Al2Os

Al2Os is a thermodynamically stable semiconducting intermetallic compound formed from aluminum and osmium.

AlOs
Crystal structure of Al2Os (tetragonal, I4/mmm (No. 139))
Ground-state structure · Materials Project
Overview

About Al2Os

Al2Os is a distinct intermetallic compound composed of aluminum and osmium. As a thermodynamically stable phase residing on the convex hull, it represents a robust structural arrangement of these elements that is well-represented across multiple materials databases.

This material exhibits semiconducting electronic character, positioning it as an intriguing candidate for specialized electronic or optoelectronic applications. Its stability and well-characterized structural profile make it a significant subject for researchers investigating transition metal aluminides.

At a glance

Key Properties

Cross-validated computational properties for Al2Os, aggregated across 4 databases.

Band Gap

0.29 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
3 DFT sources

Structures

102
4 databases, 25 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Al2Os, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
I4/mmm (No. 139)tetragonal0.290.0000-22.8209.81
C2/c (No. 15)Monoclinic6.21
Cm (No. 8)Monoclinic8.58
Amm2 (No. 38)Orthorhombic10.07
Cmcm (No. 63)Orthorhombic9.17
Amm2 (No. 38)Orthorhombic9.30
P21/m (No. 11)Monoclinic10.66
P21/m (No. 11)Monoclinic7.74
C2 (No. 5)Monoclinic7.98
Cmc21 (No. 36)Orthorhombic6.11
Cmc21 (No. 36)Orthorhombic8.14
Cc (No. 9)Monoclinic6.19
Uses

Applications

Where Al2Os is used.

Semiconductor researchMaterials science studiesFundamental electronic property analysis
Reference

Frequently Asked Questions

Common questions about Al2Os, answered from cross-validated data.

What is Al2Os?

Al2Os is a thermodynamically stable semiconducting intermetallic compound formed from aluminum and osmium.

More questions
What is Al2Os used for?
Al2Os is used in semiconductor research, materials science studies, and fundamental electronic property analysis.
What is the band gap of Al2Os?
Al2Os has a DFT-computed band gap of 0.29 eV across 102 reported structures.
Is Al2Os a metal, semiconductor, or insulator?
With a band gap up to 0.29 eV it is a semiconductor.
Is Al2Os thermodynamically stable?
Yes — Al2Os sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Al2Os?
The lowest-energy reported polymorph of Al2Os is tetragonal symmetry, space group I4/mmm (No. 139).
What is the density of Al2Os?
The computed density of the ground-state structure of Al2Os is 9.81 g/cm³.
How many polymorphs of Al2Os are known?
102 structures of Al2Os are reported across 4 databases, spanning 25 distinct space groups.
What elements does Al2Os contain?
Al2Os contains Al and Os (2 elements).
Where does the data for Al2Os come from?
Al2Os data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

As a unique intermetallic phase, Al2Os serves as a foundational example of aluminum-osmium bonding within the broader landscape of binary intermetallics, demonstrating the specific structural stability achievable when combining these particular elements.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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