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Pull requests: lammps/lammps

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Pull requests list

Performance improvements for fix_ipi
enhancement neighborlist_feature
#4157 opened May 2, 2024 by ceriottm Loading…
11 tasks
1
1
Fix CUDA block count limitation in GPU package
bugfix gpu_package
#4156 opened May 1, 2024 by tpcbtw Loading…
11 tasks
@ndtrung81
new comm_style brick/direct option
work_in_progress
#4154 opened Apr 29, 2024 by sjplimp • Draft
11 tasks
@stanmoore1
17
Fix Inconsistent syntax for dump_modify triclinic/general
bugfix
#4152 opened Apr 29, 2024 by nnn911 Loading…
11 tasks
1
@stanmoore1
4
Avoiding forcezero infinite loop with zero energy.
#4150 opened Apr 26, 2024 by Bibobu Loading…
11 tasks
1
Small patches for various commands
bpm_package fix_feature granular_package
#4148 opened Apr 25, 2024 by jtclemm Loading…
11 tasks
1
Collected small changes
github maintenance unittest_feature
#4146 opened Apr 24, 2024 by akohlmey Loading…
6 of 7 tasks
@stanmoore1
1
Improve type label support
#4145 opened Apr 22, 2024 by jrgissing • Draft
10 of 31 tasks
1
Implement kspace_modify collective yes in KOKKOS package
enhancement kokkos_package kspace_package
#4143 opened Apr 19, 2024 by hagertnl • Draft
11 tasks
1
@hagertnl
12
flag output for compute count/type as intensive vs extensive
bugfix documentation
#4142 opened Apr 18, 2024 by jrgissing Loading…
1 of 11 tasks
@stanmoore1
21
Draft: Use CMake CUDA/HIP language
cmake gpu_package kokkos_package
#4128 opened Apr 8, 2024 by rbberger • Draft
11 tasks
@rbberger
Implementation of pair_style uf3 and uf3/kk
enhancement
#4110 opened Mar 25, 2024 by monk-04 • Draft
11 tasks done
35
Coefficient of restitution based damping in granular models
granular_package
#4068 opened Feb 6, 2024 by dhairyaiitb Loading…
5 of 11 tasks
@jtclemm
19
Add npair classes for a general pairwise cutoff
granular_package neighborlist_feature
#4060 opened Jan 24, 2024 by jtclemm • Draft
11 tasks
@jtclemm
3
Bio force field documentation updates
documentation enhancement
#4050 opened Jan 18, 2024 by akohlmey • Draft
5 of 10 tasks
Update Speed_kokkos.rst (segfault, memory)
#4028 opened Dec 20, 2023 by alphataubio Loading…
6 of 11 tasks
hybrid monte carlo
mc_package
#4019 opened Dec 15, 2023 by draneyj • Draft
6 of 11 tasks
1
@sjplimp
32
Draft: implement super-ellipsoid particle shapes for use in granular simulations
granular_package
#4008 opened Dec 11, 2023 by jibril-b-coulibaly • Draft
11 tasks
@sjplimp @jtclemm
4
Add more GH actions
#3965 opened Nov 5, 2023 by rbberger • Draft
11 tasks
2
Implement reversed harmonic walls
enhancement
#3899 opened Aug 23, 2023 by Eddy-Barraud Loading…
11 tasks
@sjplimp
5
New features for the ML-POD package
#3866 opened Jul 21, 2023 by exapde • Draft
9 of 10 tasks
13
Fix reaxff/species fixes
bugfix enhancement
#3824 opened Jun 17, 2023 by jrgissing Loading…
1 of 11 tasks
@sjplimp
7
Create atoms: overlap keyword for atomic molecule
enhancement
#3810 opened Jun 8, 2023 by jrgissing Loading…
1 of 11 tasks
@sjplimp
informational thermo column titles
#3764 opened May 2, 2023 by jrgissing • Draft
3 of 14 tasks
@sjplimp
3
Humbird-Graves Tersoff-style potential enhancement manybody_package work_in_progress
#3254 opened May 6, 2022 by dhumbird • Draft
11 tasks
2
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