Ca2FeMoO6
Ca2FeMoO6 is a semiconducting oxide compound that is considered synthesizable due to its favorable thermodynamic stability.
About Ca2FeMoO6
Ca2FeMoO6 is a complex oxide containing calcium, iron, molybdenum, and oxygen. It exhibits semiconducting electronic behavior and is positioned near the thermodynamic stability hull, suggesting it is a viable candidate for experimental synthesis and characterization in materials research.
As a member of the double perovskite-related family of oxides, this compound is significant for its potential in functional material design. Its specific electronic structure makes it a subject of interest for researchers exploring new semiconducting materials for specialized technological applications.
Key Properties
Cross-validated computational properties for Ca2FeMoO6, aggregated across 2 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.
Applications
Where Ca2FeMoO6 is used.
Frequently Asked Questions
Common questions about Ca2FeMoO6, answered from cross-validated data.
What is Ca2FeMoO6?
Ca2FeMoO6 is a semiconducting oxide compound that is considered synthesizable due to its favorable thermodynamic stability.
What is Ca2FeMoO6 used for?
What is the band gap of Ca2FeMoO6?
Is Ca2FeMoO6 a metal, semiconductor, or insulator?
Is Ca2FeMoO6 thermodynamically stable?
How many polymorphs of Ca2FeMoO6 are known?
What elements does Ca2FeMoO6 contain?
Where does the data for Ca2FeMoO6 come from?
How It Compares
As a unique oxide within its structural class, Ca2FeMoO6 serves as a critical reference point for understanding how the integration of iron and molybdenum into a calcium-based lattice influences semiconducting properties. It represents a distinct compositional space that bridges the gap between simple binary oxides and more complex transition metal-based functional materials.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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