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46d5d9724a
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move interlayer potentials to their own package
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2021-07-07 15:52:53 -04:00 |
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39bd342913
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Resolved conflict
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2021-07-07 10:04:05 +01:00 |
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71f82e81d7
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Merge branch 'snap-scale' into fm
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2021-07-06 17:23:24 +02:00 |
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3675bef2b0
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doc
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2021-07-06 14:06:27 +02:00 |
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4b81802ae8
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Created new feature branch for PR as per request
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2021-07-05 16:07:40 +01:00 |
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430e7e962f
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Merge branch 'master' into dielectric-updates
# Conflicts:
# src/DIELECTRIC/Install.sh
# src/DIELECTRIC/pppm_disp_dielectric.cpp
# src/DIELECTRIC/pppm_disp_dielectric.h
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2021-07-03 15:27:57 -04:00 |
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021e8a404d
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Updated example data files
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2021-07-02 12:20:26 -05:00 |
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58196d57f1
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New package DPD-BASIC with pair styles dpd, dpd/tstat, dpd/ext, dpd/ext/tstat
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2021-07-01 00:51:55 -04:00 |
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16002ddb54
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rename some more example folders
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2021-06-29 21:48:57 -04:00 |
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9d208c9ebd
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rename some examples folders
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2021-06-29 20:25:18 -04:00 |
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878795e64a
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bulk rename of remaining USER- packages
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2021-06-29 20:12:59 -04:00 |
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1dc25b0e10
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rename USER-OMP to OPENMP
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2021-06-29 17:48:22 -04:00 |
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c085e55695
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rename USER-SMD package to MACHDYN
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2021-06-29 17:19:39 -04:00 |
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8bf6805e1d
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rename USER-LB to LATBOLTZ
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2021-06-29 17:07:14 -04:00 |
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dc3efd17d2
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rename USER-MEAMC to MEAM and pair style meam/c to meam (keeping meam/c as an alias)
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2021-06-29 16:59:05 -04:00 |
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efaec31a84
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rename USER-CGDNA and USER-CGSDK to CG-DNA and CG-SDK
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2021-06-29 15:28:27 -04:00 |
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7390d8e344
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remove bogus folder
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2021-06-29 11:31:31 -04:00 |
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4342987043
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rename example folders
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2021-06-29 11:23:47 -04:00 |
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8f60a54656
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update USER-RANN example to run faster and provide reference logs
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2021-06-22 12:27:05 -04:00 |
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ddc596170e
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Merge pull request #2803 from akohlmey/collected-small-changes
Collected small changes
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2021-06-21 12:59:16 -04:00 |
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a90a48c038
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update ASPHERE box/srd example
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2021-06-17 10:35:07 -04:00 |
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5a511c2e92
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whitespace
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2021-06-17 09:56:14 -04:00 |
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ec0f47642a
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delete old log files
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2021-06-14 11:44:05 -07:00 |
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6a4420ba5c
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updated log files from the latested run
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2021-06-14 11:40:45 -07:00 |
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84d04752d3
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update log files. make Si example (much) smaller
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2021-06-13 17:40:00 -04:00 |
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e64ec4647a
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Delete dump.myforce.3
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2021-06-09 20:45:06 -07:00 |
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06aa6b737e
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Delete dump.myforce.2
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2021-06-09 20:44:56 -07:00 |
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399de7dbf8
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Delete dump.myforce.1
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2021-06-09 20:44:45 -07:00 |
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b4e9e99067
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Delete dump.myforce.0
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2021-06-09 20:44:32 -07:00 |
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72ae091aa6
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Merge remote-tracking branch 'upstream/master' into mliap_so3_ver2
To have a fetch
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2021-06-09 20:31:46 -07:00 |
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75fd4e9eec
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update
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2021-06-09 16:59:59 -07:00 |
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13b8c63e7a
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Merge branch 'master' into user-dielectric
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2021-06-05 11:14:44 -04:00 |
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5f4bd99544
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Merge branch 'master' into track-contacts
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2021-06-04 08:42:51 -04:00 |
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80f28e7fa9
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fixing merge conflicts, update to master
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2021-06-02 12:33:37 -06:00 |
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77f009126a
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Fixing comments and log files
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2021-06-02 12:12:17 -06:00 |
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b9e9dda1ab
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Updated example input scripts, data files and README
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2021-06-02 12:03:46 -05:00 |
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49536ce02c
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Make compliance.py Python 3 compatible
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2021-06-01 15:15:11 -04:00 |
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c12f7e226b
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More cleanup to fix polarize*, access to the per-atom variables from the Atom class, and updates to doc pages
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2021-06-01 11:22:14 -05:00 |
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30e18a1b76
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Added compute efield/atom and citation for the fixes polarize*
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2021-05-28 16:06:36 -05:00 |
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012003c68a
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Merge branch 'master' into pair_rann
# Conflicts:
# cmake/CMakeLists.txt
# cmake/presets/all_off.cmake
# cmake/presets/all_on.cmake
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2021-05-26 15:17:30 -04:00 |
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9e1db61b41
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Merge branch 'master' into pair-style-nnp
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2021-05-25 16:44:55 -04:00 |
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2e6a0112d3
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update URLs in some more files
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2021-05-24 16:19:37 -04:00 |
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2a33e3674e
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Added src/USER-DIELECTRIC and examples/USER/dielectric
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2021-05-24 14:51:28 -05:00 |
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63ecb77303
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fix some more URLs
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2021-05-24 15:38:27 -04:00 |
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61b1126c3d
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Merge branch 'master' into pair_rann
# Conflicts:
# cmake/CMakeLists.txt
# src/Makefile
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2021-05-24 12:21:04 -04:00 |
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10961b8cb6
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update to upstream
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2021-05-21 16:15:31 -04:00 |
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0c6857914d
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Adding example, misc patches
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2021-05-18 20:57:24 -06:00 |
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fb3fdb43a1
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Tweak ASPHERE examples
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2021-05-17 10:27:57 -06:00 |
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640a46ec3f
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Fix broken examples
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2021-05-17 08:29:54 -06:00 |
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31a55f1f76
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Merge branch 'master' of github.com:lammps/lammps into pair-style-nnp
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2021-05-16 22:54:29 +02:00 |
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