c3ca6a8e56
Merge branch 'develop' into mala
2025-01-15 13:19:15 +01:00
89370efe39
Merge branch 'develop' into develop
2025-01-14 19:12:14 -05:00
264c1c3140
Merge branch 'develop' of github.com:lammps/lammps into mala
2025-01-14 16:02:37 -07:00
0fe7fbdb42
Merge branch 'develop' into pair_d3
2025-01-14 16:05:29 -05:00
c2868c448e
Merge remote-tracking branch 'github/develop' into collected-small-changes
2025-01-13 20:34:14 -05:00
55a3b28f7d
replace CR-LF with LF
2025-01-13 16:19:40 -05:00
8705a14b35
create logs for example input
2025-01-13 16:18:24 -05:00
742c869534
Merge branch 'develop' into gsalkuin/develop
2025-01-13 16:08:18 -05:00
ddff545a4c
Merge pull request #4431 from Becksteinlab/imd-v3-integration
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Interactive Molecular Dynamics [IMD] Version 3 implementation
2025-01-13 15:59:41 -05:00
dce1231052
add a lammps_eval() function to the C library interface and all derived wrappers
2025-01-12 00:39:18 -05:00
3731513576
example IMDv3 usage
2025-01-09 21:55:44 -07:00
463452e6a0
README added
2024-12-29 22:40:05 -08:00
b246599654
uploaded dated stress output file
2024-12-29 22:33:24 -08:00
f809aee52f
uploaded dated plot
2024-12-29 22:31:35 -08:00
78aee50de8
small cosmetic changes, simplify d2/d3 examples, and create consistent logs
2024-12-20 18:49:55 -05:00
095d33dafb
Added examples and references to the docs
2024-12-19 18:06:54 +01:00
5f3ea61080
Merge branch 'develop' into mala
2024-12-19 17:16:05 +01:00
bff2e64bbc
Docs and example updates by Aidan Thompson
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I did NOT author this commit, I am only pushing it because for some reason, Github does not permit Aidan to do so
Co-authored-by: Aidan Thompson <athomps@sandia.gov >
2024-12-19 10:06:53 +01:00
3311e71a82
Merge branch 'develop' into develop
2024-12-17 20:27:13 -08:00
4b1a8d1a78
uncommented output line
2024-12-17 20:06:04 -08:00
03fff14922
example name suffix removed
2024-12-17 20:02:38 -08:00
6124631a65
updated readme example list order
2024-12-13 21:18:10 -08:00
16e0a7788a
Now actually added the correct log
2024-12-13 09:51:07 +01:00
d50a62f827
example readme updated
2024-12-12 18:32:46 -08:00
483111b637
remove references to nonexisting input
2024-12-12 00:22:51 -05:00
b4acfd1e3b
updated summary, comments, and name
2024-12-10 21:47:30 -08:00
49938456a3
Merge branch 'lammps:develop' into develop
2024-12-10 17:45:18 -08:00
f59f084c37
Added logs for examples
2024-12-10 10:39:57 +01:00
2562d3afc4
Updating bpm pour example with break no
2024-12-09 11:11:06 -07:00
3c6f4374ee
removed some id info
2024-12-06 22:37:28 -08:00
f0c176c603
vcm example script and log added
2024-12-06 21:42:23 -08:00
2185ffa428
Renamed files to be more consistent with other examples
2024-12-05 16:43:18 +01:00
b146a1d59b
Merge remote-tracking branch 'refs/remotes/origin/develop' into mala
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# Conflicts:
# src/KOKKOS/kokkos_type.h
2024-12-05 15:23:21 +01:00
5928389c5e
Merge pull request #4312 from navlalli/qtpie
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Add fix qtpie/reaxff
2024-11-13 07:42:07 -05:00
2d2bc029a4
Merge branch 'develop' into qtpie
2024-11-12 11:37:40 -08:00
2bcd6d1f73
Name change, add example
2024-11-12 11:40:07 -05:00
f84b9f350e
Merge branch 'develop' of https://github.com/lammps/lammps into alphataubio-kokkos-fixes
2024-11-08 14:53:37 -08:00
34113226ae
Updating pair tracker example
2024-11-04 13:57:54 -07:00
c057b36c15
Merge branch 'develop' into alphataubio-kokkos-fixes
2024-10-30 21:50:36 -04:00
6d634dc646
Merge pull request #4359 from jtclemm/BPM
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Adding new force options to BPM package
2024-10-29 21:31:03 -04:00
e2214fc4d6
Merge branch 'develop' into regression-test-update
2024-10-22 21:10:22 -04:00
81f71716ba
Merge branch 'develop' into BPM
2024-10-22 20:59:12 -04:00
58ff8d3212
Suppressing dump output in bpm examples
2024-10-21 15:18:17 -06:00
f8a8783044
Merge branch 'develop' into alphataubio-kokkos-fixes
2024-10-12 20:09:59 -04:00
63a26b1770
add the missing log file using --gen-ref
2024-10-08 12:10:48 -05:00
a53840014c
Update in.wall.sphere
2024-10-07 18:17:14 -04:00
941b3dd566
add two examples for regression testing
2024-10-07 17:15:09 -04:00
8c76600d47
anticipate change to C++ standard
2024-10-06 15:06:05 -04:00
01468e2720
Merge branch 'collected-small-changes' of github.com:akohlmey/lammps into collected-small-changes
2024-10-04 01:41:57 -04:00
6d8529f1f7
Merge branch 'develop' into collected-small-changes
2024-10-04 01:24:30 -04:00
