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245e200c48
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Merge pull request #1945 from akohlmey/collected-small-changes
Collected small changes
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2020-03-19 05:31:22 -04:00 |
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b40bc3993d
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Merge branch 'master' into restart-consistency
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2020-03-19 00:54:04 -04:00 |
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53bc791b52
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Merge branch 'collected-small-changes' of github.com:akohlmey/lammps into collected-small-changes
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2020-03-19 00:51:30 -04:00 |
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1fd956a696
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fix bug when allocating and freeing newly added data structures
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2020-03-19 00:51:14 -04:00 |
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9825cd2569
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silence compiler warnings
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2020-03-19 00:50:30 -04:00 |
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f589cdb8c6
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Merge branch 'master' into collected-small-changes
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2020-03-19 00:29:08 -04:00 |
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130113927b
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add new preset "intel" to enable Intel compilers. Tweak Clang settings
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2020-03-19 00:22:41 -04:00 |
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b44d3afafe
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next batch of converted files
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2020-03-18 23:41:37 -04:00 |
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17dd794514
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Merge pull request #1891 from charlessievers/fix_numerical_differentiation
New fix to compute properties by numerical differences
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2020-03-18 23:31:18 -04:00 |
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78a2f86235
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whitespace fixes
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2020-03-18 23:13:19 -04:00 |
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060e4ff346
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integrate fix numdiff into manual and remove bogus false positive from spellcheck
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2020-03-18 23:09:43 -04:00 |
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72b70a041d
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small tweaks to align fix numdiff with the rest of the manual
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2020-03-18 23:04:02 -04:00 |
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71582c99ca
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rearrange pointer variables to a more logical location, quell compiler warning and initialize all pointer
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2020-03-18 22:51:16 -04:00 |
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842fe150eb
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update coul/slater docs to align with recent changes in upstream
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2020-03-18 21:07:57 -04:00 |
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7ee63a0025
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small spelling update
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2020-03-18 21:02:40 -04:00 |
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2714fad178
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Merge branch 'master' into collected-small-changes
# Conflicts:
# doc/src/Build_development.rst
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2020-03-18 20:59:16 -04:00 |
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164bf1b60e
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Merge pull request #1883 from evoyiatzis/master
Coulomb pair style with smeared out charges (coul/slater)
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2020-03-18 20:52:47 -04:00 |
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2b39c9968f
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Merge pull request #1913 from jrgissing/molecule_template_moleculeIDs
Molecule template: molecule-IDs and fragments
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2020-03-18 20:31:29 -04:00 |
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3e36acc533
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Merge branch 'master' into restart-consistency
# Conflicts:
# doc/src/fix_halt.rst
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2020-03-18 20:30:00 -04:00 |
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a569027a14
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trip some excess padding to make the pages waste less space on small screens
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2020-03-18 20:25:26 -04:00 |
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d1388b4ea8
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Merge pull request #1941 from e-kwsm/typo
Fix typos in comments and output.
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2020-03-18 20:24:06 -04:00 |
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9fa4d27bdd
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Merge commit 'refs/pull/1948/head' of github.com:lammps/lammps into collected-small-changes
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2020-03-18 19:02:33 -04:00 |
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572eeae549
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Move LAMMPS version string to side bar
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2020-03-18 18:09:55 -04:00 |
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7824b3f4ab
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small html theme tweaks to unclutter top of page. move version string to navigation bar
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2020-03-18 17:52:19 -04:00 |
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b6ce32f651
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step version string for next patch release
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2020-03-18 17:18:46 -04:00 |
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2cefddb16c
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avoid spelling errors
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2020-03-18 17:16:47 -04:00 |
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b903cc6dc7
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remove excessive details about how to compile with cmake. refer to cmake docs.
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2020-03-18 17:12:36 -04:00 |
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c28b9f100c
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remove unused and broken function
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2020-03-18 15:38:29 -04:00 |
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460dd662e4
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next chunk of converted atc doc files
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2020-03-18 11:39:53 -04:00 |
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ca1e1e2dff
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Convert British spelling to American
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2020-03-18 23:09:23 +09:00 |
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6054f29933
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update false positives
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2020-03-18 07:03:32 -04:00 |
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1db2538239
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use "command" instead of "cmd"
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2020-03-18 07:02:49 -04:00 |
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280d5cc6ae
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replace "xxxn't" with "xxx not"
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2020-03-18 07:02:34 -04:00 |
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38b1bf9ba5
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add links to ctypes, ipython, and jupyter
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2020-03-18 07:01:06 -04:00 |
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f1679cd58c
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update false positives
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2020-03-18 06:37:51 -04:00 |
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5992bd24e7
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some more converted atc fix_modify docs
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2020-03-18 06:29:17 -04:00 |
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d7cade9d46
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Merge branch 'master' into molecule_template_moleculeIDs
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2020-03-17 23:08:00 -06:00 |
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5109b7f1b1
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correct incorrect spelling correction
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2020-03-17 20:45:52 -04:00 |
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9ebd1e4572
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convert british spelling to american
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2020-03-17 20:41:49 -04:00 |
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0e764a3a48
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correct spelling correction
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2020-03-17 20:37:33 -04:00 |
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7f53cbc1a0
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fix grammar issue
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2020-03-17 20:33:37 -04:00 |
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e000c46c8c
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correct spelling
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2020-03-17 20:29:18 -04:00 |
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da0acd2790
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update spelling false positives
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2020-03-17 19:28:30 -04:00 |
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4a5125f450
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make behavior of CMAKE_TUNE_FLAGS more consistent and allow to turn it off
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2020-03-17 19:16:02 -04:00 |
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c1268bd1ec
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remove dead code
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2020-03-17 18:55:05 -04:00 |
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1d8e9ca014
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include gcc sanitizer libraries
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2020-03-17 18:53:28 -04:00 |
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66f730b895
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setting const on return value has no effect
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2020-03-17 18:53:10 -04:00 |
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dae2bce6b0
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we can use error->all() and also check the coordinate conversion for valid data
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2020-03-17 16:53:22 -04:00 |
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a7d2847140
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parse image flags only for valid numbers and requize imz == 0 for 2d-systems
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2020-03-17 16:43:34 -04:00 |
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6f6855e831
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do not advertise multiple targets in cmbuild wrapper
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2020-03-17 15:57:33 -04:00 |
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