Ba2MnMoO6

Barium manganese molybdate

This compound is a double perovskite oxide characterized by its complex crystalline structure. It is primarily studied in materials science for its magnetic and electronic properties, which are of interest for potential future technological applications.

BaMnMoO
Crystal structure of Ba2MnMoO6 (cubic, Fm-3m (No. 225))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Ba2MnMoO6, aggregated across 3 databases.

Band Gap

1.27 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

4
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Ba2MnMoO6, 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)cubic1.270.0000-7.9836.02
Fm-3m (No. 225)
4.52
Fm-3m (No. 225)
Uses

Applications

Where Ba2MnMoO6 is used.

Solid-state physics researchMagnetic materials developmentElectronic component studies
Reference

Frequently Asked Questions

Common questions about Ba2MnMoO6, answered from cross-validated data.

What is Ba2MnMoO6?

This compound is a double perovskite oxide characterized by its complex crystalline structure. It is primarily studied in materials science for its magnetic and electronic properties, which are of interest for potential future technological applications.

More questions
What is Ba2MnMoO6 used for?
Ba2MnMoO6 is used in solid-state physics research, magnetic materials development, and electronic component studies.
What is the band gap of Ba2MnMoO6?
Ba2MnMoO6 has a DFT-computed band gap of 1.27 eV across 4 reported structures.
Is Ba2MnMoO6 a metal, semiconductor, or insulator?
With a band gap up to 1.27 eV it is a semiconductor.
Is Ba2MnMoO6 thermodynamically stable?
Yes — Ba2MnMoO6 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Ba2MnMoO6?
The lowest-energy reported polymorph of Ba2MnMoO6 is cubic symmetry, space group Fm-3m (No. 225).
What is the density of Ba2MnMoO6?
The computed density of the ground-state structure of Ba2MnMoO6 is 6.02 g/cm³.
How many polymorphs of Ba2MnMoO6 are known?
4 structures of Ba2MnMoO6 are reported across 3 databases, spanning 1 distinct space group.
What elements does Ba2MnMoO6 contain?
Ba2MnMoO6 contains Ba, Mn, Mo, and O (4 elements).
Where does the data for Ba2MnMoO6 come from?
Ba2MnMoO6 data is cross-referenced from materials_project, jarvis, omat24.
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).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).

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