Cr2Na4O8
Cr2Na4O8 has a DFT band gap of 2.81–3.01 eV across 7 reported structures in 3 space groups. Cross-validated across 3 computational databases.
At a glance
Key Properties
Cross-validated computational properties for Cr2Na4O8, 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.
2.81–3.01 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.
0.000 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.
On hull (stable)
2 DFT sources
StructuresCount of reported calculated crystal structures for this formula, including alternate polymorphs, source databases, and observed space groups.
7
3 databases, 3 space groups
Reference
Frequently Asked Questions
Common questions about Cr2Na4O8, answered from cross-validated data.
What is the band gap of Cr2Na4O8?
Cr2Na4O8 has a DFT-computed band gap of 2.81–3.01 eV across 7 reported structures.
More questions
Is Cr2Na4O8 a metal, semiconductor, or insulator?
With a wide band gap up to 3.01 eV it is an insulator / wide-band-gap material.
Is Cr2Na4O8 thermodynamically stable?
Yes — Cr2Na4O8 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Cr2Na4O8 are known?
7 structures of Cr2Na4O8 are reported across 3 databases, spanning 3 distinct space groups.
What elements does Cr2Na4O8 contain?
Cr2Na4O8 contains Cr, Na, and O (3 elements).
Where does the data for Cr2Na4O8 come from?
Cr2Na4O8 data is cross-referenced from latticegraph.
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Related Compounds
Other Layered Sodium Transition-Metal Oxides in the database.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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