Equations of state for aqueous solutions under mantle conditions

Zhi Gang Zhang, Chi Zhang, Ming Geng

Research output: Contribution to journalReview articlepeer-review

Abstract

With unique physical and chemical properties, aqueous solutions in the mantle may play important roles for a number of geochemical and geodynamical processes. However, since experimental data available are very limited, people still know little about the aqueous solutions and their interactions with surrounding rocks and melts. From the perspective of thermodynamics, equation of state (EOS) is the key to push forward the modeling of aqueous solutions. Nevertheless, up to now accurate EOSs suitable for the mantle conditions are still in shortage. With discussions over several recognized EOSs, we summarize several ways to enhance the predictability of EOS: utilizing high quality data from molecular simulations, choosing functions with sound physical background, and improving the regression procedures for the empirical parameters. In the meantime, we find that the ion-bearing systems are still the focus of challenges in this area. New developments of experiments and computer simulations effectively deal with these challenges and in-depth understandings of aqueous solutions in the mantle are expected in the near future.

Original languageEnglish
Pages (from-to)1095-1106
Number of pages12
JournalScience China Earth Sciences
Volume59
Issue number6
DOIs
Publication statusPublished - 1 Jun 2016

Bibliographical note

Publisher Copyright: © 2016, Science China Press and Springer-Verlag Berlin Heidelberg.

Other keywords

  • Aqueous solutions
  • Equation of state
  • First principles
  • Fluid-rock interactions
  • Mantle
  • Molecular dynamics

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