Nature Communications (Sep 2020)

Predicting heterogeneous ice nucleation with a data-driven approach

  • Martin Fitzner,
  • Philipp Pedevilla,
  • Angelos Michaelides

DOI
https://doi.org/10.1038/s41467-020-18605-3
Journal volume & issue
Vol. 11, no. 1
pp. 1 – 9

Abstract

Read online

Heterogenous ice nucleation is a ubiquitous phenomenon, but predicting the ice nucleation ability of a substrate is challenging. Here the authors develop a machine-learning data-driven approach to predict the ice nucleation ability of substrates, which is based on four descriptors related to physical properties of the interface.