Iron Valancies of (Mg,Fe)SiO3 Perovskite up to 1.2 Mbar using Synchrotron Mössbauer Spectroscopy

Jennifer M. Jackson1*, Wolfgang Sturhahn2, Guoyin Shen3, Jiyong Zhao2, Michael Y. Hu4, Daniel Errandonea4, and Jay D. Bass1

1Department of Geology, University of Illinois, Urbana, IL, U.S.A.
2Advanced Photon Source. Argonne National Laboratory, Argonne, IL, U.S.A.
3Consortium for Advanced Radiation Sources, University of Chicago, IL, U.S.A.
4HP-CAT and Carnegie Institution of Washington, Advanced Photon Source, Argonne, IL, U.S.A.

*jmjackso@uiuc.edu


Knowledge of iron valancies in silicate perovskite is relevant to our understanding of the physical and chemical properties of Earth’s lower mantle such as transport properties, mechanical behavior, and element partitioning. Recent studies have proposed that magnesium silicate perovskite is the principle sink for ferric iron in Earth’s lower mantle [e.g. 1]. Previous investigations on such perovskite samples have been performed at various temperatures, but at room-pressure [e.g. 1]. In this study, we have measured the iron valancies of two Fe-bearing silicate perovskite samples, Fe0.05Mg0.95SiO3 (Pv05) to 120 GPa and Fe0.1Mg0.9SiO3 (Pv10) to 75 GPa, at ambient temperature using diamond anvil cells. Such investigations of extremely small and dilute 57Fe-bearing samples have become possible after the development of synchrotron Mössbauer spectroscopy (SMS), also known as nuclear forward scattering. The SMS data were taken at beamline 3-ID of the Advanced Photon Source. The samples were synthesized in a multi-anvil apparatus as described by Fei et al. [2], and the perovskite structure for Pv05 and Pv10 was confirmed by X-ray diffraction. Our results are explained in the framework of the “three-doublet” model [2], which assumes two Fe2+ like sites and one Fe3+-like site that are well distinguishable by the hyperfine fields at the location of the Fe nuclei. At low pressures, the Fe3+/FePvtot is about 0.40 for both samples. Our results show that at pressures reaching into the lower mantle the fraction of Fe3+ remains essentially unchanged. The quadrupole splittings of all sites first increase with increasing pressure, which suggests an increasingly distorted (non cubic) local iron environment. Above pressures of 40 GPa for Pv10 and 80 GPa for Pv05, the quadrupole splittings are relatively constant suggesting an increasing resistance of the lattice against further distortion. To our knowledge, these are the first measurements of iron valancies in silicate perovskite under pressures characteristic of Earth’s lower mantle.


[1] McCammon, C.A., Nature, 387, 694-696 (1997).
[2] Fei, Y., Virgo, D., Mysen, B. O., Wang, Y., and Mao, H.K., Am. Min., 79, 826-837 (1994).