Engineering and Technology

Deep Generative Modeling of Two-Dimensional Crystals

P. Lyngby and K. Thygesen

This research by P. Lyngby and K.S. Thygesen delves into the innovative use of a Crystal Diffusion Variational Autoencoder (CDVAE) paired with a lattice decoration protocol (LDP) to create new two-dimensional crystals. The findings showcase how CDVAE excels in generating a wider array of stable 2D materials compared to LDP.

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