GemNet — Garden's Almanac

Garden's Almanac of Matter Models

Checkpoint	Params	Polaris	Sophia	Perlmutter	Delta
gemnet-oc-large-s2ef-oc20-all-md	168M	○	○	○	—
gemnet-oc-s2ef-oc20-all-md	39M	○	○	○	—
gemnet-oc-s2ef-oc20-all	39M	○	○	○	—
gemnet-dt-s2ef-oc20-all	32M	●	○	○	—

● verified, last 30 days ○ installed, not recently verified — not installed

No cluster has installed any checkpoint of this model yet.

References

Gasteiger, Johannes, Shuaibi, Muhammed, Sriram, Anuroop, Günnemann, Stephan, Ulissi, Zachary, Zitnick, C. Lawrence, Das, Abhishek, GemNet-OC: Developing Graph Neural Networks for Large and Diverse Molecular Simulation Datasets, arXiv, 2022.

Position on the similarity map

GemNet is highlighted. Neighbors are nearest-by-CKNNA on the selected reference dataset. Click any italic label to jump to that model.

Reference dataset

OMol25 OMat24 QM9 sAlex

Layout: umap (n_neighbors=10, min_dist=0.25, metric=precomputed, seed=0) on the cknna distance (1 - sim) at k=25 across 30 foundation models. Marker area scales with parameter count; hollow markers indicate a dens, direct, or invariant variant. Italic labels link to a catalogued model page. 30 models · 5 families

Layout: umap (n_neighbors=10, min_dist=0.25, metric=precomputed, seed=0) on the cknna distance (1 - sim) at k=25 across 33 foundation models. Marker area scales with parameter count; hollow markers indicate a dens, direct, or invariant variant. Italic labels link to a catalogued model page. 33 models · 6 families

Layout: umap (n_neighbors=10, min_dist=0.25, metric=precomputed, seed=0) on the cknna distance (1 - sim) at k=25 across 29 foundation models. Marker area scales with parameter count; hollow markers indicate a dens, direct, or invariant variant. Italic labels link to a catalogued model page. 29 models · 5 families