|
|
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 |
|
|
|
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 |
|
