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Add support for more foundation models

Open Andrew-S-Rosen opened this issue 1 year ago • 0 comments

What new feature would you like to see?

We should add the pre-trained SevenNet MLP to the supported MLP methods since it performs so well on https://matbench-discovery.materialsproject.org.

This would entail adding it as a supported calculator method in quacc.recipes.mlp._base.pick_calculator, updating the method type hints in the quacc.recipes.mlp functions to include SevenNet, adding some tests to the test suite, and adding sevenn to pyproject.toml.

Also see https://github.com/orbital-materials/orb-models.

Andrew-S-Rosen avatar Aug 17 '24 03:08 Andrew-S-Rosen