Al3Os2

Al3Os2 is a metallic intermetallic compound formed from aluminum and osmium that exhibits significant structural stability.

AlOs
Crystal structure of Al3Os2 (tetragonal, I4/mmm (No. 139))
Ground-state structure · Materials Project
Overview

About Al3Os2

Al3Os2 is a metallic intermetallic compound composed of aluminum and osmium. Its electronic character is defined by its metallic nature, lacking a band gap, which influences its potential for specialized conductive applications. The material is recognized for being near the thermodynamic hull, suggesting it is a stable phase that is likely synthesizable under controlled experimental conditions.

With extensive data available across multiple structural databases, this compound represents a well-documented system for researchers studying binary aluminides. Its structural complexity and stability profile make it an interesting candidate for investigations into transition metal-aluminum phase behavior and alloy development.

At a glance

Key Properties

Cross-validated computational properties for Al3Os2, aggregated across 5 databases.

Band Gap

Metallic / not reported

Energy Above Hull

0.007 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
4 DFT sources

Structures

31
5 databases, 12 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Al3Os2, 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)tetragonal0.000.0074-25.82911.21
C2 (No. 5)Monoclinic9.35
P1 (No. 1)Triclinic10.19
R3 (No. 146)Trigonal8.20
Pm (No. 6)Monoclinic6.09
I4/mmm (No. 139)Tetragonal10.98
I4/mmm (No. 139)Tetragonal11.66
I4/mmm (No. 139)Tetragonal11.22
Cm (No. 8)Monoclinic6.62
Cm (No. 8)Monoclinic5.99
P1 (No. 1)Triclinic6.21
Cmm2 (No. 35)Orthorhombic9.82
Uses

Applications

Where Al3Os2 is used.

Materials science researchAlloy developmentFundamental condensed matter studies
Reference

Frequently Asked Questions

Common questions about Al3Os2, answered from cross-validated data.

What is Al3Os2?

Al3Os2 is a metallic intermetallic compound formed from aluminum and osmium that exhibits significant structural stability.

More questions
What is Al3Os2 used for?
Al3Os2 is used in materials science research, alloy development, and fundamental condensed matter studies.
What is the band gap of Al3Os2?
Al3Os2 is computed to be metallic (no band gap) in the reported DFT structures.
Is Al3Os2 a metal, semiconductor, or insulator?
Computed band structures report no gap, so it is metallic.
Is Al3Os2 thermodynamically stable?
Al3Os2 has a lowest energy above hull of 0.007 eV/atom (near hull (likely stable)).
What is the crystal structure of Al3Os2?
The lowest-energy reported polymorph of Al3Os2 is tetragonal symmetry, space group I4/mmm (No. 139).
What is the density of Al3Os2?
The computed density of the ground-state structure of Al3Os2 is 11.21 g/cm³.
How many polymorphs of Al3Os2 are known?
31 structures of Al3Os2 are reported across 5 databases, spanning 12 distinct space groups.
What elements does Al3Os2 contain?
Al3Os2 contains Al and Os (2 elements).
Where does the data for Al3Os2 come from?
Al3Os2 data is cross-referenced from materials_project, mpaloe, jarvis, omat24.
Comparison

How It Compares

As a binary aluminide, Al3Os2 occupies a unique space in materials science, serving as a distinct example of how transition metals interact with aluminum to form stable, metallic phases. Without direct structural analogs in this specific grouping, it stands as a reference point for understanding the bonding and phase stability of osmium-rich intermetallics.

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).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).

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