484b7e6d33
must remove and respecify fix lb/fluid around reset_timestep command
2022-03-12 16:16:15 -05:00
9931323463
attempt to transparently download the missing data file with curl
2022-03-12 14:03:08 -05:00
888db4b0ef
update examples to standard lammps conventions
2022-03-09 18:13:45 -05:00
16449c3d11
fix merge conflicts for new version of lb/fluid and minor updates from develop branch on virtual functions and removed fix styles
2022-03-08 16:38:32 -05:00
8d5a59c0fa
Switched all command and class names from pressure to stress
2022-03-07 11:27:37 -07:00
e857b923bc
Added representative output to log files
2022-03-06 20:11:10 -07:00
2f5f36cff8
move examples to a more appropriate folder. add logfiles
2022-03-06 11:03:57 -05:00
8b627f92f0
address spelling and achor issues, and integrate into style overview tables
2022-02-16 08:10:29 -05:00
e541f006eb
replace copies of files with symbolic links
2022-02-16 06:34:31 -05:00
922b240678
Interlayer Potential for TMDs and Metal Surfaces
2022-02-12 06:05:11 +02:00
415476983d
Merge branch 'develop' into cg-dna
2022-01-26 19:31:48 +00:00
e22f62f6db
add some metadata for fix gle matrix files
2022-01-18 19:55:30 -05:00
ef13455d6b
add some metadata tags
2022-01-18 16:48:07 -05:00
1f81e2afad
Added duplication of stdout into logfile
2022-01-07 13:45:54 +00:00
3748ddb1ae
Merge branch 'lammps:develop' into cg-dna
2021-12-15 09:02:57 +00:00
6140503158
update local/density examples to follow conventions more closely
2021-12-10 08:50:58 -05:00
3fc0ea3e80
correct names of the pack/unpack routines for forward communication
2021-12-09 18:30:54 -05:00
a975d0506a
update examples for pair style local/density
2021-12-09 18:21:32 -05:00
ca8dddf002
upgrade of lb/fluid fix
...
This includes documentation files in the rst format in the doc/src directory, examples in the examples/PACKAGES/latboltz directory and source files in the src/LATBOLTZ directory.
2021-12-01 14:31:57 -05:00
d178a5ffa3
Extended test script
2021-11-17 13:12:44 +00:00
4d9cef823d
must use a soft core potential to avoid a singularity
2021-09-24 16:22:44 -04:00
661ec1acc3
fix typo
2021-08-17 21:55:22 -04:00
01503535f4
remove unused symlinks
2021-08-17 10:48:09 -04:00
75214f1eeb
Merge pull request #2857 from akohlmey/update-formatted-output
...
Modernize formatted output and string handling in packages
2021-07-30 12:50:25 -04:00
c49a533ad9
reformat, simplify, add reference log files
2021-07-29 15:40:43 -04:00
b9ab0eb607
fix broken symbolic links
2021-07-28 21:32:52 -04:00
f192102da9
move examples away from USER-MISC now that the package folder is gone
2021-07-24 20:53:23 -04:00
d16f751413
Merge branch 'master' into package-reorganization2
2021-07-21 10:23:04 -04:00
8a4820a033
add data/units comments to example quip potential files
2021-07-20 19:31:52 -04:00
52156ccb35
Merge branch 'master' into package-reorganization2
2021-07-19 11:07:42 -04:00
15b3b6445e
Updated tests and documentation, added warning message
2021-07-19 11:22:06 +01:00
b7a17dc25d
Added warning message in documentation and dsDNA ring test in examples
2021-07-16 12:57:21 +01:00
0f0059269d
Modified data_bonds_post() and calling structure
2021-07-15 13:36:40 +01:00
6571a84884
move some styles around
2021-07-09 16:54:00 -04:00
46d5d9724a
move interlayer potentials to their own package
2021-07-07 15:52:53 -04:00
39bd342913
Resolved conflict
2021-07-07 10:04:05 +01:00
4b81802ae8
Created new feature branch for PR as per request
2021-07-05 16:07:40 +01:00
430e7e962f
Merge branch 'master' into dielectric-updates
...
# Conflicts:
# src/DIELECTRIC/Install.sh
# src/DIELECTRIC/pppm_disp_dielectric.cpp
# src/DIELECTRIC/pppm_disp_dielectric.h
2021-07-03 15:27:57 -04:00
58196d57f1
New package DPD-BASIC with pair styles dpd, dpd/tstat, dpd/ext, dpd/ext/tstat
2021-07-01 00:51:55 -04:00
16002ddb54
rename some more example folders
2021-06-29 21:48:57 -04:00
9d208c9ebd
rename some examples folders
2021-06-29 20:25:18 -04:00
878795e64a
bulk rename of remaining USER- packages
2021-06-29 20:12:59 -04:00
c085e55695
rename USER-SMD package to MACHDYN
2021-06-29 17:19:39 -04:00
8bf6805e1d
rename USER-LB to LATBOLTZ
2021-06-29 17:07:14 -04:00
efaec31a84
rename USER-CGDNA and USER-CGSDK to CG-DNA and CG-SDK
2021-06-29 15:28:27 -04:00
4342987043
rename example folders
2021-06-29 11:23:47 -04:00
