M. Knupfer et al., SITE-SPECIFIC UNOCCUPIED ELECTRONIC-STRUCTURE OF ONE-DIMENSIONAL SRCUO2, Physical review. B, Condensed matter, 55(12), 1997, pp. 7291-7294
The unoccupied electronic structure of SrCuO2 single crystals has been
studied using x-ray-absorption spectroscopy. By choosing the orientat
ion of the single crystals with respect to the polarization vector of
the synchrotron radiation, we are able to determine the hole occupatio
n of the different O 2p and Cu 3d orbitals. We show that the intrinsic
holes in the one-dimensional copper oxide zigzag chains mainly occupy
planar Cu 3d(y2-z2) orbitals, which closely resembles the situation i
n the undoped parent compounds of the high-temperature superconductors
. Additionally, most of the oxygen states that are admired to the uppe
r Hubbard band are concentrated in the center of the chains most proba
bly as a result of the larger number of nearest neighbors. Our results
provide an important check for calculations of one-dimensional correl
ated Cu-O systems.