Model for epsx_JVASP_57_MoSe2¶
- Description: This is a benchmark to evaluate how accurately an ES model can predict the static dielectric constant (x direction) for MoSe2 (JVASP-57), experimental results are used as a ground truth for comparison and the mean absolute error (MAE) with respect to the experimental value is used as an accuracy metric
Reference(s): https://www.nature.com/articles/s41524-020-00440-1, https://doi.org/10.48550/arXiv.2305.11842, https://www.nature.com/articles/sdata201882, https://www.nature.com/articles/s41524-020-0337-2
Model benchmarks
| Model name | Dataset | MAE | Team name | Dataset size | Date submitted | Notes |
|---|---|---|---|---|---|---|
| vasp_optb88vdw_linopt | dft_3d | 0.5049 | JARVIS | 1 | 01-14-2023 | CSV, JSON, run.sh, Info, JVASP-57 |
| vasp_optb88vdw_dfpt | dft_3d | 0.6184 | JARVIS | 1 | 01-14-2023 | CSV, JSON, run.sh, Info, JVASP-57 |