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. 2020 Dec 8;11:6280. doi: 10.1038/s41467-020-19964-7

Table 1.

Performance Benchmarks on OQMD. The table shows the mean absolute error (MAE), and root mean squared error (RMSE) for the baseline and proposed models on 10% of the data that was randomly sampled and withheld as a test set. The bracketed numbers show the standard deviation in the last significant figure.

MAE/eV   RMSE/eV  
RF + Magpie 0.067     0.121
ElemNet46 0.055    
Roost (Single) 0.0297(7) 0.0995(16)
Roost (Ensemble) 0.0241     0.0871