LiVS3

LiVS3 is a semimetallic lithium vanadium sulfide compound known for its complex structural variety and narrow electronic gap.

LiSV
Crystal structure of LiVS3
Ground-state structure · Materials Project
Overview

About LiVS3

LiVS3 is a lithium vanadium sulfide compound characterized by its near-zero-gap electronic structure. This semimetallic behavior suggests potential for specialized electronic applications where narrow-gap materials are required for charge transport.

Despite its interesting electronic profile, the compound is found above the thermodynamic hull, indicating it is likely unstable under standard conditions. Its existence across multiple reported structures highlights its complexity and the ongoing interest in exploring its phase space.

At a glance

Key Properties

Cross-validated computational properties for LiVS3, aggregated across 3 databases.

Band Gap

0.04 eV
Range across DFT structures

Energy Above Hull

0.103 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

5
3 databases, 1 space group
Uses

Applications

Where LiVS3 is used.

Fundamental materials researchElectronic property studiesSolid-state chemistry exploration
Reference

Frequently Asked Questions

Common questions about LiVS3, answered from cross-validated data.

What is LiVS3?

LiVS3 is a semimetallic lithium vanadium sulfide compound known for its complex structural variety and narrow electronic gap.

More questions
What is LiVS3 used for?
LiVS3 is used in fundamental materials research, electronic property studies, and solid-state chemistry exploration.
What is the band gap of LiVS3?
LiVS3 has a DFT-computed band gap of 0.04 eV across 5 reported structures.
Is LiVS3 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is LiVS3 thermodynamically stable?
LiVS3 has a lowest energy above hull of 0.103 eV/atom (above hull).
How many polymorphs of LiVS3 are known?
5 structures of LiVS3 are reported across 3 databases, spanning 1 distinct space group.
What elements does LiVS3 contain?
LiVS3 contains Li, S, and V (3 elements).
Where does the data for LiVS3 come from?
LiVS3 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique ternary sulfide, LiVS3 occupies a distinct position in materials research. While it lacks direct siblings in this specific dataset, its semimetallic nature sets it apart from typical wide-gap insulating sulfides, marking it as a subject of interest for fundamental studies into unstable but electronically active inorganic phases.

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

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