Fig. 6: Metal-insulator transition in embedding space.
From: Inverse design of two-dimensional materials with invertible neural networks
UMAP embedding of strain parameters for a Eg = 0.5 and b Eg = 1 eV with Eg = 0 eV samples. Red denotes Eg = 0 eV samples, while blue denotes the nonzero band gap samples. Selected regions (in yellow) are zoomed in to highlight specific examples where MIT occurs. Samples were validated with DFT and the true band gaps are shown in parentheses.
