Al2Rh1Tc1

Al2Rh1Tc1 is a semimetallic, metastable intermetallic alloy containing aluminum, rhodium, and technetium.

Crystal structure of Al2Rh1Tc1
Ground-state structure · Materials Project
Overview

About Al2Rh1Tc1

Al2Rh1Tc1 is a complex intermetallic compound classified within the platinum-group alloy catalyst family. Characterized by a near-zero-gap electronic structure, this material exhibits semimetallic behavior that is of significant interest for fundamental studies in condensed matter physics and surface science.

Due to its position above the thermodynamic hull, this compound is considered metastable, representing a challenging target for synthetic chemistry. Its existence within a broad database of structural variants highlights its role as a subject of interest for researchers investigating the interplay between transition metals and light elements in catalytic environments.

At a glance

Key Properties

Cross-validated computational properties for Al2Rh1Tc1, aggregated across 2 databases.

Band Gap

0.02 eV
Range across DFT structures

Energy Above Hull

3.277 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

27
2 databases, 14 space groups
Uses

Applications

Where Al2Rh1Tc1 is used.

Fundamental catalytic researchCondensed matter physics studiesHigh-energy phase material analysis
Reference

Frequently Asked Questions

Common questions about Al2Rh1Tc1, answered from cross-validated data.

What is Al2Rh1Tc1?

Al2Rh1Tc1 is a semimetallic, metastable intermetallic alloy containing aluminum, rhodium, and technetium.

More questions
What is Al2Rh1Tc1 used for?
Al2Rh1Tc1 is used in fundamental catalytic research, condensed matter physics studies, and high-energy phase material analysis.
What is the band gap of Al2Rh1Tc1?
Al2Rh1Tc1 has a DFT-computed band gap of 0.02 eV across 27 reported structures.
Is Al2Rh1Tc1 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is Al2Rh1Tc1 thermodynamically stable?
Al2Rh1Tc1 has a lowest energy above hull of 3.277 eV/atom (above hull).
How many polymorphs of Al2Rh1Tc1 are known?
27 structures of Al2Rh1Tc1 are reported across 2 databases, spanning 14 distinct space groups.
What elements does Al2Rh1Tc1 contain?
Al2Rh1Tc1 contains Al, Rh, and Tc (3 elements).
Where does the data for Al2Rh1Tc1 come from?
Al2Rh1Tc1 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the platinum-group alloy catalysts class.

Unlike more stable and widely utilized members of the platinum-group alloy class such as LaRh or GeRu, Al2Rh1Tc1 is distinguished by its metastable nature and unique elemental composition involving technetium. While many of its siblings are studied for their robust industrial catalytic performance, this specific alloy serves primarily as a theoretical and structural benchmark for understanding high-energy phases in transition metal systems.

Explore

Related Compounds

Other Platinum-Group Alloy Catalysts in the database.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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