Cd1Y2Zn1
Cd1Y2Zn1 is a semimetallic intermetallic compound characterized by its complex structural arrangements and metastable nature.

About Cd1Y2Zn1
Cd1Y2Zn1 is a complex intermetallic compound composed of cadmium, yttrium, and zinc. It exhibits a near-zero-gap electronic character, placing it in the category of semimetallic materials that bridge the gap between conductors and insulators.
Due to its position above the thermodynamic hull, this compound is considered metastable, making it a subject of significant interest for researchers studying phase stability and structural diversity. Its existence across multiple reported structures highlights the intricate bonding behaviors present in ternary transition metal systems.
Key Properties
Cross-validated computational properties for Cd1Y2Zn1, 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 Cd1Y2Zn1, 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. |
|---|---|---|---|---|---|
| Immm (No. 71) | orthorhombic | 0.03 | 2.4447 | -1.695 | 0.42 |
| P4/mmm (No. 123) | — | — | — | — | — |
| P4/mmm (No. 123) | — | — | — | — | — |
| P4/mmm (No. 123) | — | — | — | — | — |
| P4mm (No. 99) | — | — | — | — | — |
| P4/mmm (No. 123) | — | — | — | — | — |
| Imm2 (No. 44) | — | — | — | — | — |
| P2/m (No. 10) | — | — | — | — | — |
| Fm-3m (No. 225) | — | — | — | — | — |
| P4mm (No. 99) | — | — | — | — | — |
| Cm (No. 8) | — | — | — | — | — |
| P4mm (No. 99) | — | — | — | — | — |
Applications
Where Cd1Y2Zn1 is used.
Frequently Asked Questions
Common questions about Cd1Y2Zn1, answered from cross-validated data.
What is Cd1Y2Zn1?
Cd1Y2Zn1 is a semimetallic intermetallic compound characterized by its complex structural arrangements and metastable nature.
What is Cd1Y2Zn1 used for?
What is the band gap of Cd1Y2Zn1?
Is Cd1Y2Zn1 a metal, semiconductor, or insulator?
Is Cd1Y2Zn1 thermodynamically stable?
What is the crystal structure of Cd1Y2Zn1?
What is the density of Cd1Y2Zn1?
How many polymorphs of Cd1Y2Zn1 are known?
What elements does Cd1Y2Zn1 contain?
Where does the data for Cd1Y2Zn1 come from?
How It Compares
As a unique ternary intermetallic, Cd1Y2Zn1 serves as a distinct example of how combining rare-earth yttrium with transition metals like cadmium and zinc can yield complex electronic states. It represents a specialized case within the broader landscape of intermetallic compounds where structural metastability and semimetallic behavior are key features of interest.
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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