Discovery of a silicon-based ferrimagnetic wheel structure in V(x)Si(12)(-) (x = 1-3) clusters: photoelectron spectroscopy and density functional theory investigation.

Our studies show that VSi(12)(-) adopts a V-centered hexagonal prism with a singlet spin state. The addition of the second V atom leads to a capped hexagonal antiprism for V(2)Si(12)(-) in a doublet spin state. Most interestingly, V(3)Si(12)(-) exhibits a ferrimagnetic, bicapped hexagonal antiprism wheel-like structure with a total spin of 4 μ(B).