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2455e35fd8
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typeset mixing rules with embedded math
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2020-03-01 08:51:29 -05:00 |
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8662733dcd
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convert the remainder of raw html typesetting in pair style smtbq
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2020-02-29 14:45:39 -05:00 |
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228a0bfa2e
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replace hi- with high-
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2020-02-29 11:37:47 -05:00 |
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6f47f110f1
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use k_B consistently, fix some more math. convert some transcriptions to math
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2020-02-29 11:37:31 -05:00 |
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07fc624509
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typeset reduced units
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2020-02-29 06:41:28 -05:00 |
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66a0e27edf
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some more cases where we can use embedded math
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2020-02-29 04:57:44 -05:00 |
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e6c9efe6bf
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convert lists to tables for more compact presentation
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2020-02-28 18:52:13 +01:00 |
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f02b2485fa
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tweak command overview table width so it is readable in PDF
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2020-02-28 18:51:52 +01:00 |
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71c11c32e3
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replace more raw html code and add syntax highlighting
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2020-02-28 18:00:43 +01:00 |
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19d334908b
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replace raw html with embedded math expressions and fix related issues
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2020-02-28 17:39:57 +01:00 |
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7be004512f
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Update Colvars to version 2020-02-27
This update contains several small new features or usability improvements.
Descriptions and authorship information can be accessed from the pull
requests listed below.
Allow setting sigma parameter directly for metadynamics
https://github.com/Colvars/colvars/pull/325
Remove default values for lowerWall and upperWall legacy keywords
https://github.com/Colvars/colvars/pull/324
biasActualColvar option to bypass extended-Lagragian for a bias
https://github.com/Colvars/colvars/pull/321
Flexible restart-reading
https://github.com/Colvars/colvars/pull/320
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2020-02-27 19:55:31 -05:00 |
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03985454ed
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some more formatting and math conversion improvements
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2020-02-27 18:18:49 -05:00 |
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d242051c8e
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Merge pull request #1898 from akohlmey/next_lammps_version
Update version info for next release candidate
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2020-02-27 14:38:08 -05:00 |
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6e7e365981
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Merge pull request #1888 from lammps/release-preparation
Documentation and Build script and Info updates for stable release
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2020-02-27 13:23:08 -05:00 |
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3c277409c2
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switch parsed-literal to code-block in Howto files where applicable
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2020-02-27 12:45:14 -05:00 |
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67bfda532f
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mods to fix numdiff
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2020-02-27 09:52:23 -07:00 |
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06ede499c1
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use only the LAMMPS logo in the navigation bar
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2020-02-27 11:36:00 -05:00 |
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eb8531062c
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Merge branch 'doc-updates' of github.com:rbberger/lammps into release-preparation
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2020-02-27 11:26:15 -05:00 |
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25ec8d36a8
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Final batch of index cleanup and code-blocks
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2020-02-27 11:08:04 -05:00 |
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2d2cb46dc0
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move release date
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2020-02-27 08:58:09 +01:00 |
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1bb38ed09b
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Merge commit 'refs/pull/1903/head' of github.com:lammps/lammps into release-preparation
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2020-02-27 01:15:17 -05:00 |
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fe1ac99ae7
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bond/react: docs tweak
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2020-02-26 20:08:58 -07:00 |
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9ef5949798
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Second batch of index cleanup and code-blocks
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2020-02-26 16:31:05 -05:00 |
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3563d2f10d
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remove references to html-offline and only produce the offline viewable html manual
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2020-02-26 16:01:03 -05:00 |
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7bd3215226
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Merge pull request #1894 from stanmoore1/kk_snap_chunk
Make Kokkos pair SNAP chunksize variable user-settable
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2020-02-26 15:27:37 -05:00 |
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a828facbd8
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Merge pull request #1900 from akohlmey/couple-lammps-plugin
Example for loading LAMMPS as a plugin from a shared library
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2020-02-26 10:40:24 -05:00 |
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c92378eaca
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add explanation of use of group2 and document effect of compute group
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2020-02-26 13:12:14 +01:00 |
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b0eb940b05
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Added numdiff to false positives
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2020-02-25 16:30:13 -07:00 |
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13bff07606
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Added documentation, added an example, avoided position round off, added in compute_pe's compute_scalar, now fix produces per-atom array instead of global array
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2020-02-25 15:32:37 -07:00 |
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8e1928aa65
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First batch of index cleanup and code-blocks
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2020-02-25 14:46:22 -05:00 |
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e87b3a21c2
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complete documentation for LAMMPS plugin coupling example
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2020-02-25 14:10:55 -05:00 |
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1fc4dc151f
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typo
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2020-02-25 18:11:31 +01:00 |
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7acba4584d
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added group2ID
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2020-02-25 18:05:36 +01:00 |
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1a2a9f2209
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small correction/simplification of the linking to LAMMPS library examples
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2020-02-25 17:36:37 +01:00 |
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96d04b8a6c
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Update LAMMPS lexer for docs
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2020-02-25 11:30:20 -05:00 |
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26f11f19a7
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update LAMMPS version string
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2020-02-25 15:04:56 +01:00 |
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8d427b54ec
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small tweaks
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2020-02-25 00:42:57 -05:00 |
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11cda92ebb
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add some false positives
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2020-02-24 17:19:29 -05:00 |
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4ed1b4c3c7
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Moved the chunking keyword to pair_snap.rst
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2020-02-24 15:09:51 -07:00 |
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003ef9d98a
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add missing table
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2020-02-24 17:03:06 -05:00 |
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bf4ad9ddd7
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remove unused equation file
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2020-02-24 16:45:42 -05:00 |
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351bca4ccb
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convert pair style bop to class2
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2020-02-24 16:43:40 -05:00 |
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3aa6f39425
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convert pair styles colloid to dipole
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2020-02-24 16:19:24 -05:00 |
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02e287bf51
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convert pair styles dpd to exp6
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2020-02-24 15:41:16 -05:00 |
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796e1ac4e9
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Update docs
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2020-02-24 13:29:22 -07:00 |
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674781fe0e
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Add Kokkos version of compute orientorder/atom
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2020-02-24 13:27:40 -07:00 |
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7ee39416b4
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Small doc tweak
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2020-02-24 13:08:31 -07:00 |
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406ead64b5
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Update docs
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2020-02-24 13:04:34 -07:00 |
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9955c8f94b
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convert pair styles gauss to gromacs
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2020-02-24 13:30:58 -05:00 |
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8774ec04a9
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convert pair styles hbond to lebedeva
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2020-02-24 12:01:22 -05:00 |
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