Figure 2
Average coordination number and distance of the first coordination shell of Ln complexes in Subset 1 (green), Subset 2 (red) and Subset 3 (blue; structures in subset 2 but without the cyclopentadienyl ligand; 26,156 structures) across the Ln series: (a) Average coordination number for Subsets 1 and 2; (b) Average distance of the first coordination shell for Subsets 1 and 2; (c) Average coordination number for Subset 2 and 3; (d) Average distance of the first coordination shell for Subset 2 and 3. Standard deviations are shown as the error bars. We count the contribution of each cyclopentadienyl ligand to the coordination number as three.
