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4c870be433
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Merge pull request #1957 from david-castillo/restrain_lbound
add moving bond restraints and a lower bound only bond restraint
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2020-04-15 14:45:07 -04:00 |
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01f97f1936
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Merge branch 'master' into restrain_lbound
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2020-04-15 14:24:47 -04:00 |
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e7cce60777
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Merge pull request #1889 from lammps/change-box-error-check
delay change_box error check with existing per-atom restart data
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2020-04-15 12:29:32 -04:00 |
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08d01e6417
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import polymorphic pair style update from Xiaowang Zhou
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2020-04-15 11:31:30 -04:00 |
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0796a7032e
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same doc change for "lbond" option
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2020-04-15 11:22:48 -04:00 |
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e94576ecd8
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update documentation as requested
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2020-04-15 11:21:25 -04:00 |
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80311891f1
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Merge pull request #1874 from akohlmey/generalize-box-change-detect
Refactor handling of box change information from fixes
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2020-04-15 11:14:45 -04:00 |
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f5733ccd75
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Merge pull request #1978 from evoyiatzis/class2_cs
core-shell version of pair_style lj/class2/coul/long
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2020-04-14 22:59:46 -04:00 |
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c50e49fce4
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Merge pull request #1967 from julient31/neel-rework
Correct issue #1959 and correct issues in SPIN package
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2020-04-14 21:32:37 -04:00 |
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7d71d5bfb3
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Merge pull request #1981 from akohlmey/simplify_build_choices
Simplify choices for building LAMMPS and add some howtos for CMake and getting stack traces
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2020-04-14 10:57:54 -04:00 |
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41cfb3ae80
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Merge branch 'master' into neel-rework
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2020-04-14 05:57:08 -04:00 |
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b8b1e60b37
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describe various abstract build targets for CMake
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2020-04-14 01:13:46 -04:00 |
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3c2b23e821
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small tweaks and grammar corrections
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2020-04-14 01:13:22 -04:00 |
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4f8d4a10d9
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small tweaks and grammar/style improvements
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2020-04-14 00:00:21 -04:00 |
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a5059092b3
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fix permissions
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2020-04-13 22:26:20 -04:00 |
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8962da19ca
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complete cmake howto
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2020-04-13 19:39:00 -04:00 |
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6e4d5fd020
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address spelling and other minor issues
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2020-04-13 14:34:39 -04:00 |
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e9fdc5e84b
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rework the debug info section to be more readable and make the options more visible
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2020-04-13 14:34:23 -04:00 |
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74143a3d89
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Merge branch 'master' into simplify_build_choices
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2020-04-13 11:02:35 -04:00 |
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4abff7b4d3
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Merge pull request #1986 from akohlmey/correct-kokkos-docs
Update docs and CMake scripts for Kokkos 3.0+
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2020-04-13 11:01:26 -04:00 |
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03634b12df
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add missing pair style. Coulombic/Coulombics -> Coulomb for consistency
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2020-04-13 10:38:09 -04:00 |
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29f9ca4b54
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use list-table and figure to have side-by-side images
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2020-04-13 10:30:01 -04:00 |
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fbce1a8549
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write initial part of CMake tutorial
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2020-04-12 21:39:19 -04:00 |
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ebf6e23a67
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explain error message when using a non-c++11 compliant compiler.
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2020-04-12 16:32:40 -04:00 |
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3201213bec
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remove tabs
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2020-04-12 16:32:16 -04:00 |
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5bb2449ddb
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provide info about including debug support in executable and a stack trace debug tutorial
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2020-04-12 15:34:00 -04:00 |
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5584bd1106
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Update traditional make info and synchronize information provided with CMake version
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2020-04-12 11:41:25 -04:00 |
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8b1c6cb279
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Merge branch 'omp4-compat' into correct-kokkos-docs
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2020-04-12 01:44:47 -04:00 |
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9cf6c72a9c
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fix spell-checker issues
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2020-04-12 00:36:39 -04:00 |
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7b3b77226e
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update build overview
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2020-04-11 22:20:35 -04:00 |
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5542ad31dc
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Merge branch 'master' into simplify_build_choices
# Conflicts:
# cmake/Modules/Packages/GPU.cmake
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2020-04-11 21:31:07 -04:00 |
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d6624fe444
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Merge pull request #1863 from Vsevak/gpu_hip
HIP back end to GPU package to support AMD GPUs via the ROCm toolkit
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2020-04-11 21:14:45 -04:00 |
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2edc6939a8
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update and correct docs for OpenMP 3.x vs OpenMP 4.x and how to work around it.
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2020-04-11 18:51:10 -04:00 |
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832cb57d91
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Merge branch 'master' into fixadapt
# Conflicts:
# doc/src/fix_adapt.rst
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2020-04-11 16:24:13 -04:00 |
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15314e3c95
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Merge branch 'patch-1' of github.com:LunarLanding/lammps into correct-kokkos-docs
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2020-04-11 15:41:14 -04:00 |
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8407a77893
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add text segments removed from other pages.
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2020-04-11 12:43:50 -04:00 |
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d50013ed16
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complete rewrite of the CMake build overview page
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2020-04-11 12:43:31 -04:00 |
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15c89c388b
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add link target
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2020-04-11 12:43:00 -04:00 |
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60910e64f1
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Fix typo in latex formula (cosine was not squared)
What the title says; I am assuming it is squared in the implementation.
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2020-04-11 17:17:48 +01:00 |
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e9af15ebb4
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start rewrite of the cmake with LAMMPS documentation
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2020-04-11 11:55:45 -04:00 |
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c0d3ecfff0
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start more detailed CMake howto document
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2020-04-11 11:55:13 -04:00 |
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7978d20352
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tweaks
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2020-04-11 02:02:15 -04:00 |
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806fd8cf11
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rework KOKKOS package compilation docs for Kokkos 3.0+ and recent changes in CMake support
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2020-04-10 23:32:31 -04:00 |
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f01c90b6b0
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use consistent capitalization with NVIDIA
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2020-04-10 23:20:10 -04:00 |
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d2c4ade697
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Add HIP_USE_DEVICE_SORT CMake option
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2020-04-10 18:22:43 -04:00 |
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1a1db599f6
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Fix typo
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2020-04-10 15:03:48 -04:00 |
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024a91c751
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Add documentation on how to compile GPU package with HIP using CMake
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2020-04-10 14:50:10 -04:00 |
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c83dfd2b22
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update list of supported Kokkos_ARCH suffixes. convert to table.
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2020-04-09 22:52:25 -04:00 |
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7c8be1a411
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update instructions in Python doc section
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2020-04-09 21:47:47 -04:00 |
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284c67a0f6
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partial update of the new kokkos docs
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2020-04-09 21:20:17 -04:00 |
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