MnSi2O5

MnSi2O5 is a semiconducting manganese silicate oxide being studied for its potential role in catalytic oxygen-evolution reactions.

Crystal structure of MnSi2O5 (monoclinic, C2/c (No. 15))
Ground-state structure · Materials Project
Overview

About MnSi2O5

MnSi2O5 is a semiconducting oxide that functions within the broader category of oxygen-evolution catalysts. Its structural composition, involving manganese and silicon, places it in a specialized niche of materials investigated for their electrochemical potential in energy conversion processes.

While this compound is currently classified as thermodynamically unstable relative to its constituent phases, its existence across multiple structural configurations highlights the complexity of manganese-based oxides. Understanding its electronic character is essential for researchers evaluating its viability in catalytic water-splitting applications.

At a glance

Key Properties

Cross-validated computational properties for MnSi2O5, aggregated across 3 databases.

Band Gap

2.24 eV
Range across DFT structures

Energy Above Hull

0.106 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

6
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for MnSi2O5, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
C2/c (No. 15)monoclinic2.240.1057-8.4643.93
P4/ncc (No. 130)tetragonal0.000.1859-8.1532.75
C2/c (No. 15)
C2/c (No. 15)Monoclinic3.93
C2/c (No. 15)Monoclinic4.05
C2/c (No. 15)Monoclinic4.22
Uses

Applications

Where MnSi2O5 is used.

Oxygen-evolution catalysis researchElectrochemical energy conversion studies
Reference

Frequently Asked Questions

Common questions about MnSi2O5, answered from cross-validated data.

What is MnSi2O5?

MnSi2O5 is a semiconducting manganese silicate oxide being studied for its potential role in catalytic oxygen-evolution reactions.

More questions
What is MnSi2O5 used for?
MnSi2O5 is used in oxygen-evolution catalysis research and electrochemical energy conversion studies.
What is the band gap of MnSi2O5?
MnSi2O5 has a DFT-computed band gap of 2.24 eV across 6 reported structures.
Is MnSi2O5 a metal, semiconductor, or insulator?
With a band gap up to 2.24 eV it is a semiconductor.
Is MnSi2O5 thermodynamically stable?
MnSi2O5 has a lowest energy above hull of 0.106 eV/atom (above hull).
What is the crystal structure of MnSi2O5?
The lowest-energy reported polymorph of MnSi2O5 is monoclinic symmetry, space group C2/c (No. 15).
What is the density of MnSi2O5?
The computed density of the ground-state structure of MnSi2O5 is 3.93 g/cm³.
How many polymorphs of MnSi2O5 are known?
6 structures of MnSi2O5 are reported across 3 databases, spanning 2 distinct space groups.
What elements does MnSi2O5 contain?
MnSi2O5 contains Mn, O, and Si (3 elements).
Where does the data for MnSi2O5 come from?
MnSi2O5 data is cross-referenced from materials_project, jarvis, mpaloe.
Comparison

How It Compares

Within the oxide oxygen-evolution catalysts class.

Unlike highly stable and widely utilized class members such as LiMn2O4 or LaMnO3, MnSi2O5 is characterized by its position above the thermodynamic hull, suggesting it is a metastable phase. While materials like NiO are standard benchmarks for oxygen evolution, MnSi2O5 represents a more experimental candidate that requires careful synthesis control due to its complex structural landscape compared to the simpler perovskite architectures found in the rest of the class.

Explore

Related Compounds

Other Oxide Oxygen-Evolution Catalysts in the database.

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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