This perspective overviews the family of two-dimensional (2D) materials, which have attracted significant attention due to their properties and potential applications, and discusses how novel 2D materials including van der Waals (vdW) and non-vdW 2D materials have been predicted so far. A few thousand 2D materials have been predicted to be exfoliable or dynamically/thermodynamically stable, whereas a few hundred 2D materials have been synthesized so far, highlighting a gap between the theoretical prediction and experiments. This perspective introduces the recent developments in predicting the synthesis of non-vdW 2D materials.
Cite
@article{arxiv.2603.10462,
title = {Beyond geometrical screening in predicting two-dimensional materials},
author = {Shota Ono},
journal= {arXiv preprint arXiv:2603.10462},
year = {2026}
}