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  ## Dataset Description
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  - **Homepage:** [matpes.ai](http://matpes.ai)
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- - **Paper:** [Preprint](https://doi.org/10.48550/arXiv.2503.04070)
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  - **Leaderboard:** [MatCalc-Benchmark](http://matpes.ai/benchmarks)
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  - **Point of Contact:** [Materials Virtual Lab]
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  1. **Accuracy.** MatPES is computed using static DFT calculations with stringent converegence criteria.
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  Please refer to the `MatPESStaticSet` in [pymatgen] for details.
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  2. **Comprehensiveness.** MatPES structures are sampled using a 2-stage version of DImensionality-Reduced
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- Encoded Clusters with sTratified ([DIRECT](https//doi.org/10.1038/s41524-024-01227-4)) sampling from a greatly expanded configuration of MD structures.
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  3. **Quality.** MatPES includes computed data from the PBE functional, as well as the high fidelity r2SCAN meta-GGA
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  functional with improved description across diverse bonding and chemistries.
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  ## Dataset Description
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  - **Homepage:** [matpes.ai](http://matpes.ai)
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+ - **Paper:** [A Foundational Potential Energy Surface Dataset for Materials](https://doi.org/10.48550/arXiv.2503.04070)
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  - **Leaderboard:** [MatCalc-Benchmark](http://matpes.ai/benchmarks)
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  - **Point of Contact:** [Materials Virtual Lab]
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  1. **Accuracy.** MatPES is computed using static DFT calculations with stringent converegence criteria.
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  Please refer to the `MatPESStaticSet` in [pymatgen] for details.
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  2. **Comprehensiveness.** MatPES structures are sampled using a 2-stage version of DImensionality-Reduced
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+ Encoded Clusters with sTratified [DIRECT](https//doi.org/10.1038/s41524-024-01227-4) sampling from a greatly expanded configuration of MD structures.
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  3. **Quality.** MatPES includes computed data from the PBE functional, as well as the high fidelity r2SCAN meta-GGA
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  functional with improved description across diverse bonding and chemistries.
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