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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.
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 themethod
type hints in thequacc.recipes.mlp
functions to include SevenNet, adding some tests to the test suite, and addingsevenn
topyproject.toml
.Also see https://github.com/orbital-materials/orb-models.
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