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{2025.06}[foss/2024a] LAMMPS 22Jul2025 with CUDA #1461

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{2025.06}[foss/2024a] LAMMPS 22Jul2025 with CUDA #1461

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4b6840d
{2025.06}[foss/2024a] LAMMPS 22Jul2025 with CUDA
laraPPr Apr 7, 2026
51fb21c
add missing double point
laraPPr Apr 7, 2026
c8fddd2
add commit for easyblock
laraPPr Apr 8, 2026
07fc2af
Merge branch 'main' into LAMMPS_GPU
laraPPr Apr 28, 2026
457685c
use latest easybuild release
laraPPr Apr 28, 2026
47db9e3
use latest easybuild release
laraPPr Apr 28, 2026
7f0bea3
use update easyblock for ARM builds
laraPPr Jun 29, 2026
0a06b85
use from-pr for testing
laraPPr Jun 29, 2026
6dbb7f5
try from commit with a commit for the LAMMPS and kokkos easyblock
laraPPr Jun 29, 2026
25fa295
use from pr for testing
laraPPr Jun 29, 2026
172c35d
use commit where kokkos was added
laraPPr Jun 30, 2026
8af0c7d
use latest commit that also disables SVE on ARM
laraPPr Jun 30, 2026
eddbca3
Apply suggestion from @laraPPr
laraPPr Jun 30, 2026
269db6d
Need a commit that touches both lamms and kokkos easyblock
laraPPr Jun 30, 2026
6a30df4
set kokkos arch differently
laraPPr Jun 30, 2026
50ef06c
add easyconfig that builds with optarch false on ARM
laraPPr Jul 1, 2026
e417b97
Add more flags in the hope that neon is not picked up
laraPPr Jul 1, 2026
fe6a43c
fix broken commit
laraPPr Jul 1, 2026
aafcb4d
use latest easyblock commit
laraPPr Jul 17, 2026
7995da4
Merge branch 'main' into LAMMPS_GPU
laraPPr Jul 17, 2026
e190417
Still need the update to the config
laraPPr Jul 17, 2026
99a9bf7
use latest commit for easyblock pr for crosscompiling LAMMPS
laraPPr Aug 3, 2026
e3c1f8d
Merge branch 'main' into LAMMPS_GPU
laraPPr Aug 12, 2026
fc57f12
merge with main and use latest easybuild
laraPPr Aug 12, 2026
ece9ef0
Apply suggestion from @laraPPr
laraPPr Sep 4, 2026
c7244c8
Merge branch 'main' into LAMMPS_GPU
laraPPr Sep 4, 2026
8707311
test if neon fix with optimasation works on grace hopper
laraPPr Sep 9, 2026
b9e690b
fix commit hash
laraPPr Sep 10, 2026
9f19d61
Disable SVE for grace hopper
laraPPr Sep 10, 2026
194226b
use latest commit
laraPPr Sep 10, 2026
3611316
use latest commit from easyblocks PR 4222 for LAMMPS easyblock
boegel Sep 15, 2026
2a7a420
use latest commit from PR 4222 for LAMMPS easyblock
boegel Sep 16, 2026
fd8504b
use https://github.com/EESSI/software-layer-scripts/pull/326
laraPPr Oct 15, 2026
bfc5457
resolve merge conflict
laraPPr Oct 15, 2026
4bf9940
use latest commit of software_layer_scripts_commit
laraPPr Oct 16, 2026
88b000e
Merge branch 'main' into LAMMPS_GPU
laraPPr Oct 19, 2026
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5 changes: 5 additions & 0 deletions easystacks/software.eessi.io/2025.06/accel/nvidia/eessi-2025.06-eb-5.4.0-2024a.yml
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Original file line number Diff line number Diff line change
@@ -1,2 +1,7 @@
easyconfigs:
- ESPResSo-4.2.2-foss-2024a-CUDA-12.6.0.eb
- LAMMPS-22Jul2025-foss-2024a-kokkos-CUDA-12.6.0.eb:
# use enhanced easyblock that includes fixes for crosscompiling and Arm+CUDA,
# see https://github.com/easybuilders/easybuild-easyblocks/pull/4222
options:
include-easyblocks-from-commit: 6ef7c4c151dc9f4cd5eec7d4ebdfe68b0f42e3de
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