Li2ScIn

Li2ScIn is a semimetallic ternary compound that is theoretically stable and of interest for its electronic properties in solid-state physics.

InLiSc
Crystal structure of Li2ScIn
Ground-state structure · Materials Project
Overview

About Li2ScIn

Li2ScIn is a complex ternary intermetallic compound characterized by its near-zero-gap electronic structure. As a semimetallic material, it exhibits unique charge carrier dynamics that distinguish it from traditional insulators or wide-gap semiconductors.

Due to its position near the thermodynamic hull, Li2ScIn is considered a viable candidate for experimental synthesis. Its structural versatility is evidenced by multiple reported configurations across materials databases, marking it as a significant subject for fundamental condensed matter studies.

At a glance

Key Properties

Cross-validated computational properties for Li2ScIn, aggregated across 3 databases.

Band Gap

0.07 eV
Range across DFT structures

Energy Above Hull

0.013 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

6
3 databases, 2 space groups
Uses

Applications

Where Li2ScIn is used.

Fundamental condensed matter researchSolid-state electronic material studies
Reference

Frequently Asked Questions

Common questions about Li2ScIn, answered from cross-validated data.

What is Li2ScIn?

Li2ScIn is a semimetallic ternary compound that is theoretically stable and of interest for its electronic properties in solid-state physics.

More questions
What is Li2ScIn used for?
Li2ScIn is used in fundamental condensed matter research and solid-state electronic material studies.
What is the band gap of Li2ScIn?
Li2ScIn has a DFT-computed band gap of 0.07 eV across 6 reported structures.
Is Li2ScIn a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is Li2ScIn thermodynamically stable?
Li2ScIn has a lowest energy above hull of 0.013 eV/atom (near hull (likely stable)).
How many polymorphs of Li2ScIn are known?
6 structures of Li2ScIn are reported across 3 databases, spanning 2 distinct space groups.
What elements does Li2ScIn contain?
Li2ScIn contains In, Li, and Sc (3 elements).
Where does the data for Li2ScIn come from?
Li2ScIn data is cross-referenced from latticegraph.
Comparison

How It Compares

As a specialized ternary intermetallic, Li2ScIn occupies a distinct niche in materials science. Without direct structural siblings in its immediate class, it serves as a primary reference point for investigating the interplay between lithium, scandium, and indium in semimetallic systems.

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

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