Be4Cs8F16
Be4Cs8F16 is a stable, insulating fluoride compound formed from beryllium, cesium, and fluorine.

About Be4Cs8F16
Be4Cs8F16 is a complex fluoride compound composed of beryllium, cesium, and fluorine. As a thermodynamically stable phase located on the convex hull, it represents a well-defined structural arrangement within its chemical system.
Characterized as a wide-band-gap insulator, this material exhibits electronic properties typical of highly stable ionic solids. Its existence as a distinct crystalline phase makes it a subject of interest for fundamental studies in solid-state chemistry and materials science.
Key Properties
Cross-validated computational properties for Be4Cs8F16, 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 Be4Cs8F16, 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. |
|---|---|---|---|---|---|
| Pnma (No. 62) | orthorhombic | 6.70 | 0.0000 | -5.187 | 4.38 |
| Pnma (No. 62) | — | — | — | — | — |
| Pnma (No. 62) | orthorhombic | — | — | — | 8.93 |
| Pnma (No. 62) | — | — | — | — | — |
Applications
Where Be4Cs8F16 is used.
Frequently Asked Questions
Common questions about Be4Cs8F16, answered from cross-validated data.
What is Be4Cs8F16?
Be4Cs8F16 is a stable, insulating fluoride compound formed from beryllium, cesium, and fluorine.
What is Be4Cs8F16 used for?
What is the band gap of Be4Cs8F16?
Is Be4Cs8F16 a metal, semiconductor, or insulator?
Is Be4Cs8F16 thermodynamically stable?
What is the crystal structure of Be4Cs8F16?
What is the density of Be4Cs8F16?
How many polymorphs of Be4Cs8F16 are known?
What elements does Be4Cs8F16 contain?
Where does the data for Be4Cs8F16 come from?
How It Compares
As a unique fluoride phase, Be4Cs8F16 occupies a specialized position in inorganic chemistry. Without direct structural siblings in this specific class, it serves as a benchmark for understanding the stability and bonding interactions between alkali metals and beryllium-based anionic 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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