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Matbench-Discovery

Benchmarks

Task NameDataset NameSOTA ResultTrend
Stability PredictionMatbench-Discovery unique structure prototypes
F1 Score84.7
26
Material discoveryMatbench Discovery MPtrj
F1 Score86.3
12
Materials DiscoveryMatbench Discovery
F1 Score93.1
11
Material DiscoveryMatbench-Discovery non-compliant full (test)
F1 Score90.3
10
Material DiscoveryMatbench-Discovery 10k most stable
F1 Score98.8
10
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