Rb12Sb4Se16
This complex chalcogenide is a crystalline material composed of rubidium, antimony, and selenium. It is primarily studied in academic research settings for its unique structural properties and potential behavior in electronic or optical systems.
Key Properties
Cross-validated computational properties for Rb12Sb4Se16, 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 Rb12Sb4Se16, 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 | 1.44 | 0.0000 | -3.730 | 3.86 |
| — | — | — | — | — | 3.72 |
| Pnma (No. 62) | — | — | — | — | — |
Applications
Where Rb12Sb4Se16 is used.
Frequently Asked Questions
Common questions about Rb12Sb4Se16, answered from cross-validated data.
What is Rb12Sb4Se16?
This complex chalcogenide is a crystalline material composed of rubidium, antimony, and selenium. It is primarily studied in academic research settings for its unique structural properties and potential behavior in electronic or optical systems.
What is Rb12Sb4Se16 used for?
What is the band gap of Rb12Sb4Se16?
Is Rb12Sb4Se16 a metal, semiconductor, or insulator?
Is Rb12Sb4Se16 thermodynamically stable?
What is the crystal structure of Rb12Sb4Se16?
What is the density of Rb12Sb4Se16?
How many polymorphs of Rb12Sb4Se16 are known?
What elements does Rb12Sb4Se16 contain?
Where does the data for Rb12Sb4Se16 come from?
Related Compounds
Other Bismuth Chalcogenide Thermoelectrics in the database.
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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