Na7MgSbO6

Na7MgSbO6 is a semiconducting quaternary oxide composed of sodium, magnesium, antimony, and oxygen.

MgNaOSb
Crystal structure of Na7MgSbO6 (triclinic, P1 (No. 1))
Ground-state structure · Materials Project
Overview

About Na7MgSbO6

Na7MgSbO6 is a complex oxide featuring a quaternary arrangement of sodium, magnesium, antimony, and oxygen. As a semiconducting material, it represents a specialized composition within the broader landscape of complex metal oxides, drawing interest for its unique elemental combination and potential for electronic tuning.

While this compound has been documented across multiple structural configurations, it is categorized as being above the thermodynamic hull, suggesting it may be metastable under standard conditions. Its study contributes to the fundamental understanding of how alkali-rich oxide frameworks accommodate diverse metal cations.

At a glance

Key Properties

Cross-validated computational properties for Na7MgSbO6, aggregated across 2 databases.

Band Gap

2.10–2.73 eV
Range across DFT structures

Energy Above Hull

0.108 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

13
2 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Na7MgSbO6, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P1 (No. 1)triclinic2.260.1078-4.7212.89
R3 (No. 146)trigonal2.730.1165-4.7122.41
P1 (No. 1)triclinic2.100.1718-4.6572.89
R3 (No. 146)trigonal2.100.1721-4.6572.92
P1 (No. 1)Triclinic2.89
P1 (No. 1)Triclinic3.02
P1 (No. 1)Triclinic2.98
R3 (No. 146)Trigonal2.41
R3 (No. 146)Trigonal2.50
R3 (No. 146)Trigonal2.46
R3 (No. 146)Trigonal2.92
R3 (No. 146)Trigonal3.04
Reference

Frequently Asked Questions

Common questions about Na7MgSbO6, answered from cross-validated data.

What is Na7MgSbO6?

Na7MgSbO6 is a semiconducting quaternary oxide composed of sodium, magnesium, antimony, and oxygen.

More questions
What is the band gap of Na7MgSbO6?
Na7MgSbO6 has a DFT-computed band gap of 2.10–2.73 eV across 13 reported structures.
Is Na7MgSbO6 a metal, semiconductor, or insulator?
With a band gap up to 2.73 eV it is a semiconductor.
Is Na7MgSbO6 thermodynamically stable?
Na7MgSbO6 has a lowest energy above hull of 0.108 eV/atom (above hull).
What is the crystal structure of Na7MgSbO6?
The lowest-energy reported polymorph of Na7MgSbO6 is triclinic symmetry, space group P1 (No. 1).
What is the density of Na7MgSbO6?
The computed density of the ground-state structure of Na7MgSbO6 is 2.89 g/cm³.
How many polymorphs of Na7MgSbO6 are known?
13 structures of Na7MgSbO6 are reported across 2 databases, spanning 2 distinct space groups.
What elements does Na7MgSbO6 contain?
Na7MgSbO6 contains Mg, Na, O, and Sb (4 elements).
Where does the data for Na7MgSbO6 come from?
Na7MgSbO6 data is cross-referenced from materials_project, mpaloe.
Comparison

How It Compares

As a unique quaternary oxide, Na7MgSbO6 serves as a distinct case study in the field of complex sodium-based ceramics. Without direct structural siblings in this specific class, it stands as an outlier that highlights the synthetic challenges and structural diversity inherent in high-sodium oxide systems.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.

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