BaMgV4O8

Barium magnesium vanadium oxide is a complex inorganic compound characterized by its layered crystal structure. It is primarily utilized in materials science research as a candidate for advanced electronic and magnetic applications.

BaMgOV
Crystal structure of BaMgV4O8 (trigonal, P-31m (No. 162))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for BaMgV4O8, aggregated across 3 databases.

Band Gap

1.02 eV
Range across DFT structures

Energy Above Hull

0.168 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

5
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for BaMgV4O8, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P-31m (No. 162)trigonal1.020.1681-8.2044.26
P-31m (No. 162)
P-31m (No. 162)Trigonal4.50
P-31m (No. 162)Trigonal4.26
P-31m (No. 162)Trigonal4.73
Uses

Applications

Where BaMgV4O8 is used.

Materials science researchSolid-state chemistry studiesMagnetic property investigation
Reference

Frequently Asked Questions

Common questions about BaMgV4O8, answered from cross-validated data.

What is BaMgV4O8?

Barium magnesium vanadium oxide is a complex inorganic compound characterized by its layered crystal structure. It is primarily utilized in materials science research as a candidate for advanced electronic and magnetic applications.

More questions
What is BaMgV4O8 used for?
BaMgV4O8 is used in materials science research, solid-state chemistry studies, and magnetic property investigation.
What is the band gap of BaMgV4O8?
BaMgV4O8 has a DFT-computed band gap of 1.02 eV across 5 reported structures.
Is BaMgV4O8 a metal, semiconductor, or insulator?
With a band gap up to 1.02 eV it is a semiconductor.
Is BaMgV4O8 thermodynamically stable?
BaMgV4O8 has a lowest energy above hull of 0.168 eV/atom (above hull).
What is the crystal structure of BaMgV4O8?
The lowest-energy reported polymorph of BaMgV4O8 is trigonal symmetry, space group P-31m (No. 162).
What is the density of BaMgV4O8?
The computed density of the ground-state structure of BaMgV4O8 is 4.26 g/cm³.
How many polymorphs of BaMgV4O8 are known?
5 structures of BaMgV4O8 are reported across 3 databases, spanning 1 distinct space group.
What elements does BaMgV4O8 contain?
BaMgV4O8 contains Ba, Mg, O, and V (4 elements).
Where does the data for BaMgV4O8 come from?
BaMgV4O8 data is cross-referenced from materials_project, jarvis, mpaloe.
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).
  • mpaloe — Data from mpaloe.

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