Mn5O8

This manganese oxide is a mixed-valence compound that serves as a precursor or intermediate in the synthesis of various manganese-based materials. It is primarily studied for its structural properties and potential utility in electrochemical energy storage systems.

Crystal structure of Mn5O8 (monoclinic, C2/m (No. 12))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Mn5O8, aggregated across 4 databases.

Band Gap

0.55 eV
Range across DFT structures

Energy Above Hull

0.013 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
3 DFT sources

Structures

12
4 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Mn5O8, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
C2/m (No. 12)monoclinic0.550.0132-8.5254.93
R-3m (No. 166)trigonal0.000.0836-8.4554.19
R-3m (No. 166)Trigonal4.19
R-3m (No. 166)Trigonal4.65
C2/m (No. 12)Monoclinic4.92
C2/m (No. 12)
C2/m (No. 12)Monoclinic4.71
C2/m (No. 12)
R-3m (No. 166)Trigonal4.43
C2/m (No. 12)Monoclinic5.24
R-3m (No. 166)
C2/m (No. 12)
Uses

Applications

Where Mn5O8 is used.

Electrochemical energy storage researchCatalysisPrecursor for manganese oxide synthesis
Reference

Frequently Asked Questions

Common questions about Mn5O8, answered from cross-validated data.

What is Mn5O8?

This manganese oxide is a mixed-valence compound that serves as a precursor or intermediate in the synthesis of various manganese-based materials. It is primarily studied for its structural properties and potential utility in electrochemical energy storage systems.

More questions
What is Mn5O8 used for?
Mn5O8 is used in electrochemical energy storage research, catalysis, and precursor for manganese oxide synthesis.
What is the band gap of Mn5O8?
Mn5O8 has a DFT-computed band gap of 0.55 eV across 12 reported structures.
Is Mn5O8 a metal, semiconductor, or insulator?
With a band gap up to 0.55 eV it is a semiconductor.
Is Mn5O8 thermodynamically stable?
Mn5O8 has a lowest energy above hull of 0.013 eV/atom (near hull (likely stable)).
What is the crystal structure of Mn5O8?
The lowest-energy reported polymorph of Mn5O8 is monoclinic symmetry, space group C2/m (No. 12).
What is the density of Mn5O8?
The computed density of the ground-state structure of Mn5O8 is 4.93 g/cm³.
How many polymorphs of Mn5O8 are known?
12 structures of Mn5O8 are reported across 4 databases, spanning 2 distinct space groups.
What elements does Mn5O8 contain?
Mn5O8 contains Mn and O (2 elements).
Where does the data for Mn5O8 come from?
Mn5O8 data is cross-referenced from materials_project, mpaloe, aflow, jarvis.
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Related Compounds

Other Conversion Oxide Anodes 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.
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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