|
|
a7cfd4b934
|
Merge branch 'develop' into rheo
|
2024-11-28 10:19:35 -07:00 |
|
|
|
7c87874f5e
|
improve expanded fix external docs
|
2024-11-27 01:55:11 -05:00 |
|
|
|
ef4b070e6f
|
fix typo
|
2024-11-27 01:45:42 -05:00 |
|
|
|
e9073e4e1d
|
Missed changes
|
2024-11-26 16:19:19 -07:00 |
|
|
|
8aba26bd71
|
doc fixes
|
2024-11-26 15:55:08 -07:00 |
|
|
|
3f78ee72c6
|
get access to the applied external force from the fix
|
2024-11-24 22:25:38 -05:00 |
|
|
|
e4683c3134
|
typo in equation
|
2024-11-22 14:40:45 -07:00 |
|
|
|
10c429fe21
|
Separating background pressure from EoS definition
|
2024-11-22 14:37:47 -07:00 |
|
|
|
4296db4991
|
add link with more explanation to the illegal variable errors
|
2024-11-20 11:15:12 -05:00 |
|
|
|
c50a8d83d1
|
New release date 19 November 2024
|
2024-11-19 02:13:54 -05:00 |
|
|
|
2ac0d065a7
|
step version strings for next release
|
2024-11-19 02:05:49 -05:00 |
|
|
|
f7b87a21c7
|
apply special treatment for fix colvars/kk as suggested by @stanmoore1
|
2024-11-16 11:14:18 -05:00 |
|
|
|
b3f88da939
|
document KOKKOS restriction of fix spring/self
|
2024-11-15 15:22:19 -05:00 |
|
|
|
4dd1448dd0
|
support providing spring constant as equal or atom style variable
|
2024-11-15 14:12:19 -05:00 |
|
|
|
0f9f80ad45
|
update for fix colvars/kk
|
2024-11-14 15:32:07 -05:00 |
|
|
|
e3e502f095
|
add note that pair_coeff settings used for fix adapt must be set explicitly
|
2024-11-14 15:26:46 -05:00 |
|
|
|
5928389c5e
|
Merge pull request #4312 from navlalli/qtpie
Add fix qtpie/reaxff
|
2024-11-13 07:42:07 -05:00 |
|
|
|
2d2bc029a4
|
Merge branch 'develop' into qtpie
|
2024-11-12 11:37:40 -08:00 |
|
|
|
5673375d21
|
Add more related commands to docs
|
2024-11-12 12:32:37 -07:00 |
|
|
|
cb5bad7ece
|
Dropping obsolete keyword
|
2024-11-11 21:22:48 -07:00 |
|
|
|
33128323d8
|
Adding shift example to rheo doc, clarifying speed of sound exception
|
2024-11-11 16:31:09 -07:00 |
|
|
|
9e0047ff06
|
Documenting new multi-type shifting options
|
2024-11-11 15:50:01 -07:00 |
|
|
|
15767903b2
|
testing new argument description for fix rheo
|
2024-11-11 11:51:59 -07:00 |
|
|
|
59af94b8e3
|
Updating rheo citation information
|
2024-11-11 11:42:50 -07:00 |
|
|
|
f84b9f350e
|
Merge branch 'develop' of https://github.com/lammps/lammps into alphataubio-kokkos-fixes
|
2024-11-08 14:53:37 -08:00 |
|
|
|
a445545ffb
|
Merge pull request #4371 from evoyiatzis/patch-2
fix typo in compute_temp_partial.rst
|
2024-11-08 09:30:26 -07:00 |
|
|
|
e84c45c6e7
|
Fix whitespace
|
2024-11-08 10:38:49 +00:00 |
|
|
|
95899b53b8
|
Add fix qtpie/reaxff to pair_style reaxff docs
|
2024-11-08 10:26:47 +00:00 |
|
|
|
572be91b76
|
fix typo in compute_temp_partial.rst
|
2024-11-06 11:27:45 +01:00 |
|
|
|
a93a930f2f
|
Updating developer comm doc page to include bond and optional args
|
2024-11-05 15:53:48 -07:00 |
|
|
|
95509c4ef0
|
Referencing other methods compatible with BPM package
|
2024-11-05 15:47:59 -07:00 |
|
|
|
c1ac0cea1d
|
More rheo pressure EOS, allow variable cs
|
2024-11-01 17:04:32 -06:00 |
|
|
|
c057b36c15
|
Merge branch 'develop' into alphataubio-kokkos-fixes
|
2024-10-30 21:50:36 -04:00 |
|
|
|
9e25c8610c
|
Merge branch 'develop' into rheo
|
2024-10-30 08:24:54 -06:00 |
|
|
|
47e9a7fe79
|
Typo + style changes in rheo doc
|
2024-10-29 21:03:47 -06:00 |
|
|
|
6d634dc646
|
Merge pull request #4359 from jtclemm/BPM
Adding new force options to BPM package
|
2024-10-29 21:31:03 -04:00 |
|
|
|
a5ab8be0a2
|
Clarify restriction on periodic cell dimensions
|
2024-10-25 14:16:25 +01:00 |
|
|
|
56ac4aeedf
|
Merge branch 'develop' into alphataubio-kokkos-fixes
|
2024-10-24 12:12:12 -04:00 |
|
|
|
73c049459b
|
spelling
|
2024-10-23 21:10:34 -04:00 |
|
|
|
b682f52d11
|
fix typos
|
2024-10-23 21:07:39 -04:00 |
|
|
|
b810053d02
|
document restrictions for bonded interactions
|
2024-10-23 12:35:50 -04:00 |
|
|
|
81f71716ba
|
Merge branch 'develop' into BPM
|
2024-10-22 20:59:12 -04:00 |
|
|
|
1ec7ba547d
|
Merge branch 'develop' into alphataubio-kokkos-fixes
|
2024-10-22 14:47:19 -04:00 |
|
|
|
ec5dfcd0fb
|
remove note that was obsoleted 5 years ago
|
2024-10-22 09:50:30 -04:00 |
|
|
|
1678e2af28
|
adjusting howto text to reflect additional BPM/spring options.
|
2024-10-21 21:21:15 -06:00 |
|
|
|
4779cc44ef
|
documenting bpm anharmonic
|
2024-10-21 15:07:24 -06:00 |
|
|
|
baf1733b9a
|
documenting bpm multibody
|
2024-10-21 15:07:06 -06:00 |
|
|
|
34ab2f862a
|
small tweaks
|
2024-10-18 22:09:25 -04:00 |
|
|
|
f128abe002
|
improve OPLS description
|
2024-10-18 21:51:43 -04:00 |
|
|
|
2074b0c400
|
add check to allow only valid swaps between hybrid sub-styles and document it
|
2024-10-18 21:49:55 -04:00 |
|