Fig. 3: An embedding of the 127,638 unique compositions (grey) from the ICSD database (2021) with respect to ElMD similarity between compounds, embedded to 2 principle axes with PCA. | npj Computational Materials

Fig. 3: An embedding of the 127,638 unique compositions (grey) from the ICSD database (2021) with respect to ElMD similarity between compounds, embedded to 2 principle axes with PCA.

From: A database of experimentally measured lithium solid electrolyte conductivities evaluated with machine learning

Fig. 3

a 6972 of these compositions contain lithium (black), and b 455 unique compositions from this dataset with an experimentally measured conductivity at any temperature. The expert-curated structural label that each composition belongs to is indicated by the colour scheme given in the legend, with a selection of representative compositions and their embedded coordinates indicated.

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