Fig. 1: Overview of dataset characteristics.
From: Machine learned potential for high-throughput phonon calculations of metal—organic frameworks
Diversity in the MACE descriptors of the (a) linkers and (b) nodes of the curated 127 MOFs using gaussian kernel density estimation method (c) The symmetry distribution of the dataset (d) The heat map for elemental counts for the atoms included in the dataset. The blank elements in the heat map are not included in the dataset.
