Al1Mn1Ti2

Al1Mn1Ti2 is a metastable, semimetallic intermetallic compound composed of aluminum, manganese, and titanium.

AlMnTi
Crystal structure of Al1Mn1Ti2 (cubic, F-43m (No. 216))
Ground-state structure · Materials Project
Overview

About Al1Mn1Ti2

Al1Mn1Ti2 is a complex intermetallic compound composed of aluminum, manganese, and titanium. It exhibits a semimetallic electronic character, placing it in a unique position between traditional insulators and conductors.

As a metastable phase, this material represents a specific structural arrangement within the ternary system. Its existence across multiple reported structures highlights its significance in fundamental materials research and crystallographic studies.

At a glance

Key Properties

Cross-validated computational properties for Al1Mn1Ti2, aggregated across 2 databases.

Band Gap

0.05 eV
Range across DFT structures

Energy Above Hull

0.077 eV/atom
Best (lowest) across sources

Stability

Metastable
1 DFT source

Structures

29
2 databases, 17 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Al1Mn1Ti2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
F-43m (No. 216)cubic0.050.0768-7.4254.84
Imm2 (No. 44)
Fm-3m (No. 225)
P4mm (No. 99)
Cm (No. 8)
I-4m2 (No. 119)
Immm (No. 71)
F-43m (No. 216)
P4mm (No. 99)
P4/mmm (No. 123)
Cmm2 (No. 35)
P2/m (No. 10)
Reference

Frequently Asked Questions

Common questions about Al1Mn1Ti2, answered from cross-validated data.

What is Al1Mn1Ti2?

Al1Mn1Ti2 is a metastable, semimetallic intermetallic compound composed of aluminum, manganese, and titanium.

More questions
What is the band gap of Al1Mn1Ti2?
Al1Mn1Ti2 has a DFT-computed band gap of 0.05 eV across 29 reported structures.
Is Al1Mn1Ti2 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is Al1Mn1Ti2 thermodynamically stable?
Al1Mn1Ti2 has a lowest energy above hull of 0.077 eV/atom (metastable).
What is the crystal structure of Al1Mn1Ti2?
The lowest-energy reported polymorph of Al1Mn1Ti2 is cubic symmetry, space group F-43m (No. 216).
What is the density of Al1Mn1Ti2?
The computed density of the ground-state structure of Al1Mn1Ti2 is 4.84 g/cm³.
How many polymorphs of Al1Mn1Ti2 are known?
29 structures of Al1Mn1Ti2 are reported across 2 databases, spanning 17 distinct space groups.
What elements does Al1Mn1Ti2 contain?
Al1Mn1Ti2 contains Al, Mn, and Ti (3 elements).
Where does the data for Al1Mn1Ti2 come from?
Al1Mn1Ti2 data is cross-referenced from materials_project, aflow.
Comparison

How It Compares

As a unique ternary intermetallic, Al1Mn1Ti2 serves as a specialized example of complex metal-alloy phase formation. Without direct structural siblings in this specific class, it stands as a distinct case study for understanding how the interplay of transition metals and aluminum can stabilize metastable semimetallic configurations.

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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