Ir1Li1Mg2
This is a ternary intermetallic compound composed of iridium, lithium, and magnesium. It is primarily studied in materials science research for its structural properties and potential behavior in solid-state chemistry.
Key Properties
Cross-validated computational properties for Ir1Li1Mg2, 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 Ir1Li1Mg2, 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 | 0.0000 | -3.842 | 6.55 |
| Immm (No. 71) | orthorhombic | 0.08 | 2.1432 | -1.699 | 0.42 |
| Imm2 (No. 44) | — | — | — | — | — |
| Pmm2 (No. 25) | — | — | — | — | — |
| F-43m (No. 216) | — | — | — | — | — |
| P4/mmm (No. 123) | — | — | — | — | — |
| P4mm (No. 99) | — | — | — | — | — |
| Cmmm (No. 65) | — | — | — | — | — |
| P4mm (No. 99) | — | — | — | — | — |
| Pmm2 (No. 25) | — | — | — | — | — |
| Fm-3m (No. 225) | — | — | — | — | — |
| Cmm2 (No. 35) | — | — | — | — | — |
Applications
Where Ir1Li1Mg2 is used.
Frequently Asked Questions
Common questions about Ir1Li1Mg2, answered from cross-validated data.
What is Ir1Li1Mg2?
This is a ternary intermetallic compound composed of iridium, lithium, and magnesium. It is primarily studied in materials science research for its structural properties and potential behavior in solid-state chemistry.
What is Ir1Li1Mg2 used for?
What is the band gap of Ir1Li1Mg2?
Is Ir1Li1Mg2 a metal, semiconductor, or insulator?
Is Ir1Li1Mg2 thermodynamically stable?
What is the crystal structure of Ir1Li1Mg2?
What is the density of Ir1Li1Mg2?
How many polymorphs of Ir1Li1Mg2 are known?
What elements does Ir1Li1Mg2 contain?
Where does the data for Ir1Li1Mg2 come from?
Related Compounds
Other Platinum-Group Alloy Catalysts in the database.
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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