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Wüstite

Fe0.925O

third-order Birch-Murnaghan · Original · 2000

Why this differs from similar rows?

K0 derived using the (200) reflection alone for volume, preferred by authors due to anisotropic broadening under slightly non-hydrostatic conditions; sibling row uses 3 reflections.

V₀
Unknown basis
K₀
150
GPa
Unknown
K′
4
dimensionless

Volume (V₀)

Value Unit Basis Z
Unknown basis

Reported value and unit are preserved as extracted. Z (formula units per cell) is not stored yet, so molar ↔ ų/f.u. conversion is not applied automatically.

Composition

OxideMolar
FeO0.925

Formula: Fe0.925O

Conditions & method

Tref
Pref
Structure
B1 rocksalt (Fm-3m)
Method
experiment (XRD / DAC / multianvil compression)
high-pressure synchrotron powder X-ray diffraction in diamond anvil cell (N2 pressure medium), data P <= 13 GPa
Sample
single-phase powder sample of Fe0.925O; volume from (200) reflection alone

Source

Paper
Effect of defect clustering on the high-pressure behaviour of wüstite. High-pre…
Authors
Camilla Haavik; Svein Stølen; Michael Hanfland; C. Richard A. Catlow
DOI
10.1039/b006026g
Year
2000
Journal
Physical Chemistry Chemical Physics
Origin
Original (measured or fitted in the source paper)

Evidence from the paper

The zero-pressure bulk modulus of Fe0.925O was derived using a third-order Birch-Murnaghan equation of state. Only the P-V data for P <= 13 GPa were used in the analysis and K0' was fixed to 4. The volume of Fe0.925O was calculated by two approaches; by using the (200) reflection alone, and by using the (111), (200) and (220) reflections. The two approaches gave different values for the bulk modulus, K0 = 150 ± 10 GPa and K0 = 167 ± 10 GPa, respectively.

Additional notes

ambient lattice parameter
430.4 ± 0.2 pm at ambient conditions
note
The (200)-only value (150 GPa) is the one preferred by the authors due to anisotropic broadening from slightly non-hydrostatic conditions