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Publish materialized experimental optimization data
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{
"schema": "experimental-optimization-split/v1",
"split": "valid",
"split_unit": "family",
"families": ["catechol_rearrangement", "ni_additive", "oer", "solvation"],
"tasks": ["catechol_rearrangement", "ni_additive_1", "ni_additive_2", "ni_additive_3", "ni_additive_4", "oer", "solvation"],
"episode": {"num_initial": 10, "initialization": "random_at_or_below_median_oriented_score", "rng": "numpy.random.default_rng(seed) / PCG64", "num_queries": 50, "seeds": [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19]},
"rationale": "Validation spans reaction screening, process conditions, electrocatalysis, and molecular energy while keeping all nickel-additive plates together."
}