Ba4Sb4Zn2

Ba4Sb4Zn2 is a thermodynamically stable semiconducting ternary compound containing barium, antimony, and zinc.

BaSbZn
Crystal structure of Ba4Sb4Zn2
Ground-state structure · Materials Project
Overview

About Ba4Sb4Zn2

Ba4Sb4Zn2 is a complex ternary compound composed of barium, antimony, and zinc. It exhibits a semiconducting electronic character, positioning it as an interesting candidate for electronic and optoelectronic material studies. Its thermodynamic stability, being located on the convex hull, suggests it is a robust phase under standard conditions.

This material is primarily of interest in fundamental solid-state research where the interplay between its constituent elements dictates its physical behavior. As a stable phase, it provides a reliable platform for investigating the electronic properties of ternary pnictide-based systems.

At a glance

Key Properties

Cross-validated computational properties for Ba4Sb4Zn2, aggregated across 3 databases.

Band Gap

0.29 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

3
3 databases, 1 space group
Uses

Applications

Where Ba4Sb4Zn2 is used.

Fundamental solid-state researchSemiconductor materials development
Reference

Frequently Asked Questions

Common questions about Ba4Sb4Zn2, answered from cross-validated data.

What is Ba4Sb4Zn2?

Ba4Sb4Zn2 is a thermodynamically stable semiconducting ternary compound containing barium, antimony, and zinc.

More questions
What is Ba4Sb4Zn2 used for?
Ba4Sb4Zn2 is used in fundamental solid-state research and semiconductor materials development.
What is the band gap of Ba4Sb4Zn2?
Ba4Sb4Zn2 has a DFT-computed band gap of 0.29 eV across 3 reported structures.
Is Ba4Sb4Zn2 a metal, semiconductor, or insulator?
With a band gap up to 0.29 eV it is a semiconductor.
Is Ba4Sb4Zn2 thermodynamically stable?
Yes — Ba4Sb4Zn2 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Ba4Sb4Zn2 are known?
3 structures of Ba4Sb4Zn2 are reported across 3 databases, spanning 1 distinct space group.
What elements does Ba4Sb4Zn2 contain?
Ba4Sb4Zn2 contains Ba, Sb, and Zn (3 elements).
Where does the data for Ba4Sb4Zn2 come from?
Ba4Sb4Zn2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique ternary phase, Ba4Sb4Zn2 represents a distinct structural arrangement within the broad landscape of barium-antimony-zinc materials. While it lacks direct siblings in this specific dataset, its position on the convex hull distinguishes it as a chemically favorable configuration compared to more transient or metastable phases in similar elemental combinations.

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

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