Ba2Hf7O16

Ba2Hf7O16 is a metastable, wide-band-gap insulating oxide used in advanced materials research.

BaHfO
Crystal structure of Ba2Hf7O16
Ground-state structure · Materials Project
Overview

About Ba2Hf7O16

Ba2Hf7O16 is a complex oxide composed of barium, hafnium, and oxygen. As a wide-band-gap insulator, it exhibits electronic properties characteristic of highly stable dielectric materials, despite its own metastable nature. Its unique structural arrangement makes it a subject of interest for fundamental materials research.

Because of its insulating nature, this compound is investigated for its potential utility in electronic components where high-performance dielectric behavior is required. Its structural complexity, evidenced by multiple reported configurations, suggests a versatile framework for exploring oxide-based materials science.

At a glance

Key Properties

Cross-validated computational properties for Ba2Hf7O16, aggregated across 3 databases.

Band Gap

4.04 eV
Range across DFT structures

Energy Above Hull

0.045 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

5
3 databases, 1 space group
Uses

Applications

Where Ba2Hf7O16 is used.

Dielectric researchElectronic component development
Reference

Frequently Asked Questions

Common questions about Ba2Hf7O16, answered from cross-validated data.

What is Ba2Hf7O16?

Ba2Hf7O16 is a metastable, wide-band-gap insulating oxide used in advanced materials research.

More questions
What is Ba2Hf7O16 used for?
Ba2Hf7O16 is used in dielectric research and electronic component development.
What is the band gap of Ba2Hf7O16?
Ba2Hf7O16 has a DFT-computed band gap of 4.04 eV across 5 reported structures.
Is Ba2Hf7O16 a metal, semiconductor, or insulator?
With a wide band gap up to 4.04 eV it is an insulator / wide-band-gap material.
Is Ba2Hf7O16 thermodynamically stable?
Ba2Hf7O16 has a lowest energy above hull of 0.045 eV/atom (metastable).
How many polymorphs of Ba2Hf7O16 are known?
5 structures of Ba2Hf7O16 are reported across 3 databases, spanning 1 distinct space group.
What elements does Ba2Hf7O16 contain?
Ba2Hf7O16 contains Ba, Hf, and O (3 elements).
Where does the data for Ba2Hf7O16 come from?
Ba2Hf7O16 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a member of the barium-hafnium-oxygen system, Ba2Hf7O16 represents a specialized structural phase. While it lacks direct siblings in this specific dataset, it serves as a critical point of comparison for understanding the phase stability and insulating characteristics of complex hafnates.

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

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