v2.2.7

Caution

Known critical issues in this version

• Incorrect results on GPUs.

We suggest all users use a newer version. See #2866 for more information.

New features

• add aparam_from_compute to pair deepmd by @ChiahsinChu in #2929
• support compressing any neuron structure by @njzjz in #2933
• Support conversion to pbtxt in command line interface by @Yi-FanLi in #2943

Enhancement

• argcheck: restrict the type of elements in a list by @njzjz in #2945
• reformat func for further merging with pt version by @zxysbsbzxy in #2946

Build and release

• deploy developed Python packages to GitHub Pages by @njzjz in #2932

Bug fix

• fix py lmp plugin path for editable installation by @njzjz in #2922
• fix se_a compression for just enough sel and symmetrical coordinates by @njzjz in #2924
• fix floating point exception when nloc or nall is zero by @njzjz in #2923
• fix typo about fparam/aparam by @ChiahsinChu in #2925
• Fix typos by @HydrogenSulfate in #2930
• only freeze in rank 0 by @njzjz in #2937
• fix ase tarball url and testing C library by @njzjz in #2950

New Contributors

• @HydrogenSulfate made their first contribution in #2930
• @zxysbsbzxy made their first contribution in #2946

Full Changelog: v2.2.6...v2.2.7