MgOsY2

MgOsY2 is a semiconducting ternary compound consisting of magnesium, osmium, and yttrium that exists in a metastable state.

MgOsY
Crystal structure of MgOsY2 (orthorhombic, Immm (No. 71))
Ground-state structure · Materials Project
Overview

About MgOsY2

MgOsY2 is a complex ternary material composed of magnesium, osmium, and yttrium. As a semiconducting compound, it occupies a specialized niche in materials research where electronic properties are tuned by the interplay of its constituent elements.

Despite its existence in multiple structural configurations across various databases, the compound is characterized as being above the thermodynamic hull. This suggests that while it can be synthesized or modeled, it remains in a metastable state that requires specific conditions for stabilization.

At a glance

Key Properties

Cross-validated computational properties for MgOsY2, aggregated across 3 databases.

Band Gap

0.13 eV
Range across DFT structures

Energy Above Hull

2.698 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

9
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for MgOsY2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Immm (No. 71)orthorhombic0.132.6980-3.9420.58
P4/mmm (No. 123)
5.96
6.73
7.32
5.71
5.71
6.73
7.44
Reference

Frequently Asked Questions

Common questions about MgOsY2, answered from cross-validated data.

What is MgOsY2?

MgOsY2 is a semiconducting ternary compound consisting of magnesium, osmium, and yttrium that exists in a metastable state.

More questions
What is the band gap of MgOsY2?
MgOsY2 has a DFT-computed band gap of 0.13 eV across 9 reported structures.
Is MgOsY2 a metal, semiconductor, or insulator?
With a band gap up to 0.13 eV it is a semiconductor.
Is MgOsY2 thermodynamically stable?
MgOsY2 has a lowest energy above hull of 2.698 eV/atom (above hull).
What is the crystal structure of MgOsY2?
The lowest-energy reported polymorph of MgOsY2 is orthorhombic symmetry, space group Immm (No. 71).
What is the density of MgOsY2?
The computed density of the ground-state structure of MgOsY2 is 0.58 g/cm³.
How many polymorphs of MgOsY2 are known?
9 structures of MgOsY2 are reported across 3 databases, spanning 2 distinct space groups.
What elements does MgOsY2 contain?
MgOsY2 contains Mg, Os, and Y (3 elements).
Where does the data for MgOsY2 come from?
MgOsY2 data is cross-referenced from materials_project, nomad, omat24.
Comparison

How It Compares

As a unique ternary phase, MgOsY2 represents an exploratory material in the landscape of complex intermetallics. Without established siblings in its immediate class, it serves as a foundational case study for understanding how heavy transition metals like osmium integrate into magnesium-yttrium frameworks.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • nomad — Data from NOMAD. Cite: Draxl & Scheffler, J. Phys. Mater. 2, 036001 (2019).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).

Analyze MgOsY2 in the Lattice Graph platform

Polymorph comparison, confidence scoring, supply-chain risk, and patent monitoring — across 53 integrated data sources.

Explore the Platform →