Observation of the cubic-field splitting of an excited S = 2 manifold in a cubic copper tetramer

EPR measurements on single crystals of Cu40Cl6(triphenylphosphine oxide)4 at liquid helium temperatures in the frequency ranges 14-17 and 34-35 GHz were fitted to a simple cubicS= 2 spin Hamiltonian with g = 2.10 ± 0.01 and a zero-field splitting of(0.53 ± 0.01) em - 1 • From the decrease in intensity of the S = 2 spectrum on cooling below 4.2 K and the absence of an S = 1 spectrum, the S = 2 manifold was deduced to lie ( 14 ± 1) em- 1 above a nonmagnetic ground state. The EPR results are used as a test of the various theories developed to explain the magnetic susceptibility of copper tetramer