Cl8In8O24Se8
Cl8In8O24Se8 is a thermodynamically stable, wide-gap insulating compound composed of indium, chlorine, oxygen, and selenium.
About Cl8In8O24Se8
Cl8In8O24Se8 is a complex inorganic compound characterized by its wide-gap insulating electronic profile. Its position on the thermodynamic convex hull indicates high structural stability, making it a robust candidate for specialized material research.
As a material with multiple reported structures across databases, it represents a significant subject for structural chemistry. Its distinct elemental composition of chlorine, indium, oxygen, and selenium suggests unique coordination environments that are valuable for exploring advanced solid-state architectures.
Key Properties
Cross-validated computational properties for Cl8In8O24Se8, 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.
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.
Reported Structures
Lowest-energy structures reported for Cl8In8O24Se8, ranked by energy above hull.
| Space GroupSymmetry classification of the crystal arrangement. The number is the international space-group index. | Crystal SystemBroad lattice family, such as cubic, tetragonal, monoclinic, or triclinic, derived from unit-cell symmetry. | Band Gap (eV)Electronic gap calculated for this specific reported structure, measured in electronvolts. | E above hull (eV/atom)Thermodynamic distance from the convex hull for this structure, normalized per atom. Lower is generally more stable. | E/atom (eV)Computed total energy normalized per atom. Use energy above hull, not this value alone, when comparing stability. | Density (g/cm³)Mass per relaxed crystal volume, reported in grams per cubic centimeter. |
|---|---|---|---|---|---|
| Pbca (No. 61) | orthorhombic | 3.38 | 0.0000 | -5.371 | 4.25 |
| Pbca (No. 61) | — | — | — | — | — |
| — | — | — | — | — | 4.09 |
Applications
Where Cl8In8O24Se8 is used.
Frequently Asked Questions
Common questions about Cl8In8O24Se8, answered from cross-validated data.
What is Cl8In8O24Se8?
Cl8In8O24Se8 is a thermodynamically stable, wide-gap insulating compound composed of indium, chlorine, oxygen, and selenium.
What is Cl8In8O24Se8 used for?
What is the band gap of Cl8In8O24Se8?
Is Cl8In8O24Se8 a metal, semiconductor, or insulator?
Is Cl8In8O24Se8 thermodynamically stable?
What is the crystal structure of Cl8In8O24Se8?
What is the density of Cl8In8O24Se8?
How many polymorphs of Cl8In8O24Se8 are known?
What elements does Cl8In8O24Se8 contain?
Where does the data for Cl8In8O24Se8 come from?
How It Compares
As a unique inorganic entity, this compound serves as a distinct reference point within its structural class, providing a stable baseline for investigating the interplay between heavy metal centers and chalcogen-halogen frameworks.
Data sources & attribution
- materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
- aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).
- omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
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