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Pull requests: lammps/lammps
Pull requests list
KSPACE: Fix LAMMPS/Kokkos/Host threaded FFTs; reintroducing self-copy in remap collectives (sometimes)
enhancement
#4952
opened Apr 17, 2026 by
weinbe2
Collaborator
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5 of 7 tasks
Collected small changes and fixes
kokkos_package
maintenance
ready
#4950
opened Apr 17, 2026 by
akohlmey
Member
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6 of 8 tasks
Fix CommTiledKokkos pair comm segfault with GPU pairs + CommTiled buffer undersize
bugfix
kokkos_package
mliap_package
#4943
opened Apr 6, 2026 by
gauthierlab
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7 of 13 tasks
KSPACE: add automatic slab sizing for quasi-2D
kspace_package
#4939
opened Apr 3, 2026 by
LiangJiuyang
Collaborator
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11 tasks done
Add new bond_style
quartic/exp
enhancement
kokkos_package
#4935
opened Mar 30, 2026 by
stanmoore1
Contributor
•
Draft
fix rigid/small/*/kk and other KOKKOS improvements/bugfixes
kokkos_package
#4928
opened Mar 25, 2026 by
alphataubio
Collaborator
•
Draft
10 of 21 tasks
(write|read)_restart flexibility
work_in_progress
#4918
opened Mar 16, 2026 by
Matthew-Whitlock
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7 tasks
CMake/Core: Add support for Intel oneAPI (IntelLLVM) on Windows
cmake
user_intel_package
#4913
opened Mar 12, 2026 by
Sileo35
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Centroid stress tensor implementation for many-body pair styles + virial heat flux through the TALLY package
enhancement
#4911
opened Mar 11, 2026 by
MarkPoulos
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7 tasks
Reading General triclinic dump
enhancement
#4868
opened Feb 2, 2026 by
B3tah3
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4 of 11 tasks
Adding support for Kokkos kernel params autotuner
enhancement
kokkos_package
#4830
opened Jan 8, 2026 by
ndtrung81
Contributor
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5 of 11 tasks
Add ESP: a new FFT-based k-space solver (kspace_style esp) and matching Coulomb pair styles (coul/esp and lj/cut/coul/esp)
kspace_package
#4804
opened Dec 9, 2025 by
LiangJiuyang
Collaborator
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10 tasks done
GRACE pair style
enhancement
pace_package
#4799
opened Dec 3, 2025 by
yury-lysogorskiy
Collaborator
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8 of 11 tasks
Integrate new pair style RuNNer for evaluation of high-dimensional neural network potentials.
enhancement
#4785
opened Nov 20, 2025 by
lxknll
Collaborator
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16 tasks
Mesocanonical ensemble Monte Carlo
mc_package
#4757
opened Nov 1, 2025 by
shivamrkparashar
Collaborator
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7 of 11 tasks
Gibbs Ensemble Monte Carlo
enhancement
mc_package
#4718
opened Sep 19, 2025 by
andrewykhong
Collaborator
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3 of 11 tasks
Extend fix property/atom/kk with support for ivector, iarray and darray
enhancement
#4690
opened Aug 13, 2025 by
rbberger
Member
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11 tasks
MLIAP Unified Generalized Interface
enhancement
kokkos_package
mliap_package
#4673
opened Aug 4, 2025 by
codeformore
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9 tasks
New FENIX package
enhancement
restart_feature
#4652
opened Jul 9, 2025 by
Matthew-Whitlock
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9 of 10 tasks
Proposed enhancement to VerletSplit
kspace_package
replica_package
#4622
opened Jun 11, 2025 by
bcdandurand
Collaborator
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11 tasks
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