FeSbO4

Iron antimonate · Iron antimony oxide

Iron antimonate is a mixed metal oxide that typically adopts a rutile-type crystal structure. It is primarily investigated for its potential as a catalyst in chemical synthesis and as a functional material in electrochemical devices.

Crystal structure of FeSbO4 (orthorhombic, Cmmm (No. 65))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Iron antimonate, aggregated across 3 databases.

Band Gap

1.00–1.43 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

22
3 databases, 4 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for FeSbO4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Cmmm (No. 65)orthorhombic1.000.0000-7.2336.02
I41md (No. 109)tetragonal0.000.0001-7.2336.25
Cmm2 (No. 35)orthorhombic1.220.0162-7.2176.17
I-4m2 (No. 119)tetragonal1.430.0286-7.2045.18
I-4m2 (No. 119)Tetragonal5.35
Cmm2 (No. 35)Orthorhombic5.80
I-4m2 (No. 119)Tetragonal5.59
I41md (No. 109)Tetragonal6.02
I41md (No. 109)Tetragonal5.83
Cmmm (No. 65)Orthorhombic6.30
Cmmm (No. 65)Orthorhombic5.80
Cmmm (No. 65)
Uses

Applications

Where Iron antimonate is used.

CatalysisGas sensingElectrochemical energy storage research
Reference

Frequently Asked Questions

Common questions about Iron antimonate, answered from cross-validated data.

What is FeSbO4?

Iron antimonate is a mixed metal oxide that typically adopts a rutile-type crystal structure. It is primarily investigated for its potential as a catalyst in chemical synthesis and as a functional material in electrochemical devices.

More questions
What is FeSbO4 used for?
Iron antimonate (FeSbO4) is used in catalysis, gas sensing, and electrochemical energy storage research.
What is the band gap of FeSbO4?
Iron antimonate (FeSbO4) has a DFT-computed band gap of 1.00–1.43 eV across 22 reported structures.
Is FeSbO4 a metal, semiconductor, or insulator?
With a band gap up to 1.43 eV it is a semiconductor.
Is FeSbO4 thermodynamically stable?
Yes — Iron antimonate (FeSbO4) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of FeSbO4?
The lowest-energy reported polymorph of Iron antimonate (FeSbO4) is orthorhombic symmetry, space group Cmmm (No. 65).
What is the density of FeSbO4?
The computed density of the ground-state structure of Iron antimonate (FeSbO4) is 6.02 g/cm³.
How many polymorphs of FeSbO4 are known?
22 structures of FeSbO4 are reported across 3 databases, spanning 4 distinct space groups.
What elements does FeSbO4 contain?
Iron antimonate (FeSbO4) contains Fe, O, and Sb (3 elements).
Where does the data for FeSbO4 come from?
FeSbO4 data is cross-referenced from materials_project, mpaloe, jarvis.
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Related Compounds

Other Oxide Oxygen-Evolution Catalysts in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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