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Model for bulk_modulus_JVASP_91_C

  • Description: This is a benchmark to evaluate how accurately an ES model can predict the bulk modulus of C (JVASP-91), 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


Model benchmarks

Model name Dataset MAE Team name Dataset size Date submitted Notes
qmcpack_dmc_pbedft_3d14.2217JARVIS104-05-2023CSV, JSON,, Info, JVASP-91
qe_pbe_ccECPdft_3d7.4JARVIS104-05-2023CSV, JSON,, Info, JVASP-91
vasp_opt86bdft_3d7.5JARVIS101-14-2023CSV, JSON,, Info, JVASP-91
vasp_optcx13dft_3d4.0JARVIS101-14-2023CSV, JSON,, Info, JVASP-91
vasp_optb88vdwdft_3d5.6JARVIS101-14-2023CSV, JSON,, Info, JVASP-91
qmcpack_team__dmc_001dft_3d7.86QMCPACK105-15-2023CSV, JSON,, Info, JVASP-91
vasp_pbe_mpdft_3d7.0MP101-14-2023CSV, JSON,, Info, JVASP-91
vasp_optpbedft_3d20.8JARVIS101-14-2023CSV, JSON,, Info, JVASP-91