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mace_run_train distributed processes overwrite each others' pretrained data files

Status: Open.

#1309 In ACEsuit/mace;

· bernstei opened on Dec 18, 2025

MACE-LES with MLIAP not working with LAMMPS

Status: Open.

#1307 In ACEsuit/mace;

· nhleocn opened on Dec 15, 2025

mliap not working with recent lammps develop branch

Status: Open.

#1306 In ACEsuit/mace;

· bernstei opened on Dec 10, 2025

MACELES fine-tuning doesn't load LES parameters from keywords '--foundation model'

Status: Open.

#1305 In ACEsuit/mace;

· yixian929 opened on Dec 9, 2025

multihead fine-tuning + distributed training failing with an error about unused parameters

Status: Open.

#1304 In ACEsuit/mace;

· bernstei opened on Dec 8, 2025

Model checkpoints are incompatible when <code>cuequivariance</code> is available

Status: Open.

#1303 In ACEsuit/mace;

· pfebrer opened on Dec 8, 2025

MACE minimize with lammps

Status: Open.

#1301 In ACEsuit/mace;

· foster362 opened on Dec 4, 2025

How does MACE deals with DFT calculations with pressure?

Status: Open.

#1300 In ACEsuit/mace;

· RivasAntonio opened on Dec 4, 2025

MH-1 produce exploding results when enabling enable_cueq=True

Status: Open.

#1298 In ACEsuit/mace;

· cpeng77 opened on Dec 2, 2025

Add GPU-accelerated neighbor list construction (10× faster for large systems)

Status: Open.

#1296 In ACEsuit/mace;

· zhangqi94 opened on Dec 1, 2025

mace_plot_train fails with TypeError on newer Pandas versions (implicit non-numeric aggregation)

Status: Open.

#1295 In ACEsuit/mace;

· Phorbol opened on Nov 28, 2025

ML-IAP with MACE fails on multi-GPU with Kokkos in LAMMPS

Status: Open.

#1294 In ACEsuit/mace;

· JuKnrd opened on Nov 27, 2025