Fe<sup>2+</sup> Partitioning in Al‐Free Pyrolite: Consequences for Seismic Velocities and Heterogeneities

Abstract Iron partitioning among the main lower mantle phases, bridgmanite (Bm) and ferropericlase (Fp), has non‐monotonic behavior owing to the high‐spin to low‐spin crossover in ferrous iron (Fe 2+ ) in Fp. Previously reported iron partitioning coefficient between these phases, , still have considerable uncertainty. Here, we investigate the Fe 2+ partitioning behavior using ab initio free energy results. Although we focus on Fe 2+ only, we describe the effect of this iron spin crossover (ISC) on and of the latter on compositions and seismic velocities in a pyrolitic aggregate. Our results suggest that its velocities are mainly affected by the ISC and less so by the Fe 2+ partitioning. In contrast, iron partitioning manifests in thermally induced velocity heterogeneity ratios. Prediction of the seismological parameter including iron partitioning effects resembles quantitatively ’s inferred from several tomographic studies down to 2,400 km depth.

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Publication Details

Journal
Geophysical Research Letters
Published
2024-11-07
DOI
https://doi.org/10.1029/2024gl108967
Citations
1
Primary Topic
High-pressure geophysics and materials
Type
article
Field-Weighted Citation Impact
0.53

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article

Fe2+ Partitioning in Al‐Free Pyrolite: Consequences for Seismic Velocities and Heterogeneities

Renata M. Wentzcovitch, Jingyi Zhuang
1 citations
Geophysical Research Letters
High-pressure geophysics and materials
0.53
article

Fe2+ Partitioning in Al‐Free Pyrolite: Consequences for Seismic Velocities and Heterogeneities

Renata M. Wentzcovitch, Jingyi Zhuang
article en
1 citations

Abstract

Abstract Iron partitioning among the main lower mantle phases, bridgmanite (Bm) and ferropericlase (Fp), has non‐monotonic behavior owing to the high‐spin to low‐spin crossover in ferrous iron (Fe 2+ ) in Fp. Previously reported iron partitioning coefficient between these phases, , still have considerable uncertainty. Here, we investigate the Fe 2+ partitioning behavior using ab initio free energy results. Although we focus on Fe 2+ only, we describe the effect of this iron spin crossover (ISC) on and of the latter on compositions and seismic velocities in a pyrolitic aggregate. Our results suggest that its velocities are mainly affected by the ISC and less so by the Fe 2+ partitioning. In contrast, iron partitioning manifests in thermally induced velocity heterogeneity ratios. Prediction of the seismological parameter including iron partitioning effects resembles quantitatively ’s inferred from several tomographic studies down to 2,400 km depth.

Geophysical Research LettersVol. 51(21)
Lamont-Doherty Earth Observatory (US), Flatiron Health (United States) (US), Flatiron Institute (US), Columbia University (US)
National Science Foundation, San Diego Supercomputer Center, Division of Materials Research, Office of Advanced Cyberinfrastructure
Affordable and clean energy
Openalex Percentile: Top 33%
High-pressure geophysics and materials
0.53
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