Ba5Dy8O21Zn4

This complex oxide is a multicomponent ceramic material composed of barium, dysprosium, oxygen, and zinc. It is primarily utilized in advanced materials research for its specific structural properties and potential applications in electronic or optical components.

BaDyOZn
Crystal structure of Ba5Dy8O21Zn4 (tetragonal, I4/m (No. 87))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Ba5Dy8O21Zn4, aggregated across 3 databases.

Band Gap

3.37 eV
Range across DFT structures

Energy Above Hull

0.007 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

3
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Ba5Dy8O21Zn4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
I4/m (No. 87)tetragonal3.370.0071-7.3407.71
I4/m (No. 87)
5.74
Uses

Applications

Where Ba5Dy8O21Zn4 is used.

Materials science researchCeramic engineeringElectronic component development
Reference

Frequently Asked Questions

Common questions about Ba5Dy8O21Zn4, answered from cross-validated data.

What is Ba5Dy8O21Zn4?

This complex oxide is a multicomponent ceramic material composed of barium, dysprosium, oxygen, and zinc. It is primarily utilized in advanced materials research for its specific structural properties and potential applications in electronic or optical components.

More questions
What is Ba5Dy8O21Zn4 used for?
Ba5Dy8O21Zn4 is used in materials science research, ceramic engineering, and electronic component development.
What is the band gap of Ba5Dy8O21Zn4?
Ba5Dy8O21Zn4 has a DFT-computed band gap of 3.37 eV across 3 reported structures.
Is Ba5Dy8O21Zn4 a metal, semiconductor, or insulator?
With a wide band gap up to 3.37 eV it is an insulator / wide-band-gap material.
Is Ba5Dy8O21Zn4 thermodynamically stable?
Ba5Dy8O21Zn4 has a lowest energy above hull of 0.007 eV/atom (near hull (likely stable)).
What is the crystal structure of Ba5Dy8O21Zn4?
The lowest-energy reported polymorph of Ba5Dy8O21Zn4 is tetragonal symmetry, space group I4/m (No. 87).
What is the density of Ba5Dy8O21Zn4?
The computed density of the ground-state structure of Ba5Dy8O21Zn4 is 7.71 g/cm³.
How many polymorphs of Ba5Dy8O21Zn4 are known?
3 structures of Ba5Dy8O21Zn4 are reported across 3 databases, spanning 1 distinct space group.
What elements does Ba5Dy8O21Zn4 contain?
Ba5Dy8O21Zn4 contains Ba, Dy, O, and Zn (4 elements).
Where does the data for Ba5Dy8O21Zn4 come from?
Ba5Dy8O21Zn4 data is cross-referenced from materials_project, nomad, omat24.
Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • nomad — Data from NOMAD. Cite: Draxl & Scheffler, J. Phys. Mater. 2, 036001 (2019).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).

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