BaBiIO2

BaBiIO2 is a thermodynamically stable semiconducting material composed of barium, bismuth, iodine, and oxygen.

BaBiIO
Crystal structure of BaBiIO2
Ground-state structure · Materials Project
Overview

About BaBiIO2

BaBiIO2 is a complex quaternary compound that exists as a thermodynamically stable phase on the convex hull. Its semiconducting electronic character makes it an intriguing candidate for investigation within the broader landscape of functional inorganic materials. With multiple reported structures across various databases, this material is well-documented for researchers exploring its unique composition. Its stability profile suggests it may be a robust building block for future technological applications.

At a glance

Key Properties

Cross-validated computational properties for BaBiIO2, aggregated across 4 databases.

Band Gap

2.95 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
3 DFT sources

Structures

7
4 databases, 1 space group
Reference

Frequently Asked Questions

Common questions about BaBiIO2, answered from cross-validated data.

What is BaBiIO2?

BaBiIO2 is a thermodynamically stable semiconducting material composed of barium, bismuth, iodine, and oxygen.

More questions
What is the band gap of BaBiIO2?
BaBiIO2 has a DFT-computed band gap of 2.95 eV across 7 reported structures.
Is BaBiIO2 a metal, semiconductor, or insulator?
With a band gap up to 2.95 eV it is a semiconductor.
Is BaBiIO2 thermodynamically stable?
Yes — BaBiIO2 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of BaBiIO2 are known?
7 structures of BaBiIO2 are reported across 4 databases, spanning 1 distinct space group.
What elements does BaBiIO2 contain?
BaBiIO2 contains Ba, Bi, I, and O (4 elements).
Where does the data for BaBiIO2 come from?
BaBiIO2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct quaternary compound, BaBiIO2 occupies a specialized niche in materials science, representing a stable configuration of barium, bismuth, iodine, and oxygen that warrants further study for its unique electronic properties.

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

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