H4Al6F2Li6O28P6
H4Al6F2Li6O28P6 has a DFT band gap of 5.77 eV across 3 reported structures in 1 space group. Cross-validated across 2 computational databases.
At a glance
Key Properties
Cross-validated computational properties for H4Al6F2Li6O28P6, 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.
5.77 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.
0.011 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)
1 DFT source
StructuresCount of reported calculated crystal structures for this formula, including alternate polymorphs, source databases, and observed space groups.
3
2 databases, 1 space group
Reference
Frequently Asked Questions
Common questions about H4Al6F2Li6O28P6, answered from cross-validated data.
What is the band gap of H4Al6F2Li6O28P6?
H4Al6F2Li6O28P6 has a DFT-computed band gap of 5.77 eV across 3 reported structures.
More questions
Is H4Al6F2Li6O28P6 a metal, semiconductor, or insulator?
With a wide band gap up to 5.77 eV it is an insulator / wide-band-gap material.
Is H4Al6F2Li6O28P6 thermodynamically stable?
H4Al6F2Li6O28P6 has a lowest energy above hull of 0.011 eV/atom (near hull (likely stable)).
How many polymorphs of H4Al6F2Li6O28P6 are known?
3 structures of H4Al6F2Li6O28P6 are reported across 2 databases, spanning 1 distinct space group.
What elements does H4Al6F2Li6O28P6 contain?
H4Al6F2Li6O28P6 contains Al, F, H, Li, O, and P (6 elements).
Where does the data for H4Al6F2Li6O28P6 come from?
H4Al6F2Li6O28P6 data is cross-referenced from latticegraph.
Explore
Related Compounds
Other NASICON-Type Electrolytes in the database.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
Analyze H4Al6F2Li6O28P6 in the Lattice Graph platform
Polymorph comparison, confidence scoring, supply-chain risk, and patent monitoring — across 53 integrated data sources.
Explore the Platform →