Ba2HoNbO6

This compound is a complex oxide belonging to the double perovskite family. It is primarily utilized in materials science research for investigating magnetic properties and structural phase transitions in ceramic systems.

Crystal structure of Ba2HoNbO6 (cubic, Fm-3m (No. 225))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Ba2HoNbO6, aggregated across 3 databases.

Band Gap

2.85 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
Crystallography

Reported Structures

Lowest-energy structures reported for Ba2HoNbO6, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Fm-3m (No. 225)cubic2.850.0000-8.2916.70
Fm-3m (No. 225)
Uses

Applications

Where Ba2HoNbO6 is used.

Materials science researchSolid-state physics studiesCeramic material development
Reference

Frequently Asked Questions

Common questions about Ba2HoNbO6, answered from cross-validated data.

What is Ba2HoNbO6?

This compound is a complex oxide belonging to the double perovskite family. It is primarily utilized in materials science research for investigating magnetic properties and structural phase transitions in ceramic systems.

More questions
What is Ba2HoNbO6 used for?
Ba2HoNbO6 is used in materials science research, solid-state physics studies, and ceramic material development.
What is the band gap of Ba2HoNbO6?
Ba2HoNbO6 has a DFT-computed band gap of 2.85 eV across 3 reported structures.
Is Ba2HoNbO6 a metal, semiconductor, or insulator?
With a band gap up to 2.85 eV it is a semiconductor.
Is Ba2HoNbO6 thermodynamically stable?
Yes — Ba2HoNbO6 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Ba2HoNbO6?
The lowest-energy reported polymorph of Ba2HoNbO6 is cubic symmetry, space group Fm-3m (No. 225).
What is the density of Ba2HoNbO6?
The computed density of the ground-state structure of Ba2HoNbO6 is 6.70 g/cm³.
How many polymorphs of Ba2HoNbO6 are known?
3 structures of Ba2HoNbO6 are reported across 3 databases, spanning 1 distinct space group.
What elements does Ba2HoNbO6 contain?
Ba2HoNbO6 contains Ba, Ho, Nb, and O (4 elements).
Where does the data for Ba2HoNbO6 come from?
Ba2HoNbO6 data is cross-referenced from materials_project, jarvis, alexandria.
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Related Compounds

Other Lead-Free Piezoelectrics in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).
  • alexandria — Data from alexandria.

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