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118 Commits

Author SHA1 Message Date
Axel Kohlmeyer 8a1f893b43
repair incorrect conversions on [*] expressions by txt2rst 2020-01-22 13:20:04 -05:00
Axel Kohlmeyer ef2ac8aa26
convert updated docs to rst and remove .txt sources 2020-01-16 14:04:14 -05:00
oywg11 b2b28015c4 New ILP paramters 2020-01-16 16:46:04 +02:00
Axel Kohlmeyer 4d20f1623c
remove outdated .txt versions of documentation 2020-01-15 11:53:21 -05:00
Axel Kohlmeyer ded3354fa9
add comments about thread safety to the library howto 2020-01-14 15:04:17 -05:00
Axel Kohlmeyer 7f0373afa3
fix typo 2020-01-14 14:51:00 -05:00
Axel Kohlmeyer b9c6e0f700
Merge pull request #1691 from toquydong/stochasticwall 
Implementation of statistical gas wall boundary conditions
 2020-01-14 14:11:16 -05:00
Axel Kohlmeyer 660264855a
update rst documentation for fix hyper/local 2020-01-14 13:27:35 -05:00
Steve Plimpton 628dc6dd2a sync with master 2020-01-14 10:40:05 -07:00
Axel Kohlmeyer 02c99d1554
convert documentation to rst format and remove corresponding txt files 2020-01-14 10:14:39 -05:00
Axel Kohlmeyer e03b7c5441
Merge branch 'master' into message-iterate 2020-01-14 10:10:08 -05:00
Axel Kohlmeyer 6c851f6db0
remove outdated .txt file 2020-01-13 23:15:20 -05:00
Axel Kohlmeyer f095aacad7
remove outdated .txt files 2020-01-13 23:08:20 -05:00
Axel Kohlmeyer d35b15525b
remove obsolete .txt files 2020-01-13 22:58:35 -05:00
Axel Kohlmeyer 8258d0cb59
remove obsolete .txt file 2020-01-13 22:28:02 -05:00
Steve Plimpton d3348371e1 refactoring of code and doc files 2020-01-13 15:22:02 -07:00
Steve Plimpton 51efee43be sync to master 2020-01-13 13:42:05 -07:00
Steve Plimpton 9ed987c255 minor changes to syntax and documentation of fix deposit orient 2020-01-13 13:15:17 -07:00
Steve Plimpton e8d11931ec merged in current master 2020-01-13 10:34:31 -07:00
Steve Plimpton 99dc283f82 Merge branch 'master' into message-iterate 2020-01-13 09:30:51 -07:00
Axel Kohlmeyer 6813ab4c9c
Merge pull request #1832 from akohlmey/doc-styles-check 
Check style command lists against existing styles in sources
 2020-01-13 10:38:26 -05:00
Axel Kohlmeyer eed85bb676
Merge pull request #1834 from akohlmey/suffix-flag-refactor 
Small Suffix flag refactoring and disallow per substyle special overrides for USER-INTEL and GPU
 2020-01-13 10:37:35 -05:00
Axel Kohlmeyer bfaea66e66
update documentation 2020-01-12 23:03:45 -05:00
Axel Kohlmeyer 81c9b0b12e
small update to kspace overview 2020-01-12 10:17:56 -05:00
Axel Kohlmeyer a0ecf539f6
clean up and correct some documentation link issues 2020-01-12 10:08:14 -05:00
Axel Kohlmeyer 587fc9d962
Merge pull request #1828 from lammps/post-patch-tweaks 
minor omissions in recent patch release
 2020-01-11 21:00:09 -05:00
Axel Kohlmeyer ff7110028b
make doc of pair style mm3/switch3/coulgauss/long consistent and complete 2020-01-11 19:16:34 -05:00
Axel Kohlmeyer 7ebddb6088
Merge pull request #1829 from lammps/rerun-example 
added rerun example dir
 2020-01-11 18:49:40 -05:00
Axel Kohlmeyer d7d1d57170
remove outdated txt files 2020-01-11 16:35:27 -05:00
Axel Kohlmeyer 9c207bb751
remove outdated .txt file for pair style meam/c 2020-01-11 16:20:13 -05:00
Axel Kohlmeyer 4f35682828
list added example folder in manual 2020-01-11 16:15:49 -05:00
Axel Kohlmeyer cb8313d947
document added warning for fix bond/create 2020-01-11 16:08:37 -05:00
Axel Kohlmeyer 8ac2da792c
fix typo in fix ave/atom docs 2020-01-06 16:18:23 -05:00
Axel Kohlmeyer 1be8109618
Merge pull request #1798 from martok/meamc-dec19 
Collected MEAM/C additions
 2020-01-06 15:07:08 -05:00
Richard Berger 8030ff255d
Merge pull request #1794 from yafshar/master 
Certificate Verification
 2019-12-12 13:24:21 -07:00
Yaser Afshar b0d0037f50 Certificate Verification 
if SSL report an error ("certificate verify failed") during the
handshake and thus refuses further communication with that server,
you can specify your own CA cert path by setting the environment
variable CURL_CA_BUNDLE to the path of your choice.
 2019-12-12 12:57:34 -06:00
Richard Berger e0a771d5cb Remove outdated package.txt 2019-12-10 13:46:30 -05:00
Richard Berger e08ba3f11e Merge branch 'master' into library_interface_update 2019-12-03 12:51:17 -05:00
Sebastian Hütter ce05ed4cca MEAM/C: infer z parameter from lattice structure, eliminates possible user mistakes 2019-12-03 18:06:34 +01:00
Richard Berger 73a4c58ba1 Merge branch 'master' into doc_command_tables 2019-12-01 15:40:52 -05:00
Richard Berger 3ce020eab2
Merge pull request #1779 from athomps/compute-snap 
Compute snap
 2019-12-01 12:52:22 -07:00
Richard Berger 3611a75ce0
Merge pull request #1771 from julient31/zeeman-rework 
Adding test examples for the SPIN package and correcting some bugs
 2019-12-01 09:10:25 -07:00
Richard Berger 5c93b6ad6f Update docs: compute_spin, fix_precession_spin, pair_spin_exchange, pair_spin_neel 2019-11-27 15:17:11 -05:00
julient31 1f83c7d037 Commit JT 112719 
- correcting 'neighbours' in doc
- modifying README is src/SPIN
 2019-11-27 06:26:34 -07:00
Axel Kohlmeyer 3bd3c7a196
remove compute head/flux txt style docs as it is out of sync with the rst version 2019-11-26 14:48:08 -05:00
Axel Kohlmeyer 3b6a42dc79
clarify the impact of the lack of potential energy in pair style agni 2019-11-26 14:46:32 -05:00
Axel Kohlmeyer a171efa149
Resolve merge conflict by merging in master and recreating Commands_compute.rst 2019-11-26 08:20:42 -05:00
Aidan P. Thompson 2e4f514d40 Fixed some minor errors and omissions 2019-11-25 14:32:37 -07:00
Richard Berger 2c33b5589d Remove txt/Commands*.txt 2019-11-24 18:12:24 -07:00
julient31 8bca0b13f1 Commit2 JT 112219 
- correcting issue in src/SPIN/atom_vec_spin.cpp (inconsistency packing/unpacking hybrid)
- rerunning all examples with corrections of former commit
 2019-11-22 16:29:37 -07:00