Mg3Fe2O7

This complex oxide belongs to a class of magnesium-iron materials often studied for their structural properties and potential magnetic behavior. It is primarily utilized in academic research to explore advanced ceramic synthesis and the fundamental physics of transition metal oxides.

Crystal structure of Mg3Fe2O7 (orthorhombic, Cmc21 (No. 36))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Mg3Fe2O7, aggregated across 3 databases.

Band Gap

0.39 eV
Range across DFT structures

Energy Above Hull

0.118 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

6
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Mg3Fe2O7, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Cmc21 (No. 36)orthorhombic0.390.1179-6.8634.04
Cmc21 (No. 36)Orthorhombic4.04
Cmc21 (No. 36)Orthorhombic4.41
Cmc21 (No. 36)Orthorhombic4.25
Cmc21 (No. 36)
Cmc21 (No. 36)
Uses

Applications

Where Mg3Fe2O7 is used.

Materials science researchSolid-state chemistry studiesCatalysis exploration
Reference

Frequently Asked Questions

Common questions about Mg3Fe2O7, answered from cross-validated data.

What is Mg3Fe2O7?

This complex oxide belongs to a class of magnesium-iron materials often studied for their structural properties and potential magnetic behavior. It is primarily utilized in academic research to explore advanced ceramic synthesis and the fundamental physics of transition metal oxides.

More questions
What is Mg3Fe2O7 used for?
Mg3Fe2O7 is used in materials science research, solid-state chemistry studies, and catalysis exploration.
What is the band gap of Mg3Fe2O7?
Mg3Fe2O7 has a DFT-computed band gap of 0.39 eV across 6 reported structures.
Is Mg3Fe2O7 a metal, semiconductor, or insulator?
With a band gap up to 0.39 eV it is a semiconductor.
Is Mg3Fe2O7 thermodynamically stable?
Mg3Fe2O7 has a lowest energy above hull of 0.118 eV/atom (above hull).
What is the crystal structure of Mg3Fe2O7?
The lowest-energy reported polymorph of Mg3Fe2O7 is orthorhombic symmetry, space group Cmc21 (No. 36).
What is the density of Mg3Fe2O7?
The computed density of the ground-state structure of Mg3Fe2O7 is 4.04 g/cm³.
How many polymorphs of Mg3Fe2O7 are known?
6 structures of Mg3Fe2O7 are reported across 3 databases, spanning 1 distinct space group.
What elements does Mg3Fe2O7 contain?
Mg3Fe2O7 contains Fe, Mg, and O (3 elements).
Where does the data for Mg3Fe2O7 come from?
Mg3Fe2O7 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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