Orb models #133
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Orb models #133
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…tbench-discovery into orbitalmaterials-orb
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+ where False = isinstance(['MPtrj', 'Alex'], (dict | str))
janosh
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Sep 1, 2024
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thanks a lot @DeNeutoy! excellent results. please send a follow up PR once https://github.com/orbital-materials/orb-models is public and the paper URL/DOI is available
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Orb models from OM. Let me know if the yaml's need any more specific details! I haven't actually published our code to run the models yet, I will do that soon.