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5102 Commits

Author SHA1 Message Date
Axel Kohlmeyer 80af0281d1
replace non-ASCII characters 2019-04-25 17:54:27 -04:00
Axel Kohlmeyer 8882436078
add e3b styles to legacy documentation build 2019-04-25 17:49:35 -04:00
Steven Strong 47d4aa6803 add new false positives 2019-04-24 17:35:17 -05:00
Steven Strong f548e2717e add new false positives 2019-04-24 17:31:44 -05:00
Steven Strong dec1ad19b5 added e3b.jpg 2019-04-19 10:33:51 -05:00
Steven Strong 0eebb31903 update contact info 2019-04-16 11:48:45 -05:00
Steven Strong 69e7a2a237 add e3b water model 2019-04-16 11:32:47 -05:00
Axel Kohlmeyer cb559659f8
write a full-fledged LAMMPS manpage. 2019-04-07 10:35:00 -04:00
Axel Kohlmeyer 5c5b57be5a
minor tweaks 2019-04-07 10:34:25 -04:00
Axel Kohlmeyer e57c4c60bd
fix spelling issue 2019-04-07 05:59:28 -04:00
Axel Kohlmeyer 6f7b3643ef
document clang/clang++ preset with settings for MPI and OpenMP 2019-04-07 00:46:43 -04:00
Axel Kohlmeyer b40c4d1641
update version number and some reformatting of the LAMMPS manpage 2019-04-06 23:45:01 -04:00
Axel Kohlmeyer a6c9a782a4
add manpage for msi2lmp 2019-04-06 23:41:48 -04:00
Axel Kohlmeyer 0d8d8dc0da
Merge branch 'master' into collected-small-changes 2019-04-06 19:52:39 -04:00
Axel Kohlmeyer ce1040a103
Merge pull request #1414 from oywg11/github-tutorial-update 
fix two bugs in potential #839
 2019-04-06 19:44:11 -04:00
Axel Kohlmeyer 494e76da7d
add false positive 2019-04-06 17:29:04 -04:00
Axel Kohlmeyer f98aed419c
document the 'maxelt' define in pair style meam/c and how to change it 2019-04-06 17:03:24 -04:00
oywg11 6e6d350572 correct the spelling 2019-04-05 23:01:28 +03:00
oywg11 4f459a59a1 correct the spelling 2019-04-05 22:55:40 +03:00
Axel Kohlmeyer ac7312caf1
Merge pull request #1409 from akohlmey/collected-small-changes 
Collected small changes and bugfixes for the next patch release
 2019-04-05 15:39:16 -04:00
oywg11 815ad4dab2 fix a bug in ILP 2019-04-05 22:04:45 +03:00
Axel Kohlmeyer 2e1da2958d
resolve toctree and paper anchor issues 2019-04-05 11:04:11 -04:00
Axel Kohlmeyer 2757e4e6e6
two more false positives 2019-04-05 10:53:41 -04:00
Axel Kohlmeyer 85a0461a48
reword and reformat text in Howto_bioFF.txt a little bit. add warnings about msi2lmp's age and lack of maintenance 2019-04-05 10:53:23 -04:00
Evangelos Voyiatzis 5d3801cb12
Include info for COMPASS in the Howto section 2019-04-05 15:50:58 +02:00
Risto Toijala 619c2322e5 Merge remote-tracking branch 'upstream/master' into fix-elstop 2019-04-04 10:03:36 +03:00
Risto Toijala 0d78c7b43d fix elstop: Rename to fix electron/stopping 2019-04-04 09:57:15 +03:00
Axel Kohlmeyer bd923d8bd4
fix second typo in the same word. i need a break... :-( 2019-04-02 17:33:35 -04:00
Axel Kohlmeyer 4a003644fe
fix typo 2019-04-02 16:41:02 -04:00
Axel Kohlmeyer 34b023456b
add message about -DLAMMPS_BIGBIG incompatibility of scatter/gather functions 2019-04-02 15:28:48 -04:00
Axel Kohlmeyer 98bd720c68
improved formatting of cmake settings and presets related docs 2019-04-02 14:56:51 -04:00
Axel Kohlmeyer 4824992a1e
update documentation for recent changes to CMake presets 2019-04-02 14:31:13 -04:00
Axel Kohlmeyer 0ab65c0343
update docs for building LAMMPS for windows 2019-04-02 07:12:55 -04:00
Axel Kohlmeyer 800f3a81b1
update documentation for changes in USER-INTEL support in CMake 2019-04-02 06:59:19 -04:00
Axel Kohlmeyer 91f3a94851
fix typo in docs 2019-04-02 05:49:25 -04:00
Risto Toijala 053bdea234 fix elstop: Use inline LaTeX for equation 2019-04-01 12:27:50 +03:00
Axel Kohlmeyer 7688ead60f
add pair style granular to pair style overview page in manual 2019-04-01 04:42:56 -04:00
Risto Toijala 61d4b7a47f Add Kai as spelling false positive 2019-04-01 09:14:47 +03:00
Axel Kohlmeyer 971bce7428
address formatting issue in pair granular docs 2019-03-30 23:33:54 -04:00
Axel Kohlmeyer 5065350081
improve kim-query documentation 2019-03-30 23:19:31 -04:00
Axel Kohlmeyer 560ccb2719
Merge pull request #1387 from akohlmey/next-patch-release 
Step version string for next patch release
 2019-03-29 14:25:45 -04:00
Axel Kohlmeyer 17cd650622
Merge branch 'master' into collected-small-changes 2019-03-29 11:35:15 -04:00
Axel Kohlmeyer 4eafb624b7
Merge pull request #1392 from ellio167/kim-2.0.2 
Updates for kim-api-2.0.2 release
 2019-03-29 11:31:00 -04:00
Axel Kohlmeyer 30929d95e2
Merge pull request #1342 from dsbolin/gran_mods 
New generalized granular pair style added
 2019-03-29 10:37:07 -04:00
Axel Kohlmeyer 75382cf265
update documentation tweaks to run cleanly 2019-03-29 10:34:34 -04:00
Axel Kohlmeyer 13255d6338
step version to 29 March 2019 2019-03-29 09:20:33 -04:00
Axel Kohlmeyer 1bf5047c7a
document new CUDA_MPS_SUPPORT option in CMake 2019-03-28 18:03:54 -04:00
Ryan S. Elliott 9d0e518cc5 Updates for kim-api-2.0.2 release 2019-03-28 15:35:22 -05:00
Axel Kohlmeyer 30bca9f91e
force loading of Sphinx version 1.7.6 instead of 2.0.0 or later, so the spellchecker keeps working 2019-03-28 16:20:19 -04:00
Axel Kohlmeyer eab939af23
add a note about the lack of stress/atom in USER-INTEL to the manual 2019-03-28 12:47:06 -04:00