps into port-enforce2d-kokkos
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2018-08-06 10:25:22 -04:00 |
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446a8da8e7
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Commit before merge.
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2018-08-06 10:25:12 -04:00 |
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e88311235f
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Merge pull request #1033 from lammps/doc-reorg-commands
replace Section_commands.txt file
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2018-08-06 08:20:59 -06:00 |
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78bddacd88
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Merge pull request #1032 from lammps/slope
bug-fix for slope() function in variable
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2018-08-06 08:20:32 -06:00 |
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fba9f0aaae
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Fix various links
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2018-08-06 00:10:06 -04:00 |
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6927ed5eb9
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Fix pair body rounded polygon and polyhedron links
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2018-08-06 00:01:38 -04:00 |
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6de3dab72a
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Remove duplicates
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2018-08-05 23:59:52 -04:00 |
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82744773b3
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replace Section_commands.txt file
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2018-08-03 16:04:54 -06:00 |
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31c3c6c93e
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Merge pull request #1031 from akohlmey/cmake-cross-linux-mingw
Allow cross-compiling from linux to windows with cmake
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2018-08-03 14:55:03 -06:00 |
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382e3b08ac
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Merge pull request #1028 from lammps/doc-reorg-intro-howto
changes for Intro and Howto doc pages
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2018-08-03 14:54:34 -06:00 |
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94bf221258
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implemented checks for unsupported solvers
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2018-08-03 11:31:50 -06:00 |
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e8774dce97
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removed thread restriction on make command, should make the building process faster
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2018-08-03 11:31:11 -06:00 |
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5789ef9128
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bug-fix for slope() function in variable
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2018-08-03 10:08:02 -06:00 |
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463e34cef5
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Merge remote-tracking branch 'origin/master' into HEAD
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2018-08-03 08:13:12 -06:00 |
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cdd85b0749
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Merge branch 'reax_dup' of ssh://github.com/stanmoore1/lammps into reax_dup
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2018-08-03 07:37:49 -06:00 |
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3e962c9729
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Update from master
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2018-08-03 07:37:18 -06:00 |
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2321c8ff37
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Merge remote-tracking branch 'origin/master' into doc-reorg-intro-howto
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2018-08-03 00:12:58 -04:00 |
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9cc75792d6
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Update lammps.book
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2018-08-02 23:29:29 -04:00 |
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b2d1332d46
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change proc count to color for MPI_Comm_split
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2018-08-02 14:47:20 -06:00 |
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f330013584
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lost SPIN in package list
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2018-08-02 14:26:02 -06:00 |
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39f61a78f2
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couple more doc page tweaks
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2018-08-02 14:09:00 -06:00 |
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c105e21a73
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more mods to Intro section
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2018-08-02 13:58:25 -06:00 |
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efaebe0eb0
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READMEs for USER-SCAFACOS completed
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2018-08-02 13:44:12 -06:00 |
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1b0a8fdc9b
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Merge pull request #942 from tootea/nhfixes
Fix discrepancies between fix_nh and papers
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2018-08-02 11:16:54 -06:00 |
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fb03924e83
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patch 2Aug18
patch_2Aug2018
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2018-08-02 11:12:57 -06:00 |
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4faeda28ee
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allow cross-compiling from linux to windows with cmake
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2018-08-02 06:38:25 -04:00 |
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5412204ff7
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Merge branch 'master' into granular-kokkos
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2018-08-02 10:11:50 +02:00 |
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ad88ecd3ef
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Merge pull request #1030 from akohlmey/collected-small-fixes
Collected small fixes for the next patch release
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2018-08-01 10:54:31 -06:00 |
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d598e7c60e
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rename preprocessor guard to prevent multiple inclusion to be consistent with file name
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2018-08-01 15:54:46 +02:00 |
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42948b60ee
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corrections for broken links in the html docs
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2018-08-01 14:37:03 +02:00 |
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d877a12e0c
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Merge branch 'fix_xrd_histo' of https://github.com/king-michael/lammps into collected-small-fixes
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2018-08-01 13:57:56 +02:00 |
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c8be5a3f2d
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change ave/histo to ave/histo/weight
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2018-08-01 11:11:18 +02:00 |
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90897f570e
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changes for Intro and Howto doc pages
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2018-07-31 15:27:09 -06:00 |
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a8f0200fe9
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Install.py works on dummy tar-ball
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2018-07-31 13:33:10 -06:00 |
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ac0ab4ba34
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changed CMake file to require pkg_config for ScaFaCoS and removed Fortran/C dependencies
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2018-07-31 13:31:50 -06:00 |
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77e5445bfe
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Need to purge old pair_cdeam.* files
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2018-07-31 14:16:54 -04:00 |
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eb967a8a6c
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Merge pull request #1027 from akohlmey/move-cdeam
Move pair style eam/cd from USER-MISC to MANYBODY
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2018-07-31 10:39:18 -06:00 |
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2b7b61d5b7
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Merge pull request #1023 from amritagos/patch-1
docs: Fix spelling mistakes and clarify Tools.txt
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2018-07-31 10:38:47 -06:00 |
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ff351bd5f7
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Merge pull request #1022 from HaoZeke/updateEmacs
emacs: Update mode file
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2018-07-31 10:38:26 -06:00 |
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ae04fd0bea
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fixed error: if no particles are on a process, the arrays for efield and epot were not allocated, leading to segfaults; shifted the parameter output to after the tuning step, so if the values are changed, the changed values are displayed
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2018-07-31 09:48:59 -06:00 |
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c6186bf00d
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whitespace and formatting update
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2018-07-31 17:36:49 +02:00 |
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e9d40d3c6d
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rename class from PairCDEAM to PairEAMCD
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2018-07-31 17:16:18 +02:00 |
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8c0955aaff
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Merge pull request #1025 from lammps/doc-reorg-speed-packages
changes to Packages and Speed doc files
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2018-07-31 08:58:49 -06:00 |
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67e70316de
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rename pair_cdeam.* to pair_eam_cd.*
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2018-07-31 16:58:44 +02:00 |
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bbaf522430
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Merge pull request #1024 from akohlmey/cmake-dependencies-fixups
Resolve object dependency problems for CMake build system
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2018-07-31 08:50:33 -06:00 |
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