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Fig. 1

image

Ratio between the largest and smallest moment of inertia (Iz/Ix) with respect to the ratio between the intermediate moment of inertia to the smallest one (Iy /Ix) for three selected sets of nanoclusters. The black circle indicates the ratio that defines a perfect sphere (Iy /Ix = Iz /Ix = 1), while the dashed lines show the prolate (Iz = Iy > Ix) and oblate (Ix = Iy < Iz) limits. (A) Lowest energy O-N and P-N nanoclustersfor N = 1–10 and SiO-N nanoclustersfor N = 1–20, grey area corresponds to the plotted area in (B). (B) Zoom of the plot in (A) over a 1.0–1.8 range for both axes. (C) 180 P-6 nanocluster isomers. (D) 180 O-6 nanocluster isomers.

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