Cl6Cs2InLi
Cl6Cs2InLi has a DFT band gap of 2.78–3.24 eV across 4 reported structures in 2 space groups. Cross-validated across 2 computational databases.
At a glance
Key Properties
Cross-validated computational properties for Cl6Cs2InLi, 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.
2.78–3.24 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)
1 DFT source
StructuresCount of reported calculated crystal structures for this formula, including alternate polymorphs, source databases, and observed space groups.
4
2 databases, 2 space groups
Reference
Frequently Asked Questions
Common questions about Cl6Cs2InLi, answered from cross-validated data.
What is the band gap of Cl6Cs2InLi?
Cl6Cs2InLi has a DFT-computed band gap of 2.78–3.24 eV across 4 reported structures.
More questions
Is Cl6Cs2InLi a metal, semiconductor, or insulator?
With a wide band gap up to 3.24 eV it is an insulator / wide-band-gap material.
Is Cl6Cs2InLi thermodynamically stable?
Yes — Cl6Cs2InLi sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Cl6Cs2InLi are known?
4 structures of Cl6Cs2InLi are reported across 2 databases, spanning 2 distinct space groups.
What elements does Cl6Cs2InLi contain?
Cl6Cs2InLi contains Cl, Cs, In, and Li (4 elements).
Where does the data for Cl6Cs2InLi come from?
Cl6Cs2InLi data is cross-referenced from latticegraph.
Explore
Related Compounds
Other Halide Solid Electrolytes in the database.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
Analyze Cl6Cs2InLi in the Lattice Graph platform
Polymorph comparison, confidence scoring, supply-chain risk, and patent monitoring — across 53 integrated data sources.
Explore the Platform →