Optimizing the Optimizer: Language Models Discover Faster Molecular Relaxation
An agent rewrote Sella into AutoSella, needing only 40.2–77.2% of Sella's force calls at r2SCAN-3c.
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An agent rewrote Sella into AutoSella, needing only 40.2–77.2% of Sella's force calls at r2SCAN-3c.
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