L. Qian et al., Bonding mechanism in the transition-metal fullerides studied by symmetry-selective resonant x-ray inelastic scattering - art. no. 085418, PHYS REV B, 6308(8), 2001, pp. 5418
The bonding between titanium atoms and C-60 has been examined by means of r
esonant inelastic x-ray scattering. Using the symmetry-selection rules in t
he scattering process the symmetry of the orbitals involved in the bond for
mation was determined. It was found that the lowest unoccupied states are d
ue to hybridization between the highest occupied orbital of C-60 and Ti orb
itals. A comparison between experimental and theoretical results indicates
Ti bonding to the six-ring site. The method can be used to probe bonding be
tween metal atoms and organic molecules in general.