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Critical vaporization of MgSiO(3)

Inhomogeneous ab initio molecular dynamics simulations show that vaporization of MgSiO(3) is incongruent and that the vapor phase is dominated by SiO and O(2) molecules. The vapor is strongly depleted in Mg at low temperature and approaches the composition of the liquid near the critical point. We f...

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Detalles Bibliográficos
Autores principales: Xiao, Bing, Stixrude, Lars
Formato: Online Artículo Texto
Lenguaje:English
Publicado: National Academy of Sciences 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6003494/
https://www.ncbi.nlm.nih.gov/pubmed/29735670
http://dx.doi.org/10.1073/pnas.1719134115
Descripción
Sumario:Inhomogeneous ab initio molecular dynamics simulations show that vaporization of MgSiO(3) is incongruent and that the vapor phase is dominated by SiO and O(2) molecules. The vapor is strongly depleted in Mg at low temperature and approaches the composition of the liquid near the critical point. We find that the liquid–vapor critical temperature ([Formula: see text] K) is much lower than assumed in hydrodynamic simulations, pointing to much more extensive supercritical fluid after the Moon-forming impact than previously thought. The structure of the near-critical liquid is very different from what has been studied previously and includes a significant fraction (10%) of molecular species SiO and O(2).