Two-dimensional materials from high-throughput computational exfoliation of experimentally known compounds

@article{Mounet2018TwodimensionalMF,
  title={Two-dimensional materials from high-throughput computational exfoliation of experimentally known compounds},
  author={N. Mounet and M. Gibertini and P. Schwaller and D. Campi and Andrius Merkys and A. Marrazzo and T. Sohier and I. E. Castelli and Andrea Cepellotti and G. Pizzi and N. Marzari},
  journal={Nature Nanotechnology},
  year={2018},
  volume={13},
  pages={246-252}
}
Two-dimensional (2D) materials have emerged as promising candidates for next-generation electronic and optoelectronic applications. Yet, only a few dozen 2D materials have been successfully synthesized or exfoliated. Here, we search for 2D materials that can be easily exfoliated from their parent compounds. Starting from 108,423 unique, experimentally known 3D compounds, we identify a subset of 5,619 compounds that appear layered according to robust geometric and bonding criteria. High… Expand

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High‐throughput computational screening of layered and two‐dimensional materials
Mechanical exfoliation of two-dimensional materials
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References

SHOWING 1-10 OF 108 REFERENCES
An atlas of two-dimensional materials.
...
1
2
3
4
5
...