Table 3 Model calibration results: A distribution comparison of the True label and the Predicted Label across fivefolds.

From: Machine learning-based discovery of vibrationally stable materials

 

True label

Predicted label

Unstable

Stable

Unstable

Stable

Average across fivefolds

196.4 (32%)

426.6 (68%)

222.42 (36%)

399.76 (64%)