Artificial intelligence guided search for van der Waals materials with high optical anisotropy

Liudmila Bereznikova, Kruglov Ivan, Ermolaev Georgy, Valentyn Volkov, Kostya S. Novoselov

Keywords: optical anisotropy, van der Waals materials, deep learning, graph neural network

TL;DR: By integrating artificial intelligence into the vdW materials search process, we gain new insights into the correlation between crystallographic parameters and optical anisotropy, which was confirmed experimentally.

Confirmation Of Submission Requirements: I submit a previously published paper. It was published in an archival peer–reviewed venue on or after September 8th 2024, I specify the DOI in the field below, and I submit the camera-ready version of the paper.

DOI: https://doi.org/10.1039/D4MH01332H

Submission Number: 31