Commit Graph

7403 Commits

Author SHA1 Message Date
0f89a8b2ca explicit special_bonds commands for 1-2 coul weight equal to zero 2023-07-11 10:42:26 -06:00
cb27cb644f Merge remote-tracking branch 'github/develop' into collected-small-fixes 2023-07-10 13:11:24 -04:00
254afdd938 Merge pull request #3849 from jibril-b-coulibaly/doclink
fix typo for broken links in doc
2023-07-10 13:10:38 -04:00
469ffc7aba Merge pull request #3845 from ndtrung81/dielectric-updates2
Update and bugfix for the DIELECTRIC package
2023-07-10 11:50:23 -04:00
55343d715c update URL 2023-07-09 21:39:51 -04:00
60b45f9766 correct error message 2023-07-09 18:01:19 -06:00
0718114a67 fix typo for broken links in doc 2023-07-09 17:43:39 -06:00
6a8ca34ce8 Merge pull request #3843 from dsbolin/gran_heat
Minor bug fix and enhancements for granular heat transfer
2023-07-06 21:09:23 -04:00
a3b9914f62 make error messages consistent with keyword values yes/no. Allow coul weight for 1-2 bonds to be zero for break no to eliminate bonded atoms from neighbor list when bonds cannot break 2023-07-06 17:48:49 -06:00
3e4b66378a typo 2023-07-06 14:06:31 -04:00
55b7b3d999 whitespace fixes 2023-07-06 14:03:07 -04:00
b66a5cd225 fix another typo 2023-07-06 13:31:00 -04:00
cac8247383 Modified doc page for pair granular to include flux as extra pairwise quantity 2023-07-06 11:19:22 -06:00
6e41ac7ead fix typo 2023-07-06 09:14:00 -07:00
02845483d2 add gravity keyword info to fix rigid doc page 2023-07-06 09:08:15 -07:00
afe2226797 Merge pull request #3830 from akohlmey/collected-small-fixes
Collected small changes and fixes
2023-07-06 00:39:42 -04:00
ad14862cd0 Merge pull request #3827 from jtclemm/BPM
Bugfix and documentation corrections for BPM+Granular packages
2023-07-06 00:35:58 -04:00
78f4e4f1a1 Update compute_stress_mop.rst 2023-07-05 16:51:41 +03:00
3c09aa26f9 Merge branch 'develop' of github.com:lammps/lammps into kk_update_4.0 2023-07-03 16:35:57 -06:00
677ff15740 Gran/heat changes 2023-07-03 11:52:41 -06:00
ef40448df6 update docs for CMake 3.16 requirement 2023-07-01 03:01:37 -04:00
c1213c5222 use dynamic/dof and extra/dof consistently. remove compatibility note in docs. 2023-06-30 16:27:07 -04:00
a50993dac1 update docs for create_bonds 2023-06-28 10:06:31 -04:00
906eecdbd7 clarify the temperature computation in compute temp 2023-06-27 17:53:06 -04:00
fc365d3d5f Merge branch 'develop' into always-exceptions 2023-06-22 10:53:36 -04:00
c5d9f901d9 Merge pull request #3829 from JohnLucas1/fixpair_bugfix
fix pair bugfix
2023-06-19 15:13:39 -04:00
542aa203da correct typo in fix pair documentation 2023-06-18 20:42:45 -05:00
753a0bd386 remove obsolete Fortran interfaces from examples/COUPLE folder 2023-06-17 18:31:11 -04:00
32e4aac9f7 Update fix_reaxff_species.rst 2023-06-16 21:34:06 -04:00
2a432bdaf1 Clarifying output as sqrt 2023-06-16 16:32:15 -06:00
ca636ffa7d Adding d2min doc 2023-06-16 16:28:48 -06:00
a1513a7d3b rattler documentation 2023-06-15 23:06:50 -06:00
2fbaeb4fc7 Fixing merge conflict 2023-06-15 16:03:30 -06:00
2905016f9a Updating to develop 2023-06-15 16:00:48 -06:00
25f5e74e9a updating args and D2min calculation in nonaffine fix 2023-06-15 15:51:59 -06:00
9673c22cc7 Merge pull request #3818 from akohlmey/next_release
Update version strings for upcoming release
2023-06-15 14:30:40 -04:00
b8dda7ebfe documentation formatting and spelling fixes 2023-06-14 22:08:30 -04:00
4d02c6f26f update version strings for upcoming release 2023-06-14 21:50:27 -04:00
162f243ebc Merge pull request #3797 from Compizfox/develop
Include bond forces in `compute stress/cartesian`
2023-06-14 21:31:41 -04:00
618fa815cc Merge pull request #3812 from wmbrownIntel/intel_fixes_2023Jun
Misc Fixes for Intel Package
2023-06-14 18:21:34 -04:00
6de50fbd33 Adding iso options to fix deform 2023-06-14 13:39:24 -06:00
96b8bbbdc9 Merge branch 'develop' into develop 2023-06-14 15:09:51 +02:00
e6cd79e0e9 Fix doc links 2023-06-14 15:04:46 +02:00
8aeb059ce8 Update doc/src/compute_stress_cartesian.rst
Co-authored-by: Axel Kohlmeyer <akohlmey@gmail.com>
2023-06-14 15:03:35 +02:00
233fb67eaa Reverted the zero net induced charge constraint, updated the fix polarize doc page for q_scaled and q 2023-06-14 00:28:24 -05:00
2ba83a4d8f add versionadded keyword 2023-06-12 15:31:37 -04:00
82cea7a546 small doc updates for added pppm_table keyword 2023-06-12 15:31:03 -04:00
90416faf0a Merge branch 'develop' into intel_fixes_2023Jun 2023-06-12 15:18:08 -04:00
0e7d91b611 add missing documentation 2023-06-10 07:45:52 -06:00
4cad18a057 document Fortran version of lammps_last_thermo 2023-06-08 19:59:47 -04:00