B8Ce2Cl2H4O16
B8Ce2Cl2H4O16 is a stable, semiconducting inorganic compound composed of boron, cerium, chlorine, hydrogen, and oxygen.
About B8Ce2Cl2H4O16
B8Ce2Cl2H4O16 is a complex inorganic compound characterized by its semiconducting electronic nature. As a thermodynamically stable phase residing on the convex hull, it represents a robust structural configuration within its chemical system.
This material is of significant interest for researchers investigating specialized electronic properties in multi-element frameworks. Its stability suggests potential for integration into advanced functional materials where reliable performance is required.
Key Properties
Cross-validated computational properties for B8Ce2Cl2H4O16, 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 B8Ce2Cl2H4O16, 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. |
|---|---|---|---|---|---|
| Cc (No. 9) | monoclinic | 0.45 | 0.0000 | -7.737 | 3.26 |
| No. 0 | unknown | — | — | — | 0.84 |
| Cc (No. 9) | — | — | — | — | — |
Applications
Where B8Ce2Cl2H4O16 is used.
Frequently Asked Questions
Common questions about B8Ce2Cl2H4O16, answered from cross-validated data.
What is B8Ce2Cl2H4O16?
B8Ce2Cl2H4O16 is a stable, semiconducting inorganic compound composed of boron, cerium, chlorine, hydrogen, and oxygen.
What is B8Ce2Cl2H4O16 used for?
What is the band gap of B8Ce2Cl2H4O16?
Is B8Ce2Cl2H4O16 a metal, semiconductor, or insulator?
Is B8Ce2Cl2H4O16 thermodynamically stable?
What is the crystal structure of B8Ce2Cl2H4O16?
What is the density of B8Ce2Cl2H4O16?
How many polymorphs of B8Ce2Cl2H4O16 are known?
What elements does B8Ce2Cl2H4O16 contain?
Where does the data for B8Ce2Cl2H4O16 come from?
How It Compares
As a unique compound within its specific chemical system, B8Ce2Cl2H4O16 serves as a primary reference point for understanding the interplay between boron, cerium, and halide-oxygen coordination. It stands as a distinct structural entity that provides insight into the formation of stable, semiconducting architectures in complex inorganic chemistry.
Data sources & attribution
- materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
- cod — Data from the Crystallography Open Database. Cite: Grazulis et al., Nucleic Acids Res. 40, D420 (2012).
- aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).
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