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52bec0f380
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patch 10Aug17
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2017-08-10 16:44:09 -06:00 |
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f9a515efd3
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add some remarks about makefile settings on windows
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2017-08-10 07:24:24 -04:00 |
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5b55744209
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fix a header line formatting issue
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2017-08-10 07:21:39 -04:00 |
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f01103dd08
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correctly use the term CUDA (instead of Cuda) when not referring to the KOKKOS device flag (which is Cuda)
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2017-08-09 19:08:23 -04:00 |
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81f4d7ecb5
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rework section 4 (Packages) in the manual to match Install.py scripts
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2017-08-09 19:07:20 -04:00 |
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0a54c34e34
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Merge pull request #600 from akohlmey/install-and-docs-reviewed
Installation scripts and docs reviewed for release
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2017-08-07 08:02:04 -06:00 |
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e0f9a7c34c
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Adds BOW tutorial link in main menu
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2017-08-07 00:06:53 -04:00 |
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aaf17bde3f
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Added tutorial for using LAMMPS in Bash on Windows
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2017-08-07 00:06:12 -04:00 |
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5ad8a3332d
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Merge pull request #55 from GarrettTow/patch-1
Fixed typo in "compute_voronoi_atom.txt"
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2017-08-04 19:18:57 -04:00 |
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ca7a3a6316
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Fixed typo in "compute_voronoi_atom.txt"
There was the typo "requiers" in the Restrictions section of compute_voronoi_atom.txt.
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2017-08-04 17:48:27 -04:00 |
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59ac6ef573
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correct a link and a name for OpenKIM
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2017-08-04 11:19:09 -04:00 |
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2fa16bcd4c
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make overlapping links to references unique to avoid anchor label errors
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2017-08-04 11:11:41 -04:00 |
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96d3712817
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Add missing link flag
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2017-07-31 15:52:44 -06:00 |
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b395ef00b4
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Update tutorial_pylammps.txt
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2017-07-31 15:50:14 -06:00 |
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e7d9aabca6
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Merge branch 'kim-install' into install-and-docs-reviewed
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2017-07-28 11:25:08 -04:00 |
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72419b6313
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Merge remote-tracking branch 'github/kim-doc' into install-and-docs-reviewed
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2017-07-26 19:35:15 -04:00 |
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da7a5f55d3
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Merge branch 'kim-install' into install-and-docs-reviewed
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2017-07-26 19:32:55 -04:00 |
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934cbbbeca
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restore lost KIM doc section in Section packages
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2017-07-26 16:07:08 -06:00 |
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a59b7e4d56
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patch 24Jul17
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2017-07-24 09:09:22 -06:00 |
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3449d42267
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include pair style kim doc changes that were accidentally included in PR #590
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2017-07-20 17:58:49 -04:00 |
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551001f172
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revert change, that is part of the kim-install branch and changeset
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2017-07-20 17:08:19 -04:00 |
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59db5f6a17
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update of Fortran-DFTB interface to be compatible with fix msst
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2017-07-20 14:40:35 -06:00 |
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3cd597e948
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Merge pull request #585 from akohlmey/make-py-manual-cleanup
Make.py removal and manual cleanup
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2017-07-20 12:05:04 -06:00 |
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eca61226c2
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Merge pull request #583 from giacomofiorin/colvars-update-2017-07-19
Update Colvars to version 2017-07-15 and support automated builds for it
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2017-07-20 12:04:49 -06:00 |
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fac3e3daa2
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Merge pull request #581 from libAtoms/idces2quip
Modified USER-QUIP interface to pass lammps atom IDs
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2017-07-20 12:04:32 -06:00 |
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a351977c59
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update manual links that got broken when removing and renumbering a section
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2017-07-20 12:25:42 -04:00 |
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ee6cac826e
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Update Colvars to version 2017-07-15 and support automated builds for it
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2017-07-19 14:24:07 -04:00 |
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52a1c54d50
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support QUIP wrapper API version query, relax hybrid restriction to allow hybrid/overlay, update docs
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2017-07-19 13:17:35 -04:00 |
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fcf9607a66
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Update USER_QUIP docs to clarify use of "special_bonds"
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2017-07-19 17:47:21 +01:00 |
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5cbaf7ca1d
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correct commands table format issue
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2017-07-18 14:47:54 -04:00 |
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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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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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296e572e69
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better Install.py script for KIM from Ryan Elliott
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2017-07-14 16:25:16 -06:00 |
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3b1134c164
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correct formatting error in peridynamics pair style docs
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2017-07-14 13:42:02 -04:00 |
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fc36754ca2
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Merge pull request #561 from v0i0/fix-airebo-various
Fix Various AIREBO issues
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2017-07-13 13:10:42 -06:00 |
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3a46c34c2f
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Merge pull request #574 from lammps/snap-virial
changes to SNAP virial from Aidan
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2017-07-13 13:07:29 -06:00 |
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a3a0c9b144
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Merge pull request #570 from akohlmey/collected-small-changes
Collected small changes
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2017-07-13 11:26:47 -06:00 |
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e58bcd8b4a
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Merge pull request #568 from akohlmey/fix_gcmc_parallel_workaround
Workaround for data corruption when using fix gcmc in parallel with shake or fix rigid
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2017-07-13 11:23:49 -06:00 |
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ef2f4980e9
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Merge pull request #566 from akohlmey/compute_rdf_dynamic
Dynamic group and normalization support for compute rdf
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2017-07-13 11:23:22 -06:00 |
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d3a45f6d50
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Merge pull request #560 from aershadinia/master
EES wall potential
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2017-07-13 11:22:47 -06:00 |
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d0cc1dfbb8
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changes to SNAP virial from Aidan
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2017-07-13 11:19:35 -06:00 |
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c8939d8df6
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clarify explanation of body style molecule in rigid fixes
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2017-07-11 09:43:54 -04:00 |
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c9a0d38a3e
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mention restriction for use with fix shake or fix rigid in fix gcmc docs
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2017-07-10 17:34:00 -04:00 |
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fe888e4622
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add support for recomputing normalization factors and finite size correction during
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2017-07-07 15:39:25 -04:00 |
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4339379948
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patch 6Jul17
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2017-07-06 13:58:26 -06:00 |
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23925b3a57
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update fix wall/ees and wall/region/ees file to conform more to common formatting
also fix some typos and formatting issues
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2017-07-06 14:47:44 -04:00 |
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423e3b6389
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integrate fix wall/ees and wall/region/ees into doc system
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2017-07-06 14:45:51 -04:00 |
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8be6d5bfd8
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Merged two doc files
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2017-07-06 20:21:55 +09:00 |
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a62eb43791
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Delete "fix_wall_region_ees.txt"
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2017-07-06 20:20:12 +09:00 |
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33be51af54
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Deleted "fix wall/region/ees" doc file
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2017-07-06 20:19:40 +09:00 |
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