O8W2Zn2
O8W2Zn2 has a DFT band gap of 1.20–3.52 eV across 47 reported structures in 5 space groups. Cross-validated across 4 computational databases.
At a glance
Key Properties
Cross-validated computational properties for O8W2Zn2, aggregated across 4 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.
1.20–3.52 eV
Range across DFT structures
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.
0.002 eV/atom
Best (lowest) across sources
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.
Near hull (likely stable)
2 DFT sources
StructuresCount of reported calculated crystal structures for this formula, including alternate polymorphs, source databases, and observed space groups.
47
4 databases, 5 space groups
Reference
Frequently Asked Questions
Common questions about O8W2Zn2, answered from cross-validated data.
What is the band gap of O8W2Zn2?
O8W2Zn2 has a DFT-computed band gap of 1.20–3.52 eV across 47 reported structures.
More questions
Is O8W2Zn2 a metal, semiconductor, or insulator?
With a wide band gap up to 3.52 eV it is an insulator / wide-band-gap material.
Is O8W2Zn2 thermodynamically stable?
O8W2Zn2 has a lowest energy above hull of 0.002 eV/atom (near hull (likely stable)).
How many polymorphs of O8W2Zn2 are known?
47 structures of O8W2Zn2 are reported across 4 databases, spanning 5 distinct space groups.
What elements does O8W2Zn2 contain?
O8W2Zn2 contains O, W, and Zn (3 elements).
Where does the data for O8W2Zn2 come from?
O8W2Zn2 data is cross-referenced from latticegraph.
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Related Compounds
Other Spinel Oxide Catalysts in the database.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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