All issues

List of critical bugs giving incorrect results without error messages
#2866 · njzjz opened on Sep 26, 2023
lmp in 2.1.3 make unrecognized pair error
#1809 · pee8379 opened on Jul 2, 2022
13

Promote remaining duck-typed attribute probes (add_chg_spin_ebd, geo_compress, reinit_exclude) to base-class interfaces

#5897

· wanghan-iapcm opened

on Jul 23, 2026

[Code scan] SE-Attention ops can read and write past mismatched tensor shapes

#5895

· njzjz-bot opened

on Jul 22, 2026

[Code scan] SE-T grad-grad skips loading a newly scoped polynomial cache

#5894

· njzjz-bot opened

on Jul 22, 2026

[Code scan] ROCm SE-T and SE-R gradient kernels can deadlock at divergent block barriers

#5893

· njzjz-bot opened

on Jul 22, 2026

[Code scan] SE-A tabulation dereferences `em_x[-1]` when `nnei == 0`

#5892

· njzjz-bot opened

on Jul 22, 2026

[Code scan] Sorted SE-Attention padding has inconsistent `two_embed` gradients and double backward

#5891

· njzjz-bot opened

on Jul 22, 2026

[Code scan] PyTorch SE-Attention tabulation ignores `is_sorted` in forward and first backward

#5890

· njzjz-bot opened

on Jul 22, 2026

feat(tf2): implement training.mixed_precision

#5881

· njzjz-bot opened

on Jul 19, 2026

feat(tf2): implement training profiler support

#5880

· njzjz-bot opened

on Jul 19, 2026

feat(tf2): support epoch-based and multi-task training horizons

#5879

· njzjz-bot opened

on Jul 19, 2026

feat(tf2): align optimizer dispatch with the common schema

#5878

· njzjz-bot opened

on Jul 19, 2026

feat(tf2): support or reject dens, ener_spin, and population losses

#5877

· njzjz-bot opened

on Jul 19, 2026