Equilibrium Mg isotope fractionation among aqueous Mg2+, carbonates, brucite and lizardite: Insights from first-principles molecular dynamics simulations

Title
Equilibrium Mg isotope fractionation among aqueous Mg2+, carbonates, brucite and lizardite: Insights from first-principles molecular dynamics simulations
Authors
Keywords
Mg isotopes, Equilibrium fractionation, Density functional theory, First-principles molecular dynamics simulations, Aqueous Mg, Concentration effect, Carbonates, Brucite
Journal
GEOCHIMICA ET COSMOCHIMICA ACTA
Volume 250, Issue -, Pages 117-129
Publisher
Elsevier BV
Online
2019-02-08
DOI
10.1016/j.gca.2019.01.042

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