Final-state effect on X-ray photoelectron spectrum of n-doped SrTiO$_3$
ORAL
Abstract
X-ray photoelectron spectroscopy (XPS) is a widely used technique to determine the oxidation states of chemical elements. In stoichiometric SrTiO$_3$, the Ti$^{4+}$ peak appears at a binding energy of about 459.0 eV for photoelectrons ejected from the Ti $2p$ core level. In lightly n-doped SrTiO$_3$, a weak shoulder at a binding energy of about 1.5 eV lower than the Ti$^{4+}$ peak appears in the XPS spectrum that has been conventionally interpreted as a Ti$^{3+}$ signal. By taking the final-state effect into account, i.e. by considering the response of the valence electrons in the presence of a core hole, we argue that such a Ti$^{3+}$ peak does not necessarily imply the existence of spatially localized Ti$^{3+}$ ions, and explicitly show that a spatially uniform Ti$^{(4-x)+}$ distribution also leads to the multi-peak structure. Spectra from metallic n-doped SrTiO$_3$ (e.g. La replacing Sr, Nb replacing Ti, or even oxygen vacancy doping) should be interpreted as the latter case. Several experiments based on this interpretation are discussed.
*Support for this work was provided through Scientific Discovery through Advanced Computing (SciDAC) program funded by U.S. DOE, Office of Science, Advanced Scientific Computing Research and Basic Energy Sciences under award number DESC0008877.
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