Polarons in Rock-Forming Minerals: Physical Implications

The existence of thermally-activated quasiparticles in amphiboles is an important issue, as amphiboles are among the main hydrous complex silicate minerals in the Earth’s lithosphere. The amphibole structure consists of stripes of 6-membered TO<sub>4</sub>-rings sandwiching MO<sub>...

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Bibliographic Details
Main Authors: Boriana Mihailova, Giancarlo Della Ventura, Naemi Waeselmann, Simone Bernardini, Wei Xu, Augusto Marcelli
Format: Article
Language:English
Published: MDPI AG 2022-11-01
Series:Condensed Matter
Subjects:
Online Access:https://www.mdpi.com/2410-3896/7/4/68
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Summary:The existence of thermally-activated quasiparticles in amphiboles is an important issue, as amphiboles are among the main hydrous complex silicate minerals in the Earth’s lithosphere. The amphibole structure consists of stripes of 6-membered TO<sub>4</sub>-rings sandwiching MO<sub>6</sub> octahedral slabs. To elucidate the atomistic origin of the anomalous rock conductivity in subduction-wedge regions, we studied several Fe-containing amphiboles with diverse chemistry by using in situ, temperature-dependent, polarised Raman spectroscopy. The occurrence of resonance Raman scattering at high temperatures unambiguously reveal temperature-activated small polarons arising from the coupling between polar optical phonons and electron transitions within Fe<sup>2+</sup>O<sub>6</sub> octahedra, independently of the amphibole chemical composition. The FeO<sub>6</sub>-related polarons coexist with delocalised H<sup>+</sup>; that is, at elevated temperatures Fe-bearing amphiboles are conductive and exhibit two types of charge carriers: electronic polarons with highly anisotropic mobility and H<sup>+</sup> cations. The results from density-functional-theory calculations on the electron band structure for a selected amphibole compound with a relatively simple composition are in full agreement with experimental data. The polaron activation temperature, mobility, and polaron-dipole magnitude and alignment can be controlled by varying the mineral composition, which makes amphiboles attractive “geo-stripes” that can serve as mineral-inspired technology to design thermally-stable smart materials with anisotropic properties.
ISSN:2410-3896