Na5Mn7O16

Na5Mn7O16 is a metastable, semiconducting layered oxide of sodium and manganese used in energy storage research.

Crystal structure of Na5Mn7O16 (monoclinic, P2/m (No. 10))
Ground-state structure · Materials Project
Overview

About Na5Mn7O16

Na5Mn7O16 is a complex layered sodium transition-metal oxide characterized by its semiconducting electronic nature. As a metastable phase, it represents a unique structural arrangement within the manganese-based oxide family, offering distinct pathways for ion transport and structural flexibility.

This material is primarily investigated for its potential in advanced electrochemical energy storage systems. Its specific stoichiometry and layered architecture make it a subject of interest for researchers looking to optimize electrode performance in next-generation sodium-ion battery technologies.

At a glance

Key Properties

Cross-validated computational properties for Na5Mn7O16, aggregated across 3 databases.

Band Gap

0.61 eV
Range across DFT structures

Energy Above Hull

0.039 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

9
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Na5Mn7O16, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P2/m (No. 10)monoclinic0.610.0388-7.2693.84
C2/m (No. 12)monoclinic0.000.0970-7.2103.81
C2/m (No. 12)Monoclinic3.81
C2/m (No. 12)Monoclinic4.19
P2/m (No. 10)Monoclinic4.02
P2/m (No. 10)Monoclinic4.21
P2/m (No. 10)Monoclinic3.84
C2/m (No. 12)Monoclinic4.00
P2/m (No. 10)
Uses

Applications

Where Na5Mn7O16 is used.

Sodium-ion battery researchElectrochemical energy storage development
Reference

Frequently Asked Questions

Common questions about Na5Mn7O16, answered from cross-validated data.

What is Na5Mn7O16?

Na5Mn7O16 is a metastable, semiconducting layered oxide of sodium and manganese used in energy storage research.

More questions
What is Na5Mn7O16 used for?
Na5Mn7O16 is used in sodium-ion battery research and electrochemical energy storage development.
What is the band gap of Na5Mn7O16?
Na5Mn7O16 has a DFT-computed band gap of 0.61 eV across 9 reported structures.
Is Na5Mn7O16 a metal, semiconductor, or insulator?
With a band gap up to 0.61 eV it is a semiconductor.
Is Na5Mn7O16 thermodynamically stable?
Na5Mn7O16 has a lowest energy above hull of 0.039 eV/atom (metastable).
What is the crystal structure of Na5Mn7O16?
The lowest-energy reported polymorph of Na5Mn7O16 is monoclinic symmetry, space group P2/m (No. 10).
What is the density of Na5Mn7O16?
The computed density of the ground-state structure of Na5Mn7O16 is 3.84 g/cm³.
How many polymorphs of Na5Mn7O16 are known?
9 structures of Na5Mn7O16 are reported across 3 databases, spanning 2 distinct space groups.
What elements does Na5Mn7O16 contain?
Na5Mn7O16 contains Mn, Na, and O (3 elements).
Where does the data for Na5Mn7O16 come from?
Na5Mn7O16 data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

Within the layered sodium transition-metal oxides class.

Within the broader family of layered sodium transition-metal oxides, Na5Mn7O16 occupies a specialized niche compared to more common, highly stable phases like NaCoO2 or NaFeO2. While many siblings in this class are studied for their robust cycling capabilities, this manganese-rich oxide is distinguished by its metastable nature, which provides a different structural framework for studying ion insertion processes compared to the simpler, more conventional layered structures.

Explore

Related Compounds

Other Layered Sodium Transition-Metal Oxides in the database.

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

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