|
|
916e5a81fb
|
more fix::init() checks and some clang-formatting for NH style classes
|
2024-12-27 08:44:02 -05:00 |
|
|
|
fbba20fa89
|
validate that a non-temperature compute has not been replaced without fix_modify
|
2024-12-23 20:24:24 -05:00 |
|
|
|
ee58003800
|
update electron radius velocities and radii in EFF NH fixes analog to fix nve/eff
|
2024-03-18 23:37:00 -04:00 |
|
|
|
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 |
|
|
|
8b89c330e6
|
make removed DOF computation large system compatible
|
2024-01-10 15:32:02 -05:00 |
|
|
|
603d7d28fd
|
make constants and functions static so there are no namespace conflicts with multiple files including it
|
2023-08-21 05:23:42 -04:00 |
|
|
|
564a8e88c1
|
use blanks on both sides of comparison operators not only one, remove blanks next to parenthesis
|
2023-07-11 10:31:16 -04:00 |
|
|
|
3a55a374a9
|
address compilation failures
|
2022-12-31 22:10:32 -05:00 |
|
|
|
8016378241
|
Extended to packages
|
2022-12-31 19:49:25 -07:00 |
|
|
|
13e5b12f21
|
Merge pull request #3555 from stanmoore1/kk_atom_vec
Refactor Kokkos `AtomVec`
|
2022-12-14 13:43:07 -05:00 |
|
|
|
3b2376d0bb
|
use virtual inheritance consistently for all atom styles
|
2022-12-12 20:37:30 -05:00 |
|
|
|
ebcb702e95
|
remove dead code detected by clang 15
|
2022-12-12 07:07:06 -05:00 |
|
|
|
b30ce3ff32
|
next round of IWYU updates
|
2022-12-12 01:07:46 -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 |
|
|
|
4f0caca9d8
|
make sure data is initialized
|
2022-09-22 13:05:32 -04:00 |
|
|
|
67f6adebb7
|
whitespace fixup with dynamic casts
|
2022-09-10 13:26:38 -04:00 |
|
|
|
7e6bd892ed
|
apply clang-format
|
2022-09-10 03:29:32 -04:00 |
|
|
|
2c0eb10d62
|
label electron spin with "espin" instead of "spin" but be backward compatible
|
2022-08-30 06:20:53 -04:00 |
|
|
|
1d89c3f5d7
|
Fixed remaining BibTeX entries, checked all entries in issue #2597
|
2022-08-13 13:45:39 -05:00 |
|
|
|
29e1595fb4
|
Updates to BibTeX syntax for anything that needed it that I caught and fixes to address Issue #2597
|
2022-08-13 04:51:54 -05:00 |
|
|
|
47564ab6bc
|
Merge branch 'develop' into region-lookup-refactor
|
2022-04-22 22:11:41 -04:00 |
|
|
|
aa4787f604
|
complete region handling refactor
|
2022-04-16 00:17:39 -04:00 |
|
|
|
b16d48aa41
|
"stringify" and "vectorize" processing of per-atom attributs in AtomVec classes
|
2022-04-14 11:06:10 -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 |
|
|
|
55f8bf9c51
|
adapt some more styles to use the new neighbor list request API
|
2022-03-08 15:27:37 -05:00 |
|
|
|
06beb28d7d
|
Apply override to Pair classes
|
2022-01-21 16:13:49 -05:00 |
|
|
|
ff3f762499
|
Apply override to Fix classes
|
2022-01-21 14:45:53 -05:00 |
|
|
|
f83271aa40
|
Apply override to Compute classes
|
2022-01-21 13:23:36 -05:00 |
|
|
|
b45a6d7720
|
Apply override to AtomVec classes
|
2022-01-19 17:31:41 -05:00 |
|
|
|
7b6a3c4307
|
remove redundant void arguments
|
2021-10-12 21:17:46 -04:00 |
|
|
|
878795e64a
|
bulk rename of remaining USER- packages
|
2021-06-29 20:12:59 -04:00 |
|
