Dataset List catalogs machine-learning datasets from across the web and accepts additions through a submission form.
ColabFit Exchange
ColabFit Exchange supports materials science by helping users discover, explore, and submit datasets for machine learning interatomic potentials.

About ColabFit Exchange
ColabFit Exchange is a hub for discovering, exploring and submitting datasets used to develop machine learning interatomic potentials in materials science and chemistry. Its curated datasets are available in LMDB, Parquet and XYZ formats. The Exchange is a KIM Initiative project, and datasets can also be reached through its CLI, KLIFF and a Hugging Face organization.
Key features
- Simple view and downloadable search results.
- Dataset entries list source data and publication links, elements, configuration and atom counts, download counts, methods, software and licenses.
- ColabFit MCP for AI/LLM interactions with the Exchange.
- The OMol25 training set lists 488.8 GB of original data files.
ColabFit Exchange at a glance
- Official website
- materials.colabfit.org
- Category
- Research & Data › Machine Learning Datasets
- Type
- Dataset
- Pricing
- Free
- Platforms
- Web
- Details verified
- Oct 22, 2026 · Official source
- Language
- English
- Last checked
- Oct 5, 2026 · Online when checked
- Listed
- Oct 5, 2026
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