Pre-trained Models

ALIGNN ships a large catalog of pre-trained checkpoints for direct use.

• Models are hosted on Figshare.
• Two CLIs load them: pretrained.py (single-property predictors) and run_alignn_ff.py (universal force-field).
• Model names and sources are listed in alignn/ff/all_models_alignn.json and alignn/ff/all_models_alignn_atomwise.json.

Page	What it covers
Property predictors	Per-property checkpoints (formation energy, bandgap, …)
ALIGNN-FF	Universal force-field: EV curve, optimization, phonons, MD
ASE calculator	Drive ALIGNN-FF from Python via ASE

See Performance for per-dataset accuracy numbers.