O14Rb12Si4
This compound is a complex rubidium silicate material characterized by its specific crystalline arrangement of oxygen, rubidium, and silicon atoms. It is primarily utilized in solid-state chemistry research to investigate the structural properties and phase behaviors of alkali metal silicates.
Key Properties
Cross-validated computational properties for O14Rb12Si4, 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 O14Rb12Si4, 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 | 3.14 | 0.0000 | -5.851 | 3.95 |
| — | — | — | — | — | 3.78 |
| P21/c (No. 14) | — | — | — | — | — |
Applications
Where O14Rb12Si4 is used.
Frequently Asked Questions
Common questions about O14Rb12Si4, answered from cross-validated data.
What is O14Rb12Si4?
This compound is a complex rubidium silicate material characterized by its specific crystalline arrangement of oxygen, rubidium, and silicon atoms. It is primarily utilized in solid-state chemistry research to investigate the structural properties and phase behaviors of alkali metal silicates.
What is O14Rb12Si4 used for?
What is the band gap of O14Rb12Si4?
Is O14Rb12Si4 a metal, semiconductor, or insulator?
Is O14Rb12Si4 thermodynamically stable?
What is the crystal structure of O14Rb12Si4?
What is the density of O14Rb12Si4?
How many polymorphs of O14Rb12Si4 are known?
What elements does O14Rb12Si4 contain?
Where does the data for O14Rb12Si4 come from?
Data sources & attribution
- materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
- omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
- aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).
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