Ag1Al1Y2
Ag1Al1Y2 is a semiconducting ternary intermetallic compound composed of silver, aluminum, and yttrium that is considered likely to be synthesizable.
About Ag1Al1Y2
Ag1Al1Y2 is a ternary intermetallic compound composed of silver, aluminum, and yttrium. As a semiconducting material that resides near the thermodynamic hull, it is considered a viable candidate for experimental synthesis and structural characterization.
The compound is notable for its structural complexity, supported by a significant number of reported configurations within materials databases. Its electronic properties and composition make it a unique subject for fundamental studies in solid-state chemistry and materials design.
Key Properties
Cross-validated computational properties for Ag1Al1Y2, aggregated across 2 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 Ag1Al1Y2, 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. |
|---|---|---|---|---|---|
| Fm-3m (No. 225) | cubic | 0.00 | 0.0079 | -17.569 | 5.39 |
| Immm (No. 71) | orthorhombic | 0.10 | 2.5989 | -14.978 | 0.41 |
| Pm (No. 6) | — | — | — | — | — |
| P4/mmm (No. 123) | — | — | — | — | — |
| P4/mmm (No. 123) | — | — | — | — | — |
| P4/mmm (No. 123) | — | — | — | — | — |
| R-3m (No. 166) | — | — | — | — | — |
| Pmm2 (No. 25) | — | — | — | — | — |
| P4/mmm (No. 123) | — | — | — | — | — |
| P4/mmm (No. 123) | — | — | — | — | — |
| Fm-3m (No. 225) | — | — | — | — | — |
| P4mm (No. 99) | — | — | — | — | — |
Applications
Where Ag1Al1Y2 is used.
Frequently Asked Questions
Common questions about Ag1Al1Y2, answered from cross-validated data.
What is Ag1Al1Y2?
Ag1Al1Y2 is a semiconducting ternary intermetallic compound composed of silver, aluminum, and yttrium that is considered likely to be synthesizable.
What is Ag1Al1Y2 used for?
What is the band gap of Ag1Al1Y2?
Is Ag1Al1Y2 a metal, semiconductor, or insulator?
Is Ag1Al1Y2 thermodynamically stable?
What is the crystal structure of Ag1Al1Y2?
What is the density of Ag1Al1Y2?
How many polymorphs of Ag1Al1Y2 are known?
What elements does Ag1Al1Y2 contain?
Where does the data for Ag1Al1Y2 come from?
How It Compares
As a specialized ternary phase, Ag1Al1Y2 represents a distinct point in the chemical space of silver-aluminum-yttrium alloys, serving as a benchmark for understanding how these specific elements interact to form stable semiconducting architectures.
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).
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