We have determined by means of first principles quasiharmonic calculations the elastic constants and acoustic velocities of MgSiO3 perovskite, the most abundant mineral of the Earth's lower mantle (LM), at pertinent pressures and temperatures. Using these results, along with the effects of low concentration iron alloying and the thermoelasticity of the most important secondary LM phase, MgO, we predict the isotropic elastic moduli of likely LM aggregates. Comparison with seismic values extracted from the preliminary reference Earth model indicates that the top of the LM behaves as a typical aggregate of pyrolitic composition, likewise the upper mantle. But systematic deviations that cannot be accounted for by alterations in the geotherm alone develop toward the deep LM. This result could be viewed as evidence in support of radially inhomogeneous LM models.

Thermoelastic Properties of [Formula presented]-Perovskite: Insights on the Nature of the Earth’s Lower Mantle

Cococcioni M.;
2004-01-01

Abstract

We have determined by means of first principles quasiharmonic calculations the elastic constants and acoustic velocities of MgSiO3 perovskite, the most abundant mineral of the Earth's lower mantle (LM), at pertinent pressures and temperatures. Using these results, along with the effects of low concentration iron alloying and the thermoelasticity of the most important secondary LM phase, MgO, we predict the isotropic elastic moduli of likely LM aggregates. Comparison with seismic values extracted from the preliminary reference Earth model indicates that the top of the LM behaves as a typical aggregate of pyrolitic composition, likewise the upper mantle. But systematic deviations that cannot be accounted for by alterations in the geotherm alone develop toward the deep LM. This result could be viewed as evidence in support of radially inhomogeneous LM models.
2004
Applied Physics/Condensed Matter/Materials Science encompasses the resources of three related disciplines: Applied Physics, Condensed Matter Physics, and Materials Science. The applied physics resources are concerned with the applications of topics in condensed matter as well as optics, vacuum science, lasers, electronics, cryogenics, magnets and magnetism, acoustical physics and mechanics. The condensed matter physics resources are concerned with the study of the structure and the thermal, mechanical, electrical, magnetic and optical properties of condensed matter. They include superconductivity, surfaces, interfaces, thin films, dielectrics, ferroelectrics and semiconductors. The materials science resources are concerned with the physics and chemistry of materials and include ceramics, composites, alloys, metals and metallurgy, nanotechnology, nuclear materials, adhesion and adhesives. Resources dealing with polymeric materials are listed in the Organic Chemistry/Polymer Science category.
Esperti anonimi
Inglese
Internazionale
ELETTRONICO
92
1
4
MAGNESIUM-SILICATE PEROVSKITE; MGSIO3 PEROVSKITE; WAVE VELOCITIES; HIGH-PRESSURE; DEEP MANTLE; ELASTIC-ANISOTROPY; MOLECULAR-DYNAMICS; THERMAL EQUATION; LATTICE-DYNAMICS; STRATIFICATION
4
info:eu-repo/semantics/article
262
Wentzcovitch, R. M.; Karki, B. B.; Cococcioni, M.; de Gironcoli, S.
1 Contributo su Rivista::1.1 Articolo in rivista
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/11571/1279946
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