1. Helmholtz-Zentrum Berlin für Materialien und Energie GmbH, Hahn-Meitner-Platz 1, 14109 Berlin, Germany
2. Department of Mathematics and Computer Science, Freie Universität Berlin, Arnimallee 12, 14195 Berlin, Germany
3. Department of Biology, Chemistry and Pharmacy, Freie Universität Berlin, Arnimallee 22, 14195 Berlin, Germany
4. Institute of Physics, Albert-Ludwigs-Universität Freiburg, Hermann-Herder-Straße 3, 79104 Freiburg im Breisgau, Germany
5. Microsoft Research AI4Science, Karl-Liebknecht Str. 32, 10178 Berlin, Germany
6. Department of Physics, Freie Universität Berlin, Arnimallee 12, 14195 Berlin, Germany
7. Department of Chemistry, Rice University, 6100 Main Street, Houston, Texas 77005, United States