sensitivity-dimensionality-results

Results of sensitivity and dimensionality analyses

For more details on the methods and how the data is generated, please check the following reference:

Citation:

Berk Onat, Christoph Ortner, James R. Kermode, "Sensitivity and Dimensionality of Atomic Environment Representations used for Machine Learning Interatomic Potentials", J. Chem. Phys. 153, (2020) doi:10.1063/5.0016005 DOI