Theoretical Model for the High-Pressure Melting Process of MgO with the B1 Structure
MgO is an abundant mineral in the rocky mantle of terrestrial planets, but its melting behaviors remain enigmatic. Here we introduce a simple theoretical model to investigate the B1-liquid transition of MgO up to 370 GPa. Vibrational free energies of B1-MgO are fully computed by the moment recurrenc...
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Published in | arXiv.org |
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Main Authors | , |
Format | Paper |
Language | English |
Published |
Ithaca
Cornell University Library, arXiv.org
06.04.2021
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Subjects | |
Online Access | Get full text |
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Summary: | MgO is an abundant mineral in the rocky mantle of terrestrial planets, but its melting behaviors remain enigmatic. Here we introduce a simple theoretical model to investigate the B1-liquid transition of MgO up to 370 GPa. Vibrational free energies of B1-MgO are fully computed by the moment recurrence technique in quantum statistical physics. On that basis, we associate the melting temperature with the isothermal bulk modulus via the work-heat equivalence principle. This strategy allows us to quantitatively explain recent experimental data. Our numerical analyses would yield insights into planetary dynamics and evolution. |
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ISSN: | 2331-8422 |