MaterialsAtlas Benchmark

LeMat-GenBench: Generative Crystal Structure Model Benchmark

crystal structuregenerative modelsbenchmarkmaterials scienceHugging FaceleaderboardCIF files

A Hugging Face Space that provides a leaderboard for ranking generative models of crystal structures based on various quality metrics. Users can upload their own CIF files and model details to be included in the benchmark.

Citation: Betala, Siddharth, Samuel P. Gleason, Ali Ramlaoui, Andy Xu, Georgia Channing, Daniel Levy, Clémentine Fourrier et al. "LeMat-GenBench: A Unified Evaluation Framework for Crystal Generative Models." arXiv preprint arXiv:2512.04562 (2025).

Acknowledgement: Entalpic, France, 2Harvey Mudd College, USA, 3Hugging Face, France, 4Mila, Canada, 5National University of Singapore, Singapore, 6University of Cambridge, UK, 7Chalmers University of Technology, Sweden, 8Indian Institute of Technology Delhi, India

TypeBenchmark
DomainGenerative materials design
LicenseNot specified
ContributorsNot specified