Cl2O24Sr10V6
Cl2O24Sr10V6 is a thermodynamically stable, insulating oxychloride compound composed of strontium, vanadium, oxygen, and chlorine.
About Cl2O24Sr10V6
Cl2O24Sr10V6 is a complex inorganic compound characterized by its insulating electronic nature and high thermodynamic stability. Its structural integrity, confirmed by its position on the convex hull, makes it a significant subject for researchers investigating multi-component oxychloride systems. The material exhibits a distinct atomic arrangement that balances strontium, vanadium, oxygen, and chlorine ions to maintain a robust lattice. This stability is essential for its potential integration into specialized electronic or optical applications where insulating behavior is required. Due to its unique composition, it serves as a valuable reference point for understanding the interplay between transition metals and halide anions in oxide frameworks.
Key Properties
Cross-validated computational properties for Cl2O24Sr10V6, 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 Cl2O24Sr10V6, 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. |
|---|---|---|---|---|---|
| P63/m (No. 176) | hexagonal | 3.95 | 0.0000 | -7.669 | 3.93 |
| P63/m (No. 176) | — | — | — | — | — |
| P63/m (No. 176) | — | — | — | — | — |
| P63/m (No. 176) | — | — | — | — | — |
| — | — | — | — | — | 3.90 |
Frequently Asked Questions
Common questions about Cl2O24Sr10V6, answered from cross-validated data.
What is Cl2O24Sr10V6?
Cl2O24Sr10V6 is a thermodynamically stable, insulating oxychloride compound composed of strontium, vanadium, oxygen, and chlorine.
What is the band gap of Cl2O24Sr10V6?
Is Cl2O24Sr10V6 a metal, semiconductor, or insulator?
Is Cl2O24Sr10V6 thermodynamically stable?
What is the crystal structure of Cl2O24Sr10V6?
What is the density of Cl2O24Sr10V6?
How many polymorphs of Cl2O24Sr10V6 are known?
What elements does Cl2O24Sr10V6 contain?
Where does the data for Cl2O24Sr10V6 come from?
How It Compares
As a unique member of its chemical system, this compound represents a distinct structural configuration within the broader landscape of strontium-vanadium oxychlorides. Unlike simpler binary or ternary oxides, its complex stoichiometry allows for a highly stable crystalline architecture that is rarely replicated in simpler materials, positioning it as a specialized candidate for structural studies.
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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