Catalyst Zero Research fork of TRIADS for materials-property prediction and scientific ML workflows.
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May 25, 2026 - Python
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matbench
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Predict ω_max (last-peak phonon frequency, cm⁻¹) for 1265 inorganic crystals on Matbench phonons. Magpie+GBDT baseline (MAE 70.1 cm⁻¹) beats published Roost (75.6). Hand-written CGCNN included for ablation.
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May 30, 2026 - Python
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