Unconditional Crystal Generation on MP20

Metric: DFT Stable, Unique, Novel Rate (higher is better)

LeaderboardDataset
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#ModelDFT Stable, Unique, Novel RateExtra DataPaperDateCode
1ADiT6NoAll-atom Diffusion Transformers: Unified generat...2025-03-05Code
2FlowLLM4.7NoFlowLLM: Flow Matching for Material Generation w...2024-10-30Code
3FlowMM2.8NoFlowMM: Generating Materials with Riemannian Flo...2024-06-07Code