Al1Li1Sr2

Al1Li1Sr2 is a semimetallic ternary intermetallic compound composed of aluminum, lithium, and strontium.

AlLiSr
Crystal structure of Al1Li1Sr2 (orthorhombic, Immm (No. 71))
Ground-state structure · Materials Project
Overview

About Al1Li1Sr2

Al1Li1Sr2 is a complex ternary intermetallic compound composed of aluminum, lithium, and strontium. Its electronic structure exhibits near-zero-gap characteristics, placing it in the category of semimetallic materials that bridge the gap between conductors and semiconductors.

Due to its position above the thermodynamic hull, this compound is considered metastable, suggesting it may require specific synthesis conditions to stabilize. With numerous reported structural variations in materials databases, it remains a subject of interest for researchers investigating the phase space of light-metal alloys.

At a glance

Key Properties

Cross-validated computational properties for Al1Li1Sr2, aggregated across 2 databases.

Band Gap

0.03 eV
Range across DFT structures

Energy Above Hull

1.518 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

27
2 databases, 15 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Al1Li1Sr2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Immm (No. 71)orthorhombic0.031.5185-8.4570.23
Fm-3m (No. 225)
P4/mmm (No. 123)
P4/mmm (No. 123)
P4/mmm (No. 123)
P4/mmm (No. 123)
R-3m (No. 166)
I4/mmm (No. 139)
F-43m (No. 216)
Cm (No. 8)
Pmmm (No. 47)
Pm (No. 6)
Reference

Frequently Asked Questions

Common questions about Al1Li1Sr2, answered from cross-validated data.

What is Al1Li1Sr2?

Al1Li1Sr2 is a semimetallic ternary intermetallic compound composed of aluminum, lithium, and strontium.

More questions
What is the band gap of Al1Li1Sr2?
Al1Li1Sr2 has a DFT-computed band gap of 0.03 eV across 27 reported structures.
Is Al1Li1Sr2 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is Al1Li1Sr2 thermodynamically stable?
Al1Li1Sr2 has a lowest energy above hull of 1.518 eV/atom (above hull).
What is the crystal structure of Al1Li1Sr2?
The lowest-energy reported polymorph of Al1Li1Sr2 is orthorhombic symmetry, space group Immm (No. 71).
What is the density of Al1Li1Sr2?
The computed density of the ground-state structure of Al1Li1Sr2 is 0.23 g/cm³.
How many polymorphs of Al1Li1Sr2 are known?
27 structures of Al1Li1Sr2 are reported across 2 databases, spanning 15 distinct space groups.
What elements does Al1Li1Sr2 contain?
Al1Li1Sr2 contains Al, Li, and Sr (3 elements).
Where does the data for Al1Li1Sr2 come from?
Al1Li1Sr2 data is cross-referenced from materials_project, aflow.
Comparison

How It Compares

As a unique ternary phase, Al1Li1Sr2 serves as a specialized example of how aluminum, lithium, and strontium interact within a crystalline lattice, representing a distinct point in the broader landscape of complex intermetallic systems.

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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