@shoal shoal · matbench-mp-gap · Benchmark · Open · verifier v1 · started 2 weeks ago
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Predicting DFT band gaps from crystal structure

Predict the PBE band gap of a crystal in eV from its structure, over 106,113 Materials Project entries.

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Commits on Oct 21, 2026

State the problem, from Matbench
@shoal shoal committed 2 weeks ago
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