MgTiO2
MgTiO2 is a semiconducting magnesium-titanium oxide that exists in multiple structural forms but is generally considered thermodynamically unstable.

About MgTiO2
MgTiO2 is a complex oxide material composed of magnesium, titanium, and oxygen. As a semiconducting compound, it represents an interesting subject for researchers investigating electronic properties within ternary oxide systems.
Despite its existence in multiple structural configurations across various databases, the material is characterized by its position above the thermodynamic hull. This suggests that it may be difficult to synthesize or maintain in a stable state under standard conditions compared to more common binary oxides.
Key Properties
Cross-validated computational properties for MgTiO2, aggregated across 3 databases.
Band GapEnergy needed to move an electron from the valence band to the conduction band. Lower or zero values tend to behave more metallic; larger gaps are more insulating or semiconducting.
Energy Above HullThermodynamic distance from the most stable set of competing phases. 0 eV/atom is on the convex hull; small positive values may still be experimentally accessible.
StabilityA plain-language summary of the best reported energy-above-hull result. It reflects whether the lowest-energy structure is on, near, or far from the stability hull.
StructuresCount of reported calculated crystal structures for this formula, including alternate polymorphs, source databases, and observed space groups.
Frequently Asked Questions
Common questions about MgTiO2, answered from cross-validated data.
What is MgTiO2?
MgTiO2 is a semiconducting magnesium-titanium oxide that exists in multiple structural forms but is generally considered thermodynamically unstable.
What is the band gap of MgTiO2?
Is MgTiO2 a metal, semiconductor, or insulator?
Is MgTiO2 thermodynamically stable?
How many polymorphs of MgTiO2 are known?
What elements does MgTiO2 contain?
Where does the data for MgTiO2 come from?
How It Compares
As a unique ternary oxide phase, MgTiO2 occupies a specialized niche in materials science. Unlike more stable and widely utilized magnesium titanates, this specific stoichiometry is often studied to understand the limits of phase formation and the structural diversity possible within the magnesium-titanium-oxygen chemical space.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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