|
|
7be7ffbaf1
|
revert renamin of cariable chi to chi0 in improper_cossq.cpp
|
2025-02-11 16:15:52 +02:00 |
|
|
|
c263c9a534
|
revert changes in improper_cossq.h
|
2025-02-11 16:12:34 +02:00 |
|
|
|
afaff7199b
|
revert changes in improper_cossq_omp.cpp - they are not needed
|
2025-02-11 16:11:52 +02:00 |
|
|
|
b94d82d7b1
|
rename k anc chi in fix_adapt.rst
|
2025-02-11 16:04:33 +02:00 |
|
|
|
ed9b22cb0e
|
rename k and chi in improper-distance.yaml
|
2025-02-11 16:03:42 +02:00 |
|
|
|
a708a50468
|
rename k and chi in improper_distance.cpp
|
2025-02-11 16:03:03 +02:00 |
|
|
|
1d974a51c0
|
Update fix_adapt.rst
|
2025-02-11 16:00:39 +02:00 |
|
|
|
fb6a1ad603
|
rename kw to k in improper-inversion_harmonic.yaml
|
2025-02-11 15:58:47 +02:00 |
|
|
|
8bba7ff10f
|
rename kw to k in improper_inversion_harmonic.cpp
|
2025-02-11 15:58:07 +02:00 |
|
|
|
757eb8bf58
|
Update fix_adapt.rst
|
2025-02-11 15:53:58 +02:00 |
|
|
|
c66ca60f65
|
rename kw to k in improper-umbrella.yaml
|
2025-02-11 15:53:14 +02:00 |
|
|
|
94dd03d43c
|
rename kw to k in improper_umbrella.cpp
|
2025-02-11 15:52:20 +02:00 |
|
|
|
5032436312
|
Update fix_adapt.rst
|
2025-02-11 15:49:46 +02:00 |
|
|
|
c9b4689167
|
rename sign and multiplicity in improper-cvff.yaml
|
2025-02-11 15:48:50 +02:00 |
|
|
|
bac4eec31b
|
rename sign and multplicity in improper_cvff.cpp
|
2025-02-11 15:47:58 +02:00 |
|
|
|
a320a52804
|
Update fix_adapt.rst
|
2025-02-11 15:44:55 +02:00 |
|
|
|
11b95655f8
|
rename k0 to k in improper-class2.yaml
|
2025-02-11 15:42:30 +02:00 |
|
|
|
7e0f067b74
|
rename k0 to k in improper_class2.cpp
|
2025-02-11 15:41:22 +02:00 |
|
|
|
1d3ad36e85
|
add support for visualization plane regions
|
2025-02-11 07:40:42 -05:00 |
|
|
|
17797e4f74
|
tiny cr
|
2025-02-11 13:56:53 +02:00 |
|
|
|
252bd9aa9d
|
must close "owned" file pointer if a different one is is assigned
|
2025-02-11 05:13:07 -05:00 |
|
|
|
08553a7272
|
apply safe file pointer
|
2025-02-10 22:48:55 -05:00 |
|
|
|
c42650257f
|
move AutoClose class to separate header and rename to SafeFilePtr
|
2025-02-10 22:27:09 -05:00 |
|
|
|
f8b13b21ec
|
Merge branch 'develop' into collected-small-changes
|
2025-02-10 17:57:49 -05:00 |
|
|
|
c41c4086ca
|
Merge pull request #4468 from akohlmey/add-region2vmd-command
Add a new region2vmd command for visualizing regions with VMD
|
2025-02-10 16:57:44 -05:00 |
|
|
|
18cd31d811
|
Update fix_adapt.rst
|
2025-02-10 20:22:32 +02:00 |
|
|
|
e88946935c
|
rename chi to theta0 in extract improper_ring.cpp
|
2025-02-10 20:19:13 +02:00 |
|
|
|
dc83bd3084
|
rename chi to theta0 in improper-ring.yaml
|
2025-02-10 20:18:13 +02:00 |
|
|
|
0b55587b1d
|
add error 10 URL and text
|
2025-02-10 10:56:04 -07:00 |
|
|
|
7ae9ef75d8
|
Update fix_adapt.rst
|
2025-02-10 19:20:26 +02:00 |
|
|
|
70acd78048
|
change chi to d0 in improper_distharm.cpp
|
2025-02-10 19:18:58 +02:00 |
|
|
|
f738690cb5
|
change chi to d0 in improper_distharm.h
|
2025-02-10 19:16:47 +02:00 |
|
|
|
2b46abc31c
|
change chi to d0 in improper-distharm.yaml
|
2025-02-10 19:15:58 +02:00 |
|
|
|
0c80ec5e0d
|
change chi to chi0 in improper_harmonic_kokkos.cpp
|
2025-02-10 19:06:14 +02:00 |
|
|
|
3f5c54e362
|
change chi to chi0 in improper_harmonic_omp.cpp
|
2025-02-10 19:00:55 +02:00 |
|
|
|
7fe804d19d
|
change chi to chi0 in improper_cossq_omp.cpp
|
2025-02-10 19:00:21 +02:00 |
|
|
|
c9bd1a7877
|
add url to improper_coeff messages
|
2025-02-10 09:59:04 -07:00 |
|
|
|
0f66e66529
|
add url to dihedral_coeff messages
|
2025-02-10 09:57:04 -07:00 |
|
|
|
8025a494d9
|
add url to angle_coeff messages
|
2025-02-10 09:49:53 -07:00 |
|
|
|
5251ba1465
|
change chi to chi0 in fix_adapt.rst
|
2025-02-10 18:45:40 +02:00 |
|
|
|
e90d5133cc
|
change chi to chi0 in improper_cossq.cpp
|
2025-02-10 18:44:40 +02:00 |
|
|
|
9bce6662b4
|
change chi to chi0 in improper_cossq.h
|
2025-02-10 18:42:55 +02:00 |
|
|
|
8dfb967acc
|
change chi to chi0 in improper-cossq.yaml
|
2025-02-10 18:42:07 +02:00 |
|
|
|
261cc13f99
|
Update fix_adapt.rst
|
2025-02-10 18:39:13 +02:00 |
|
|
|
f6e39d14b0
|
change chi to chi0 in improper_harmonic.cpp
|
2025-02-10 18:37:47 +02:00 |
|
|
|
0a4eea6aa0
|
add url to bond_coeff messages
|
2025-02-10 09:36:22 -07:00 |
|
|
|
ec0afc3fdf
|
change chi to chi0 in improper_harmonic.h
|
2025-02-10 18:35:37 +02:00 |
|
|
|
6abdedc75b
|
change chi to chi0 in improper-harmonic.yaml
|
2025-02-10 18:34:15 +02:00 |
|
|
|
75fd76aaa6
|
update text for MOLECULE package
|
2025-02-10 09:26:08 -07:00 |
|
|
|
9e249c9c57
|
Merge branch 'bosonic-pimd-langevin' of https://github.com/yotamfe/lammps into bosonic-pimd-langevin
|
2025-02-10 17:37:05 +02:00 |
|
