MgFe4CoO8

MgFe4CoO8 is a metastable, semiconducting spinel oxide containing magnesium, iron, and cobalt, primarily studied for its potential in advanced ceramic applications.

Crystal structure of MgFe4CoO8 (trigonal, R3m (No. 160))
Ground-state structure · Materials Project
Overview

About MgFe4CoO8

MgFe4CoO8 is a complex oxide belonging to the spinel and hexagonal ferrite family. As a semiconducting material, it exhibits unique electronic characteristics that arise from the specific arrangement of magnesium, iron, cobalt, and oxygen atoms within its crystal lattice. Its metastable nature makes it a subject of significant interest for researchers investigating phase transitions and structural stability in multicomponent oxides. Due to its distinct composition, it serves as a valuable case study for understanding how transition metal substitution influences the electronic behavior of spinel-structured compounds. It is primarily utilized in fundamental materials research aimed at developing advanced magnetic and electronic ceramics.

At a glance

Key Properties

Cross-validated computational properties for MgFe4CoO8, aggregated across 3 databases.

Band Gap

1.47 eV
Range across DFT structures

Energy Above Hull

0.072 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

5
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for MgFe4CoO8, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
R3m (No. 160)trigonal1.470.0716-7.6764.64
R3m (No. 160)Trigonal4.64
R3m (No. 160)Trigonal5.01
R3m (No. 160)Trigonal4.86
R3m (No. 160)
Uses

Applications

Where MgFe4CoO8 is used.

Fundamental materials researchAdvanced magnetic ceramicsElectronic ceramics development
Reference

Frequently Asked Questions

Common questions about MgFe4CoO8, answered from cross-validated data.

What is MgFe4CoO8?

MgFe4CoO8 is a metastable, semiconducting spinel oxide containing magnesium, iron, and cobalt, primarily studied for its potential in advanced ceramic applications.

More questions
What is MgFe4CoO8 used for?
MgFe4CoO8 is used in fundamental materials research, advanced magnetic ceramics, and electronic ceramics development.
What is the band gap of MgFe4CoO8?
MgFe4CoO8 has a DFT-computed band gap of 1.47 eV across 5 reported structures.
Is MgFe4CoO8 a metal, semiconductor, or insulator?
With a band gap up to 1.47 eV it is a semiconductor.
Is MgFe4CoO8 thermodynamically stable?
MgFe4CoO8 has a lowest energy above hull of 0.072 eV/atom (metastable).
What is the crystal structure of MgFe4CoO8?
The lowest-energy reported polymorph of MgFe4CoO8 is trigonal symmetry, space group R3m (No. 160).
What is the density of MgFe4CoO8?
The computed density of the ground-state structure of MgFe4CoO8 is 4.64 g/cm³.
How many polymorphs of MgFe4CoO8 are known?
5 structures of MgFe4CoO8 are reported across 3 databases, spanning 1 distinct space group.
What elements does MgFe4CoO8 contain?
MgFe4CoO8 contains Co, Fe, Mg, and O (4 elements).
Where does the data for MgFe4CoO8 come from?
MgFe4CoO8 data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

Within the spinel and hexagonal ferrites class.

Within the diverse group of ferrites, MgFe4CoO8 occupies a niche position compared to more common, thermodynamically stable spinels like MgFe2O4 or ZnFe2O4. While those simpler ferrites are extensively characterized for their magnetic properties, MgFe4CoO8 represents a more complex, metastable variation that challenges standard structural models, distinguishing it from the more widely utilized ferrite systems like MnFe2O4 or the perovskite-related SrFeO3.

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Related Compounds

Other Spinel and Hexagonal Ferrites 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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