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      Lattice dynamics of MgSiO\(_3\) perovskite (bridgmanite) studied by inelastic x-ray scattering and ab initio calculations

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          Abstract

          We have determined the lattice dynamics of MgSiO\(_3\) perovskite (bridgmanite) by a combination of single-crystal inelastic x-ray scattering and ab initio calculations. We observe a remarkable agreement between experiment and theory, and provide accurate results for phonon dispersion relations, phonon density of states and the full elasticity tensor. The present work constitutes an important milestone to extend this kind of combined studies to extreme conditions of pressure and temperature, directly relevant for the physics and the chemistry of Earth's lower mantle.

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          Mineralogy. Discovery of bridgmanite, the most abundant mineral in Earth, in a shocked meteorite.

          Meteorites exposed to high pressures and temperatures during impact-induced shock often contain minerals whose occurrence and stability normally confine them to the deeper portions of Earth's mantle. One exception has been MgSiO3 in the perovskite structure, which is the most abundant solid phase in Earth. Here we report the discovery of this important phase as a mineral in the Tenham L6 chondrite and approved by the International Mineralogical Association (specimen IMA 2014-017). MgSiO3-perovskite is now called bridgmanite. The associated phase assemblage constrains peak shock conditions to ~ 24 gigapascals and 2300 kelvin. The discovery concludes a half century of efforts to find, identify, and characterize a natural specimen of this important mineral.
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            Ab initio study of phonons and structural stabilities of the perovskite-type

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              Erratum First-principles prediction of crystal structures at high temperatures using the quasiharmonic approximation [Phys Rev B76 064116 (2007)]

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                Author and article information

                Journal
                10.1002/2016GL067970
                1509.06164

                Condensed matter
                Condensed matter

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