Sc1Te2Tl1

Sc1Te2Tl1 is a thermodynamically stable, semimetallic ternary compound containing scandium, tellurium, and thallium.

ScTeTl
Crystal structure of Sc1Te2Tl1
Ground-state structure · Materials Project
Overview

About Sc1Te2Tl1

Sc1Te2Tl1 is a complex ternary compound composed of scandium, tellurium, and thallium. It is characterized as a thermodynamically stable phase that sits directly on the convex hull, indicating robust structural integrity under standard conditions.

Electronically, this material exhibits a near-zero-gap profile, placing it in the semimetallic regime. Its unique electronic configuration makes it a subject of interest for researchers investigating charge transport and electronic behavior in ternary chalcogenide systems.

At a glance

Key Properties

Cross-validated computational properties for Sc1Te2Tl1, aggregated across 2 databases.

Band Gap

0.04 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
1 DFT source

Structures

29
2 databases, 15 space groups
Uses

Applications

Where Sc1Te2Tl1 is used.

Fundamental materials researchElectronic property studiesSolid-state chemistry investigation
Reference

Frequently Asked Questions

Common questions about Sc1Te2Tl1, answered from cross-validated data.

What is Sc1Te2Tl1?

Sc1Te2Tl1 is a thermodynamically stable, semimetallic ternary compound containing scandium, tellurium, and thallium.

More questions
What is Sc1Te2Tl1 used for?
Sc1Te2Tl1 is used in fundamental materials research, electronic property studies, and solid-state chemistry investigation.
What is the band gap of Sc1Te2Tl1?
Sc1Te2Tl1 has a DFT-computed band gap of 0.04 eV across 29 reported structures.
Is Sc1Te2Tl1 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is Sc1Te2Tl1 thermodynamically stable?
Yes — Sc1Te2Tl1 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Sc1Te2Tl1 are known?
29 structures of Sc1Te2Tl1 are reported across 2 databases, spanning 15 distinct space groups.
What elements does Sc1Te2Tl1 contain?
Sc1Te2Tl1 contains Sc, Te, and Tl (3 elements).
Where does the data for Sc1Te2Tl1 come from?
Sc1Te2Tl1 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct ternary phase, Sc1Te2Tl1 serves as a unique entry point into the study of scandium-based tellurides. While it lacks direct siblings in this specific dataset, it represents a stable, well-defined structural arrangement that provides a baseline for understanding how the integration of thallium influences the electronic properties of transition metal chalcogenides.

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

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