Commit Graph

7403 Commits

Author SHA1 Message Date
16a254f6bd Update Errors_messages.txt 2019-05-30 23:29:43 -06:00
8b169d97f5 update documentation for updates to fix restarting 2019-05-31 00:58:10 -04:00
edecd2b760 fix typo and update list of false positives for updated docs 2019-05-30 22:19:47 -04:00
df1308ad92 add kim_style error messages to Errors_messages.txt doc file 2019-05-30 21:58:18 -04:00
24a63f0f31 update kim_style command semantics as discussed in PR #1440
this also adds documentation of error messages in the kim_style header
2019-05-30 21:51:13 -04:00
02e7dd5716 also allow %e in format variables of suffix 2019-05-30 14:52:26 -04:00
1a5c3c6dcb add check that allows only %f and %g conversions in variable format strings 2019-05-30 14:46:07 -04:00
daac3f7102 Merge pull request #1419 from akohlmey/report-uninstalled-pkg-style
Improved error messages when a style is not found
2019-05-30 06:34:56 -04:00
fec2f8f69b update docs for fully supporting hybrid styles 2019-05-29 14:39:45 -04:00
d717101e94 Merge branch 'master' of https://github.com/lammps/lammps into team_opt 2019-05-28 14:02:22 -06:00
e133c60ff5 bond/react docs: better English 2019-05-26 20:28:28 -06:00
97be57be7b additional topology overflow check for reactions 2019-05-26 15:53:49 -06:00
c2a200fe85 A function logfreq3(), for logarithmical spacing
Unlike logfreq(), this also allows for fractional ratios
Resolves #1471
2019-05-26 14:00:21 +05:30
e82e1c695a correct links in package documentation 2019-05-24 19:45:48 -04:00
fc8a639d58 add documentation for kim_style command. update a few KIM related doc files 2019-05-24 19:42:16 -04:00
cfad0634ac Merge pull request #1465 from akohlmey/collected-minor-changes
Collected small changes and bugfixes
2019-05-21 16:55:19 -04:00
95ab056576 Add PPPM dipole reference 2019-05-21 10:07:41 -06:00
82b50706bd Commit2 JT 052019
- some corrections in the examples
- deleted an old doc files (now redundant)
2019-05-20 22:09:59 -06:00
5f2f7d1575 Merge branch 'pppm_spin' of github.com:julient31/lammps into pppm_spin 2019-05-20 21:35:52 -06:00
3e60ec9be1 Merge branch 'clean-master2' of github.com:julient31/lammps into pppm_spin 2019-05-20 21:35:16 -06:00
0349e9fee9 update/correct list of example folders 2019-05-20 15:08:33 -04:00
55116db8fb avoid segfault and print more meaningful error message with empty lines in coeff sections 2019-05-20 14:15:04 -04:00
e3823a521c remove leftover references to removed MEAM package 2019-05-18 15:36:13 -04:00
dc8b43a95f update docs and sources and for changes in this branch 2019-05-18 15:16:10 -04:00
35bb2ac2a3 fix typo 2019-05-18 09:25:20 -04:00
fbb78e7b78 Commit JT 051719
- removed qsymp pair style
- cleaned doc (pair/spin/diole and kspace_style)
- cleaned kspace .cpp/h files
2019-05-17 15:04:14 -06:00
e2ed9330b7 Merge branch 'master' into team_opt 2019-05-16 12:31:26 -06:00
fb8d31422d fix typo 2019-05-16 09:06:17 -04:00
27a2d0cbd4 add option to restrict coordination number by group 2019-05-16 08:55:03 -04:00
0c0b106924 Commit2 JT 051519
- started doc pair_spin_dipole.txt
- renamed all pair/spin/dipole
- created and tested example pair/spin/dipole/cut
2019-05-15 20:49:05 -06:00
267782d689 Merge pull request #1459 from akohlmey/next-patch-release
Step version string for next patch release
2019-05-14 21:30:28 -04:00
fd168068a1 Merge branch 'clean-master2' of github.com:julient31/lammps into pppm_spin
Conflicts:
	src/SPIN/fix_nve_spin.h
2019-05-14 17:41:58 -06:00
f2b293d93b Merge pull request #1460 from akohlmey/collected-small-changes
Some more small changes
2019-05-14 17:55:36 -04:00
6e842ba84a fix typo 2019-05-14 17:36:26 -04:00
30dc7f70b5 correct repeated words in docs 2019-05-14 17:13:46 -04:00
67532684f9 add missing formatting info 2019-05-14 14:02:54 -06:00
091dbfa265 Merge pull request #1457 from julient31/fix_cubic_aniso
Adding a cubic anisotropy in the SPIN package, documentation corrections
2019-05-14 15:08:21 -04:00
d8fb17e2cb Step version string for next patch release 2019-05-14 10:01:43 -04:00
322c244bec Merge pull request #1456 from akohlmey/fix-mapping-for-KC-etc
Fix element mapping and a few other issues for interlayer potentials
2019-05-13 21:12:58 -04:00
52e3aeab33 revert incorrect changes in commands_list.txt 2019-05-13 21:05:26 -04:00
8e18f2bf7e Commit2 JT 051319
- corrected doc issues
2019-05-13 17:32:44 -06:00
11f223416c Commit JT 051319
- added a cubic anisotropy in fix_precession_spin
- added associated doc and examples
- corrected neb/spin commands in doc/src/
- added tools/spin/ description
2019-05-13 16:59:39 -06:00
805cc18b2d Merge branch 'master' into e3b 2019-05-12 22:22:31 -05:00
c581e9349a update interlayer potential examples for now requiring CH.rebo potential file with rebo pair style 2019-05-11 16:46:21 -04:00
a7c9560dc1 Merge pull request #1453 from mjwen/pair_drip
add pair style drip
2019-05-10 20:44:28 -04:00
2bc089db27 mis-labeling of some rigid fixes 2019-05-10 07:42:11 -06:00
47cf17e5c8 Merge branch 'master' into pair_drip 2019-05-09 12:19:41 -04:00
928600a878 Merge pull request #1452 from akohlmey/github-rebo-bugfix
Resubmission of REBO bugfix for easier review
2019-05-09 12:18:05 -04:00
7b2d526f86 Merge pull request #1448 from akohlmey/collected-small-changes
Collected small changes and bugfixes
2019-05-09 12:17:19 -04:00
0034473e66 update legacy pdf manual input config 2019-05-08 10:19:21 -04:00