Crystal Lab › Oxides & frameworks
Magnetite (inverse spinel) Fe₃O₄
Inverse spinel AB₂O₄ · space group Fd-3m (No. 227) · Z = 8
Unit cell
- Lattice constants
- a = 8.396 Å, b = 8.396 Å, c = 8.396 Å; α = 90°, β = 90°, γ = 90°
- Cell volume
- 591.9 ų
- Atoms in the cell
- 56 (Fe 24, O 32)
- Formula units Z
- 8
- Calculated density
- 5.20 g cm⁻³
- Shortest contact
- 1.876 Å
Coordination
- Fe³⁺ (tet)
- CN 4 at 1.88 Å (4 O)
- Fe²⁺/Fe³⁺ (oct)
- CN 6 at 2.07 Å (6 O)
- O
- CN 4 at 1.88 Å (4 Fe)
About the structure
- The same framework as spinel, but with the cations swapped round: the tetrahedral (8a) sites hold Fe³⁺, and the octahedral (16d) sites hold Fe²⁺ and Fe³⁺ in equal numbers — an inverse spinel, written Fe³⁺[Fe²⁺Fe³⁺]O₄.
- Coordination: Fe(tet) 4, Fe(oct) 6, O 4.
- Fast electron hopping between Fe²⁺ and Fe³⁺ on the octahedral sites makes magnetite a conductor and a ferrimagnet (lodestone).
- Mg₂TiO₄, NiFe₂O₄ and CoFe₂O₄ are also inverse; MgAl₂O₄ and ZnFe₂O₄ are normal.
Atom positions (fractional, one cell)
| Atom | x | y | z |
|---|---|---|---|
| Fe Fe³⁺ (tet) | 0.0000 | 0.0000 | 0.0000 |
| Fe Fe³⁺ (tet) | 0.0000 | 0.5000 | 0.5000 |
| Fe Fe³⁺ (tet) | 0.5000 | 0.0000 | 0.5000 |
| Fe Fe³⁺ (tet) | 0.5000 | 0.5000 | 0.0000 |
| Fe Fe³⁺ (tet) | 0.7500 | 0.2500 | 0.7500 |
| Fe Fe³⁺ (tet) | 0.7500 | 0.7500 | 0.2500 |
| Fe Fe³⁺ (tet) | 0.2500 | 0.2500 | 0.2500 |
| Fe Fe³⁺ (tet) | 0.2500 | 0.7500 | 0.7500 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.6250 | 0.6250 | 0.6250 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.6250 | 0.1250 | 0.1250 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.1250 | 0.6250 | 0.1250 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.1250 | 0.1250 | 0.6250 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.3750 | 0.8750 | 0.1250 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.3750 | 0.3750 | 0.6250 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.8750 | 0.8750 | 0.6250 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.8750 | 0.3750 | 0.1250 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.8750 | 0.1250 | 0.3750 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.8750 | 0.6250 | 0.8750 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.3750 | 0.1250 | 0.8750 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.3750 | 0.6250 | 0.3750 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.1250 | 0.3750 | 0.8750 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.1250 | 0.8750 | 0.3750 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.6250 | 0.3750 | 0.3750 |
| Fe Fe²⁺/Fe³⁺ (oct) | 0.6250 | 0.8750 | 0.8750 |
| O | 0.3790 | 0.3790 | 0.3790 |
| O | 0.3790 | 0.8790 | 0.8790 |
| O | 0.8790 | 0.3790 | 0.8790 |
| O | 0.8790 | 0.8790 | 0.3790 |
| O | 0.6210 | 0.1210 | 0.8790 |
| O | 0.6210 | 0.6210 | 0.3790 |
| O | 0.1210 | 0.1210 | 0.3790 |
| O | 0.1210 | 0.6210 | 0.8790 |
| O | 0.1210 | 0.8790 | 0.6210 |
| O | 0.1210 | 0.3790 | 0.1210 |
| O | 0.6210 | 0.8790 | 0.1210 |
| O | 0.6210 | 0.3790 | 0.6210 |
| O | 0.8790 | 0.6210 | 0.1210 |
| O | 0.8790 | 0.1210 | 0.6210 |
| O | 0.3790 | 0.6210 | 0.6210 |
| O | 0.3790 | 0.1210 | 0.1210 |
| O | 0.1290 | 0.6290 | 0.3710 |
| O | 0.1290 | 0.1290 | 0.8710 |
| O | 0.6290 | 0.6290 | 0.8710 |
| O | 0.6290 | 0.1290 | 0.3710 |
| O | 0.8710 | 0.8710 | 0.8710 |
| O | 0.8710 | 0.3710 | 0.3710 |
| O | 0.3710 | 0.8710 | 0.3710 |
| O | 0.3710 | 0.3710 | 0.8710 |
| O | 0.6290 | 0.3710 | 0.1290 |
| O | 0.6290 | 0.8710 | 0.6290 |
| O | 0.1290 | 0.3710 | 0.6290 |
| O | 0.1290 | 0.8710 | 0.1290 |
| O | 0.3710 | 0.1290 | 0.6290 |
| O | 0.3710 | 0.6290 | 0.1290 |
| O | 0.8710 | 0.1290 | 0.1290 |
| O | 0.8710 | 0.6290 | 0.6290 |
Z, coordination numbers, distances, density and packing on this page are computed from these coordinates.
Other oxides & frameworks
Perovskite (ideal cubic)SrTiO₃ · ABO₃Rhenium trioxideReO₃ · AB₃SpinelMgAl₂O₄ · AB₂O₄CorundumAl₂O₃ · A₂B₃CupriteCu₂O · A₂BPyriteFeS₂ · AB₂ with S₂²⁻ pairsCalciteCaCO₃ · CarbonateMolybdeniteMoS₂ · Layered AB₂, 6:3ScheeliteCaWO₄ · ABO₄ tetrahedral oxo-anionIce Ih (oxygen framework)H₂O · Hydrogen-bonded network
Open Magnetite (inverse spinel) in the 3D viewer → · All structures