Commit Graph

2609 Commits

Author SHA1 Message Date
024a91c751 Add documentation on how to compile GPU package with HIP using CMake 2020-04-10 14:50:10 -04:00
56c07cec26 handle not previously flagged false positives 2020-04-06 08:28:12 -04:00
596ec06960 Update fix_adapt.rst 2020-04-01 15:01:34 +02:00
1316e93eb2 Merge pull request #1870 from stanmoore1/kk_2.99
Update Kokkos library to v3.0
2020-03-30 13:35:48 -04:00
5a88db838d Merge pull request #1946 from yafshar/kim-property
Add new kim_property command
2020-03-27 20:58:52 -04:00
afc17b1d53 use american english spelling 2020-03-27 19:05:52 -04:00
2d15071c9f Update Errors_messages.rst 2020-03-27 23:22:17 +01:00
9e0e046eb2 MEAM/C: improve error messages and documentation 2020-03-26 17:20:23 +01:00
0025dfe1e3 Update Kokkos CUDA minimum verison 2020-03-25 13:56:18 -06:00
3704d90efb Merge branch 'master' into collected-small-fixes 2020-03-25 06:50:11 -04:00
431647d943 Add link to official WSL docs 2020-03-24 18:52:05 -04:00
0f35c1d009 Update ubuntu package name to libpng-dev 2020-03-24 18:43:20 -04:00
0060473cee fix up some escaped '*' characters in "code-block" sections that do not need to be escaped 2020-03-24 11:35:21 -04:00
aabee4b328 one more change 2020-03-20 07:27:28 -06:00
9ff71e2da0 fix a typo 2020-03-20 07:26:15 -06:00
8b0e5c66ea tweak the docs for the new fix numdiff command 2020-03-20 07:23:01 -06:00
a7f16f521f Merge branch 'master' into atc-doc-to-rst 2020-03-19 15:55:08 -04:00
6644caf817 fix rst formatting issues 2020-03-19 15:48:46 -04:00
223bfac229 remove ATC html files that are no longer needed 2020-03-19 15:44:53 -04:00
a6adf95603 final batch of converted AtC doc files 2020-03-19 15:36:45 -04:00
65b6b6f2f8 next batch of converted files 2020-03-19 14:39:00 -04:00
84f89134d9 Merge branch 'master' into atc-doc-to-rst
# Conflicts:
#	doc/src/Errors_messages.rst
2020-03-19 11:28:02 -04:00
23509d0785 add missing entries for new pair styles 2020-03-19 11:09:41 -04:00
3d0fc4a112 update docs for updated CMake support with MinGW 2020-03-19 11:09:27 -04:00
5fbb1fa331 small tweak to MinGW preset and correct corresponding entry in documentation 2020-03-19 09:00:36 -04:00
42cff9270c Merge branch 'master' into restart-consistency 2020-03-19 05:32:45 -04:00
b40bc3993d Merge branch 'master' into restart-consistency 2020-03-19 00:54:04 -04:00
53bc791b52 Merge branch 'collected-small-changes' of github.com:akohlmey/lammps into collected-small-changes 2020-03-19 00:51:30 -04:00
f589cdb8c6 Merge branch 'master' into collected-small-changes 2020-03-19 00:29:08 -04:00
130113927b add new preset "intel" to enable Intel compilers. Tweak Clang settings 2020-03-19 00:22:41 -04:00
b44d3afafe next batch of converted files 2020-03-18 23:41:37 -04:00
17dd794514 Merge pull request #1891 from charlessievers/fix_numerical_differentiation
New fix to compute properties by numerical differences
2020-03-18 23:31:18 -04:00
060e4ff346 integrate fix numdiff into manual and remove bogus false positive from spellcheck 2020-03-18 23:09:43 -04:00
72b70a041d small tweaks to align fix numdiff with the rest of the manual 2020-03-18 23:04:02 -04:00
842fe150eb update coul/slater docs to align with recent changes in upstream 2020-03-18 21:07:57 -04:00
7ee63a0025 small spelling update 2020-03-18 21:02:40 -04:00
2714fad178 Merge branch 'master' into collected-small-changes
# Conflicts:
#	doc/src/Build_development.rst
2020-03-18 20:59:16 -04:00
164bf1b60e Merge pull request #1883 from evoyiatzis/master
Coulomb pair style with smeared out charges (coul/slater)
2020-03-18 20:52:47 -04:00
2b39c9968f Merge pull request #1913 from jrgissing/molecule_template_moleculeIDs
Molecule template: molecule-IDs and fragments
2020-03-18 20:31:29 -04:00
3e36acc533 Merge branch 'master' into restart-consistency
# Conflicts:
#	doc/src/fix_halt.rst
2020-03-18 20:30:00 -04:00
d1388b4ea8 Merge pull request #1941 from e-kwsm/typo
Fix typos in comments and output.
2020-03-18 20:24:06 -04:00
2cefddb16c avoid spelling errors 2020-03-18 17:16:47 -04:00
b903cc6dc7 remove excessive details about how to compile with cmake. refer to cmake docs. 2020-03-18 17:12:36 -04:00
460dd662e4 next chunk of converted atc doc files 2020-03-18 11:39:53 -04:00
ca1e1e2dff Convert British spelling to American 2020-03-18 23:09:23 +09:00
1db2538239 use "command" instead of "cmd" 2020-03-18 07:02:49 -04:00
280d5cc6ae replace "xxxn't" with "xxx not" 2020-03-18 07:02:34 -04:00
38b1bf9ba5 add links to ctypes, ipython, and jupyter 2020-03-18 07:01:06 -04:00
5992bd24e7 some more converted atc fix_modify docs 2020-03-18 06:29:17 -04:00
d7cade9d46 Merge branch 'master' into molecule_template_moleculeIDs 2020-03-17 23:08:00 -06:00