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5e0b017d30
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update information about adding unit tests to reflect recent changes
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2021-04-04 20:51:58 -04:00 |
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b2e9ffa673
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add missing entry to standard packages list
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2021-04-03 11:15:00 -04:00 |
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66e885b6e5
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Merge branch 'master' into collected-small-changes
# Conflicts:
# src/USER-YAFF/pair_lj_switch3_coulgauss_long.cpp
# src/USER-YAFF/pair_mm3_switch3_coulgauss_long.cpp
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2021-04-02 17:57:54 -04:00 |
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b976c2d13c
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Merge pull request #2679 from akohlmey/more-unittests
Expand unit tests
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2021-04-02 17:51:29 -04:00 |
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1c43b4a4c3
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Merge branch 'fix_ave_chunk_cdof_bug' into collected-small-changes
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2021-04-02 17:50:33 -04:00 |
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90ab63f9ad
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Merge branch 'master' into collected-small-changes
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2021-04-02 17:49:27 -04:00 |
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af6452065f
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correct URL to XTC file format docs on the gromacs homepage
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2021-04-02 16:48:13 -04:00 |
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7995fd8923
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Merge pull request #2689 from bhanudaysharma/patch-1
Update units.rst (documentation for units commands)
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2021-04-02 16:09:56 -04:00 |
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c62b1b1050
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Merge remote-tracking branch 'github/master' into collected-small-changes
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2021-04-02 16:08:51 -04:00 |
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e613da98d6
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Merge pull request #2650 from akohlmey/plugin-loader
New PLUGIN package with a LAMMPS plugin loader command
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2021-04-02 15:08:44 -04:00 |
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d24f74b582
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add stop on file example to fix halt docs
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2021-04-02 12:31:46 -04:00 |
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2dfafe4adb
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add is_file() special variable function and unit tests for it
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2021-04-02 12:07:43 -04:00 |
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b5ef98cc22
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consolidate the documentation for lj/switch3/coulgauss/long and mm3/switch3/coulgauss/long into a single file
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2021-04-01 12:42:07 -04:00 |
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3668ce1374
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Merge branch 'master' into more-unittests
# Conflicts:
# unittest/testing/core.h
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2021-04-01 11:11:18 -04:00 |
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0b60650c1b
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Merge branch 'master' into collected-small-changes
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2021-04-01 10:11:59 -04:00 |
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21c934d2cd
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Merge pull request #2682 from rbberger/python_unittests
Python package unit tests
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2021-04-01 10:11:26 -04:00 |
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f867e69290
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include new split_lines() function in Developer docs
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2021-04-01 09:35:52 -04:00 |
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7092a7769c
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Update units.rst
In LJ units, the conversion formula between rho and rho* should be corrected to
\rho^* = \rho \frac{\sigma^{dim}}{m}
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2021-03-31 06:44:52 +05:30 |
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4ee24b85b0
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fix a few minor issues with the docs
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2021-03-30 11:45:47 -04:00 |
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2dbf59efa9
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update install instructions for updates via patch and git for CMake/GNU make
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2021-03-30 11:43:56 -04:00 |
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bfca619957
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fix typos
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2021-03-30 07:49:15 -04:00 |
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3041561383
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add proper r-RESPA support for fix cmap
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2021-03-30 07:36:53 -04:00 |
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ea105a3c9a
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fix typo
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2021-03-30 07:36:22 -04:00 |
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41de02ee9d
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update granular howto
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2021-03-29 23:44:38 -04:00 |
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ea808b8563
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Merge branch 'master' into more-unittests
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2021-03-29 15:27:26 -04:00 |
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e85f945d8e
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fix typos
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2021-03-26 23:12:29 -04:00 |
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55b0e33200
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fix typo
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2021-03-24 18:01:48 -04:00 |
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b7296b6d0b
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consolidate documentation for dihedral styles table and table/cut into one file
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2021-03-23 13:49:37 -04:00 |
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58744f0a49
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correct expression for K
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2021-03-22 15:32:24 -04:00 |
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aabfe40ad3
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add missing 1/n**2 term to pair style cosine/periodic energy function
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2021-03-22 15:10:45 -04:00 |
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e8c8ceaf81
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correct attribution of angle style cosine/squared with DREIDING
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2021-03-22 11:28:22 -04:00 |
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b8f6063578
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correct documentation of angle style cosine/periodic
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2021-03-22 10:47:49 -04:00 |
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06ee5be2ce
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Fix unhandled cases in docs LAMMPS syntax highlighting
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2021-03-19 18:51:21 -04:00 |
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024a9600b1
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update docs
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2021-03-18 18:20:32 -04:00 |
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ddc77be911
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update docs for converting the plugin feature to a package
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2021-03-16 23:52:44 -04:00 |
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11894f83b9
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clarify and fix grammar issues
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2021-03-16 19:50:45 -04:00 |
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31009b0517
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Merge branch 'master' into plugin-loader
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2021-03-16 19:46:21 -04:00 |
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22fdfa27b5
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Updated documentation to clarify the treatment of temperature using norm all
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2021-03-17 09:01:35 +10:00 |
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d1b4af60a3
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disable GPU binning via CUDPP by default and describe why
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2021-03-16 11:58:47 -04:00 |
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f2890e39ef
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update to use new intel fortran compiler name
Co-authored-by: Richard Berger <richard.berger@temple.edu>
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2021-03-15 20:53:49 -04:00 |
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1b409fbae8
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update docs for magic patterns
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2021-03-14 06:39:59 -04:00 |
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18be1a2ea3
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fix typo in false positives
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2021-03-14 05:45:25 -04:00 |
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84b0da3054
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add a "magic" file for use with the file(1) command to detect LAMMPS files
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2021-03-14 05:44:28 -04:00 |
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ec2be3f8bc
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add preset for Intel's new oneAPI LLVM based compiler
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2021-03-13 13:07:25 -05:00 |
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88760fa648
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add plugin clear command to unload all loaded plugins
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2021-03-13 12:40:04 -05:00 |
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3e90b1971a
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add preliminary support for compiling/loading plugins on windows
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2021-03-12 22:21:11 -05:00 |
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a2bcd7fe68
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programmer documentation update
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2021-03-12 00:07:52 -05:00 |
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524c62994e
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update docs
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2021-03-11 23:12:00 -05:00 |
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dde00ab344
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add plugin command documentation
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2021-03-11 23:10:26 -05:00 |
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19c042c8d2
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add false positives
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2021-03-11 21:19:49 -05:00 |
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