|
|
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 |
|
|
|
0a4eea6aa0
|
add url to bond_coeff messages
|
2025-02-10 09:36:22 -07:00 |
|
|
|
32d0bf1bee
|
update all simple coeff messages
|
2025-02-03 12:13:52 -07:00 |
|
|
|
aeeacf0442
|
Update extract of bond_class2.cpp
|
2024-10-11 10:42:01 +02:00 |
|
|
|
7f0ff96324
|
add extract() function to angle_class2.cpp
|
2024-09-20 19:37:12 +02:00 |
|
|
|
b49f3412df
|
add extract() function to angle_class2.h
|
2024-09-20 19:36:35 +02:00 |
|
|
|
f2102b76f2
|
cosmetic
|
2024-08-28 11:09:47 -04:00 |
|
|
|
a48da5b1e4
|
move ewald_const.h to src and apply it to a few more files
|
2024-02-13 08:02:32 -05:00 |
|
|
|
ad855ad7ea
|
remove unused constants
|
2024-02-05 20:26:23 -05:00 |
|
|
|
12422ff510
|
replace defines with static constexpr declarations
|
2024-01-21 15:53:35 -05:00 |
|
|
|
6069e8cb14
|
Merge pull request #3684 from jrgissing/encode_improper_symmetries
Encode improper symmetries
|
2023-03-16 12:33:15 -04:00 |
|
|
|
53056f47ed
|
encode improper symmetries
|
2023-03-09 22:04:08 -05:00 |
|
|
|
85f3d6eaef
|
Implement born_matrix in pair_lj_class2_coul_cut.cpp
|
2023-03-01 10:24:22 +02:00 |
|
|
|
e59d08ee8b
|
Include method declaration in pair_lj_class2_coul_cut.h
|
2023-03-01 10:22:07 +02:00 |
|
|
|
a875ef77cd
|
Implement born_matrix in pair_lj_class2.cpp
|
2023-02-18 20:23:40 +02:00 |
|
|
|
863aec4c79
|
Include method declaration in pair_lj_class2.h
|
2023-02-18 20:21:44 +02:00 |
|
|
|
864488adbb
|
Implement analytical expression for born_matrix in bond_class2.cpp
|
2023-02-14 09:39:39 +02:00 |
|
|
|
115c09ce23
|
Include method declaration in bond_class2.h
|
2023-02-14 09:37:12 +02:00 |
|
|
|
27da716852
|
getting out of the insurance business :-)
|
2023-01-23 16:45:41 -05:00 |
|
|
|
2132b1d904
|
update developer reference text
|
2022-10-24 11:08:26 -04:00 |
|
|
|
cccf3f6f78
|
change email for contacting LAMMPS developers, add to homepage checker
|
2022-10-20 20:36:03 -04:00 |
|
|
|
67a210e6d8
|
no need to include pair.h
|
2022-09-25 06:41:51 -04:00 |
|
|
|
4bcd43ff90
|
correct pair coeff mixing diagnostic for CLASS2 pair styles
|
2022-08-28 05:55:33 -04:00 |
|
|
|
6100e1fafb
|
code tweaks and update of examples
|
2022-07-07 14:33:19 -06:00 |
|
|
|
929734ce45
|
Merge remote-tracking branch 'github/develop' into amoeba-ak
# Conflicts:
# doc/src/Commands_pair.rst
# src/memory.h
|
2022-04-28 20:08:18 -04:00 |
|
|
|
78c10bac4a
|
clang-format update
|
2022-04-23 13:08:11 -04:00 |
|
|
|
115962db88
|
Merge branch 'develop' into remove-error-docs-in-header
|
2022-04-23 12:46:54 -04:00 |
|
|
|
79a7d2abf6
|
remove error docs from header files
|
2022-04-22 23:31:15 -04:00 |
|
|
|
f8f2b9542e
|
sync with current develop
|
2022-04-18 17:29:23 -06:00 |
|
|
|
69d9c5187e
|
refactor group access, enable and apply clang-format
|
2022-04-15 15:29:43 -04:00 |
|
|
|
200b4f13c7
|
use dynamic cast instead of c-style cast when casting from base type to derived class
|
2022-04-10 18:18:06 -04:00 |
|
|
|
d0af0fa456
|
turn off terms for both amoeba and hippo
|
2022-04-08 16:51:08 -06:00 |
|
|
|
25d8950f94
|
Merge branch 'develop' into neigh-request-refactor
|
2022-03-15 11:39:45 -04:00 |
|
|
|
0658844e04
|
first working version of fix pitorsion
|
2022-03-10 16:00:05 -07:00 |
|
|
|
dfbeedfded
|
convert more neighbor list requests to the new API
|
2022-03-08 12:39:05 -05:00 |
|
|
|
2a0e66164e
|
enable and apply clang-format
|
2022-03-01 21:06:19 -05:00 |
|
|
|
06beb28d7d
|
Apply override to Pair classes
|
2022-01-21 16:13:49 -05:00 |
|
|
|
0d4bbf60e6
|
Apply override to Dihedral classes
|
2022-01-21 12:48:11 -05:00 |
|
|
|
557e25d6fb
|
Apply override to Bond classes
|
2022-01-20 18:00:16 -05:00 |
|
|
|
4e89488f27
|
Apply override to Angle classes
|
2022-01-20 17:53:38 -05:00 |
|
|
|
7387643b87
|
Apply override to Improper classes
|
2022-01-20 17:36:43 -05:00 |
|
|
|
97b5651633
|
minor correction to angle class2
|
2021-12-20 10:33:05 -07:00 |
|
|
|
bca99f684f
|
update list and order of include files from include-what-you-use analysis
|
2021-09-18 14:16:48 -04:00 |
|
|
|
385220fd4b
|
format changes
|
2021-09-17 22:50:15 -04:00 |
|
|
|
09c19a936b
|
update URLs in source code and manual
|
2021-05-24 14:18:20 -04:00 |
|
|
|
7fcd449864
|
apply clang-format to all headers with some exceptions
|
2021-05-14 19:16:07 -04:00 |
|
|
|
d8291eea7b
|
Merge branch 'master' into prepare-clang-format
# Conflicts:
# src/MOLECULE/bond_fene.h
# src/MOLECULE/bond_fene_expand.h
|
2021-05-11 21:49:48 -04:00 |
|
|
|
d1941392d3
|
disable clang-format for all existing .cpp files (for now)
|
2021-05-05 23:53:38 -04:00 |
|
