Grain boundary diffusion cannot explain the W isotope heterogeneities of the deep mantle.

Peng, Yihang; Yoshino, Takashi; Deng, Jie · Nat Commun · 2025

basic_science · Level V

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Abstract

The low <sup>182</sup>W/<sup>184</sup>W and high <sup>3</sup>He/<sup>4</sup>He in some ocean island basalts compared to the bulk mantle values may derive from the Earth's core through long-term core-mantle interactions. It has been proposed that the grain boundary diffusion of siderophile elements is an efficient mechanism for core-mantle interaction and may effectively modify the W isotopic compositions of the plume-source mantle. In this study, we perform large-scale molecular dynamics simulations driven by machine learning potentials of ab initio quality to investigate the diffusion of W along ferropericlase grain boundaries and in (Mg,Fe)O liquid. Here we show that the diffusion of W is sluggish under core-mantle boundary conditions, and thus is unlikely to have observable impacts on the W isotopic compositions of terrestrial igneous rocks.