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Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure

  • Camilla Haavik , Svein Stølen EMAIL logo , Helmer Fjellvåg , Michael Hanfland and Daniel Häusermann
Published/Copyright: March 26, 2015
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American Mineralogist
From the journal American Mineralogist Volume 85 Issue 3-4

Abstract

Fe3O4 has been studied by high-pressure diffraction to 43 GPa. No major changes in the spinel-type structure of magnetite is observed below 21.8 GPa. At higher pressure a sluggish transition to a highpressure modification, h-Fe3O4, is observed. The X-ray diffraction pattern of the high-pressure modification is consistent with the orthorhombic unit cell (CaMn2O4-type structure, space group Pbcm) recently proposed for h-Fe3O4 by Fei et al. (1999), however, it is also consistent with a more symmetric CaTi2O4- type structure (space group Bbmm). Bulk modulus values for magnetite, KT0 = 217 (2) GPa, and h-Fe3O4, KT0 = 202 (7) GPa, are calculated from the pressure-volume data using a third-order Birch-Murnaghan equation of state. A thermodynamic analysis of the Fe-O system at high pressure is presented. The proposed equation of state of h-Fe3O4 gives an increased stability of wüstite relatively to a two-phase mixture of iron and h-Fe3O4 compared to earlier equations of state and removes an inconsistency in the thermodynamic description of the Fe-O system at high pressure.

Received: 1999-5-5
Accepted: 1999-11-8
Published Online: 2015-3-26
Published in Print: 2000-4-1

© 2015 by Walter de Gruyter Berlin/Boston

Articles in the same Issue

  1. Iron concentration and the physical processes of dynamic oxidation in an alkaline earth aluminosilicate glass
  2. A crystal chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies
  3. Mineralogy of mafic xenoliths and their reaction zones in the olivine lamproite from Prairie Creek Arkansas and the paragenesis of haggertyite, Ba [Fe6Ti5Mg]O19
  4. Magmatic anhydrite in granitic rocks: First occurrence and potential petrologic consequences
  5. Crystal chemistry of Al-rich biotites coexisting with muscovites in peraluminous granites
  6. Spectroscopic and structural properties of synthetic micas on the annite-siderophyllite binary: Synthesis, crystal structure refinement, Mössbauer, and infrared spectroscopy
  7. Thermodynamic properties of tremolite: A correction and some comments
  8. Raman spectroscopic characteristics of Mg-Fe-Ca pyroxenes
  9. Hydrogen in diopside: Diffusion profiles
  10. Diffusion of C and O in calcite at 100 MPa
  11. Solubility and stability of zeolites in aqueous solution: II. Calcic clinoptilolite and mordenite
  12. TEM and SFM of exsolution and twinning in an alkali feldspar
  13. Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure
  14. Optimization of site occupancies in minerals using quadratic programming
  15. Leverage analysis and structure refinement of minerals
  16. The absolute energy positions of conduction and valence bands of selected semiconducting minerals
  17. Antiferroelectric phase transition in titanite: Excess entropy and short range order
  18. P4/n and P4nc long-range ordering in low-temperature vesuvianites
  19. Tetrahedral vacancies and cation ordering in low-temperature Mn-bearing vesuvianites: Indication of a hydrogarnet-like substitution
  20. Sodic-ferripedrizite, a new monoclinic amphibole bridging the magnesium-iron-manganese-lithium and the sodium-calcium groups
  21. The crystal structure of peprossiite-(Ce), an anhydrous REE and Al mica-like borate with square-pyramidal coordination for Al
  22. Crystal chemistry of the new mineral brandholzite, Mg(H2O)6[Sb(OH)6]2, and of the synthetic analogues M2+(H2O)6[Sb(OH)6]2 (M2+ = Mg, Co)
  23. Letters. In-situ Raman spectra of dissolved silica species in aqueous fluids to 900 °C and 14 kbar
  24. Quetzalcoatlite: A new octahedral-tetrahedral structure from a 2 × 2 × 40 μm3 crystal at the Advanced Photon Source-GSE-CARS Facility
  25. Bonding and dynamics of Mg in pyrope: a theoretical investigation
  26. Structure of a new Al-rich phase, [K, Na]0.9[Mg, Fe]2[Mg, Fe, Al, Si]6O12, synthesized at 24 GPa
  27. Core level electron binding energies of realgar (As4S4)
  28. Oxidation of {100} and {111} surfaces of pyrite: Effects of preparation method
https://doi.org/10.2138/am-2000-0413

Articles in the same Issue

  1. Iron concentration and the physical processes of dynamic oxidation in an alkaline earth aluminosilicate glass
  2. A crystal chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene DTi values in petrogenetic studies
  3. Mineralogy of mafic xenoliths and their reaction zones in the olivine lamproite from Prairie Creek Arkansas and the paragenesis of haggertyite, Ba [Fe6Ti5Mg]O19
  4. Magmatic anhydrite in granitic rocks: First occurrence and potential petrologic consequences
  5. Crystal chemistry of Al-rich biotites coexisting with muscovites in peraluminous granites
  6. Spectroscopic and structural properties of synthetic micas on the annite-siderophyllite binary: Synthesis, crystal structure refinement, Mössbauer, and infrared spectroscopy
  7. Thermodynamic properties of tremolite: A correction and some comments
  8. Raman spectroscopic characteristics of Mg-Fe-Ca pyroxenes
  9. Hydrogen in diopside: Diffusion profiles
  10. Diffusion of C and O in calcite at 100 MPa
  11. Solubility and stability of zeolites in aqueous solution: II. Calcic clinoptilolite and mordenite
  12. TEM and SFM of exsolution and twinning in an alkali feldspar
  13. Equation of state of magnetite and its high-pressure modification: Thermodynamics of the Fe-O system at high pressure
  14. Optimization of site occupancies in minerals using quadratic programming
  15. Leverage analysis and structure refinement of minerals
  16. The absolute energy positions of conduction and valence bands of selected semiconducting minerals
  17. Antiferroelectric phase transition in titanite: Excess entropy and short range order
  18. P4/n and P4nc long-range ordering in low-temperature vesuvianites
  19. Tetrahedral vacancies and cation ordering in low-temperature Mn-bearing vesuvianites: Indication of a hydrogarnet-like substitution
  20. Sodic-ferripedrizite, a new monoclinic amphibole bridging the magnesium-iron-manganese-lithium and the sodium-calcium groups
  21. The crystal structure of peprossiite-(Ce), an anhydrous REE and Al mica-like borate with square-pyramidal coordination for Al
  22. Crystal chemistry of the new mineral brandholzite, Mg(H2O)6[Sb(OH)6]2, and of the synthetic analogues M2+(H2O)6[Sb(OH)6]2 (M2+ = Mg, Co)
  23. Letters. In-situ Raman spectra of dissolved silica species in aqueous fluids to 900 °C and 14 kbar
  24. Quetzalcoatlite: A new octahedral-tetrahedral structure from a 2 × 2 × 40 μm3 crystal at the Advanced Photon Source-GSE-CARS Facility
  25. Bonding and dynamics of Mg in pyrope: a theoretical investigation
  26. Structure of a new Al-rich phase, [K, Na]0.9[Mg, Fe]2[Mg, Fe, Al, Si]6O12, synthesized at 24 GPa
  27. Core level electron binding energies of realgar (As4S4)
  28. Oxidation of {100} and {111} surfaces of pyrite: Effects of preparation method
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