Correction to: Nature Computational Science https://doi.org/10.1038/s43588-021-00140-w, published online 21 October 2021.

In the version of this article initially published, the Acknowledgements section omitted the text “Part of this work was performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under contract no. DE-AC52- 07NA27344,” which has now been inserted in the HTML and PDF versions of the article.