Yb Valence States in YbC2: A HERFD-XANES Spectroscopic Investigation

The valence state of Yb in YbC2 was analyzed using high-energy-resolution fluorescence detection (HERFD) X-ray absorption near-edge structure (XANES) spectroscopy and time-of-flight neutron powder diffraction to clarify a controversy in the literature. The unit cell volume of YbC2 suggests a mixed Yb valence, which was formerly determined to be 2.8 by magnetization measurements and paramagnetic neutron scattering techniques. However, the nature of the intermediate valence was not clearly established. Both homogeneous and heterogeneous mixed valences were assumed in different publications. The temperature-dependent behavior of the valence state was only predicted, albeit not explicitly studied. In this work, the valence state of Yb in YbC2 is, therefore, investigated thoroughly by HERFD-XANES spectroscopy at low and high temperatures. Our measurements result in an average Yb valence of 2.81 that is temperature-independent from 15 to 1123 K. These findings are confirmed by neutron powder diffraction experiments, which reveal a constant C–C distance of 128.7(9) pm in a temperature range from 5 to 100 K. A significant temperature dependence of the Yb valence state in YbC2 can, therefore, be excluded by our experimental results.