NaMnO4

sodium permanganate

Sodium permanganate is a metastable, semiconducting transition-metal oxide widely recognized for its powerful oxidizing capabilities in chemical synthesis.

Crystal structure of NaMnO4 (orthorhombic, Cmcm (No. 63))
Ground-state structure · Materials Project
Overview

About sodium permanganate

Sodium permanganate is a semiconducting member of the layered sodium transition-metal oxide family. Characterized by its metastable nature, this compound represents a complex chemical system with multiple documented structural configurations, highlighting its versatility in inorganic synthesis and research. Its unique electronic structure makes it a subject of interest for those studying transition-metal oxides and their potential for structural transformation. As a potent oxidizing agent, it plays a critical role in various industrial and laboratory processes, leveraging the high reactivity of the manganese center within the sodium-oxygen framework. Its ability to participate in diverse chemical reactions stems from the interplay between the alkali metal cation and the transition metal oxide layers.

At a glance

Key Properties

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

Band Gap

1.96 eV
Range across DFT structures

Energy Above Hull

0.064 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

11
3 databases, 3 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for NaMnO4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Cmcm (No. 63)orthorhombic1.910.0636-6.4332.51
P21/c (No. 14)monoclinic1.960.0681-6.4292.68
Pnma (No. 62)orthorhombic0.000.3518-6.1452.42
P21/c (No. 14)Monoclinic2.68
P21/c (No. 14)Monoclinic2.84
P21/c (No. 14)Monoclinic2.72
Cmcm (No. 63)
Cmcm (No. 63)Orthorhombic2.64
Cmcm (No. 63)
Cmcm (No. 63)Orthorhombic2.51
Cmcm (No. 63)Orthorhombic2.54
Uses

Applications

Where sodium permanganate is used.

oxidizing agentwater treatmentchemical synthesisetching agent
Reference

Frequently Asked Questions

Common questions about sodium permanganate, answered from cross-validated data.

What is NaMnO4?

Sodium permanganate is a metastable, semiconducting transition-metal oxide widely recognized for its powerful oxidizing capabilities in chemical synthesis.

More questions
What is NaMnO4 used for?
sodium permanganate (NaMnO4) is used in oxidizing agent, water treatment, chemical synthesis, and etching agent.
What is the band gap of NaMnO4?
sodium permanganate (NaMnO4) has a DFT-computed band gap of 1.96 eV across 11 reported structures.
Is NaMnO4 a metal, semiconductor, or insulator?
With a band gap up to 1.96 eV it is a semiconductor.
Is NaMnO4 thermodynamically stable?
sodium permanganate (NaMnO4) has a lowest energy above hull of 0.064 eV/atom (metastable).
What is the crystal structure of NaMnO4?
The lowest-energy reported polymorph of sodium permanganate (NaMnO4) is orthorhombic symmetry, space group Cmcm (No. 63).
What is the density of NaMnO4?
The computed density of the ground-state structure of sodium permanganate (NaMnO4) is 2.51 g/cm³.
How many polymorphs of NaMnO4 are known?
11 structures of NaMnO4 are reported across 3 databases, spanning 3 distinct space groups.
What elements does NaMnO4 contain?
sodium permanganate (NaMnO4) contains Mn, Na, and O (3 elements).
Where does the data for NaMnO4 come from?
NaMnO4 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, NaMnO4 stands out as a more reactive and metastable alternative to more structurally robust members like NaFeO2 or NaCoO2. While compounds such as NaMnO2 or NaNiO2 are often studied for their stable layered architectures in battery applications, NaMnO4 occupies a distinct niche due to its higher oxidation state and tendency toward metastable phases, making it less suitable for long-term electrochemical cycling but highly effective for chemical oxidation tasks.

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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