diff --git a/README.md b/README.md index 2d929b9..35954ab 100644 --- a/README.md +++ b/README.md @@ -21,6 +21,7 @@ Models also available on Hugging Face: https://huggingface.co/mace-foundations. | MACE-MATPES-PBE-0 | 89 | MATPES-PBE | DFT (PBE) | Materials | [medium](https://github.com/ACEsuit/mace-foundations/releases/download/mace_matpes_0/MACE-matpes-pbe-omat-ft.model) | >=v0.3.10 | No +U correction. | ASL | | MACE-MATPES-r2SCAN-0 | 89 | MATPES-r2SCAN | DFT (r2SCAN) | Materials | [medium](https://github.com/ACEsuit/mace-foundations/releases/download/mace_matpes_0/MACE-matpes-r2scan-omat-ft.model) | >=v0.3.10 | Better functional for materials. | ASL | | MACE-MH-0/1 | 89 | OMAT/OMOL/OC20/MATPES | DFT (PBE/R2SCAN/wB97M-VV10) | Inorganic crystals, molecules and surfaces. [More info.](https://huggingface.co/mace-foundations/mace-mh-1) | [mh-0](https://github.com/ACEsuit/mace-foundations/releases/download/mace_mh_1/mace-mh-0.model) [mh-1](https://github.com/ACEsuit/mace-foundations/releases/download/mace_mh_1/mace-mh-1.model) | >=v0.3.14 | Very good cross domain performance on surfaces/bulk/molecules. | ASL | +| MACE-MDP | 10 | SPICE-α | DFT (wB97M-D3(BJ)/def2-TZVPP) | Organic systems [More info.](https://chemrxiv.org/doi/full/10.26434/chemrxiv.15000716) | [model](https://raw.githubusercontent.com/Nilsgoe/MACE-MDP/main/models/MACE-MDP.model) | >=v0.3.16 | Dipoles & polarizabilities only; not for energies/forces. | [ASL](https://github.com/Nilsgoe/MACE-MDP) | The first generation of models are available in the [MACE-MP-0](https://github.com/ACEsuit/mace-mp/releases/tag/mace_mp_0).