As6Cl2O24Pb10
As6Cl2O24Pb10 is a stable, wide-gap insulating compound composed of lead, arsenic, oxygen, and chlorine, frequently studied for its complex structural properties.
About As6Cl2O24Pb10
As6Cl2O24Pb10 is a complex inorganic compound characterized by its insulating electronic nature and high thermodynamic stability. As a member of the lead arsenate chloride family, its structural integrity is confirmed by its position on the convex hull, making it a robust candidate for fundamental materials science studies.
This material is primarily utilized in academic and experimental settings to investigate the interplay between heavy metal cations and oxyanion frameworks. Its stability and distinct electronic properties provide researchers with a reliable platform for exploring complex crystal chemistry and potential applications in specialized optical or dielectric components.
Key Properties
Cross-validated computational properties for As6Cl2O24Pb10, 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 As6Cl2O24Pb10, 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. |
|---|---|---|---|---|---|
| P21/c (No. 14) | monoclinic | 3.27 | 0.0000 | -6.221 | 6.86 |
| P63/m (No. 176) | hexagonal | 3.06 | 0.0041 | -6.217 | 7.28 |
| P63/m (No. 176) | — | — | — | — | — |
| P63/m (No. 176) | — | — | — | — | — |
| P63/m (No. 176) | — | — | — | — | — |
| No. 0 | unknown | — | — | — | 1.82 |
| No. 0 | unknown | — | — | — | 1.82 |
| No. 0 | unknown | — | — | — | 1.82 |
| No. 0 | unknown | — | — | — | 3.67 |
Applications
Where As6Cl2O24Pb10 is used.
Frequently Asked Questions
Common questions about As6Cl2O24Pb10, answered from cross-validated data.
What is As6Cl2O24Pb10?
As6Cl2O24Pb10 is a stable, wide-gap insulating compound composed of lead, arsenic, oxygen, and chlorine, frequently studied for its complex structural properties.
What is As6Cl2O24Pb10 used for?
What is the band gap of As6Cl2O24Pb10?
Is As6Cl2O24Pb10 a metal, semiconductor, or insulator?
Is As6Cl2O24Pb10 thermodynamically stable?
What is the crystal structure of As6Cl2O24Pb10?
What is the density of As6Cl2O24Pb10?
How many polymorphs of As6Cl2O24Pb10 are known?
What elements does As6Cl2O24Pb10 contain?
Where does the data for As6Cl2O24Pb10 come from?
How It Compares
As a unique inorganic compound, As6Cl2O24Pb10 serves as a critical reference point for understanding the structural diversity of lead-based arsenate halides. While it operates within a specialized niche of materials, its inherent stability distinguishes it as a reliable model system for exploring the broader class of complex lead-arsenic-oxygen-chlorine 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).
- cod — Data from the Crystallography Open Database. Cite: Grazulis et al., Nucleic Acids Res. 40, D420 (2012).
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