Hansen, Katja Theory, Fritz Haber Institute, Max Planck Society;
Scheffler, Matthias Theory, Fritz Haber Institute, Max Planck Society;
Tkatchenko, Alexandre Theory, Fritz Haber Institute, Max Planck Society;
Hansen, K., Montavon, G., Biegler, F., Fazli, S., Rupp, M., Scheffler, M., et al. (2013). Assessment and Validation of Machine Learning Methods for Predicting Molecular Atomization Energies. Journal of Chemical Theory and Computation, 9(8), 3404-3419. doi:10.1021/ct400195d.