Imprimir Resumo


The 27th AIRAPT International Conference on High Pressure Science and Technology
Abstract

Oral


Anomalous conductivity in rutile SnO2 driven by local disorder

Authors:
Dean Smith (UNLV - University of Nevada Las Vegas)

Abstract:

Many rutile-type materials are characterized by a shear softness under pressure, which is coupled to a Raman-active librational motion. Upon complete softening of the shear elastic constant, these materials adopt the CaCl2 structure. Using extended x-ray absorption fine structure spectroscopy (EXAFS), x-ray diffraction (XRD) and Raman spectroscopy, we have observed a disordered regime in rutile-type SnO2 at pressures between 5-10 GPa , in which four-probe electrical resistance experiments measure an anomalous increase in conductivity up to 4 orders of magnitude (i.e. a drop in the band gap, Eg, up to 0.47 eV). Ab initio calculations reveal that decrease in Eg may only be explained by the displacement of single anions, which results directly from the softening of the librational mode under pressure, and we propose that the same behavior should be a feature across all materials exhibiting a rutile®CaCl2 transition.