Input files to reproduce the results of the paper.
The nucleation rates vs supercooling can be found in the files rate_cnt_scan_ml.txt
and rate_seeding_scan_ml.txt
.
If you have questions send me an email to ppiaggi at princeton.edu
Data of paper: Piaggi et al., "Homogeneous ice nucleation in an ab initio machine learning model of water", PNAS, 119, e2207294119, (2022) https://www.pnas.org/doi/full/10.1073/pnas.2207294119 or arXiv preprint arXiv:2203.01376 (2022) https://arxiv.org/abs/2203.01376
Jupyter Notebook
Input files to reproduce the results of the paper.
The nucleation rates vs supercooling can be found in the files rate_cnt_scan_ml.txt
and rate_seeding_scan_ml.txt
.
If you have questions send me an email to ppiaggi at princeton.edu