MgCoPO5

MgCoPO5 is a semiconducting transition-metal phosphate characterized by multiple reported structural forms and limited thermodynamic stability.

Crystal structure of MgCoPO5
Ground-state structure · Materials Project
Overview

About MgCoPO5

MgCoPO5 is a complex transition-metal phosphate featuring a semiconducting electronic profile. As a member of the diverse phosphate family, it represents a synthetic challenge due to its position above the thermodynamic hull, indicating limited stability under standard conditions. Despite its inherent instability, the compound is of interest in fundamental materials research due to the multiple structural configurations reported across databases. Its study contributes to the broader understanding of how magnesium and cobalt ions coordinate within phosphate frameworks.

At a glance

Key Properties

Cross-validated computational properties for MgCoPO5, aggregated across 3 databases.

Band Gap

0.15 eV
Range across DFT structures

Energy Above Hull

0.117 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

5
3 databases, 1 space group
Reference

Frequently Asked Questions

Common questions about MgCoPO5, answered from cross-validated data.

What is MgCoPO5?

MgCoPO5 is a semiconducting transition-metal phosphate characterized by multiple reported structural forms and limited thermodynamic stability.

More questions
What is the band gap of MgCoPO5?
MgCoPO5 has a DFT-computed band gap of 0.15 eV across 5 reported structures.
Is MgCoPO5 a metal, semiconductor, or insulator?
With a band gap up to 0.15 eV it is a semiconductor.
Is MgCoPO5 thermodynamically stable?
MgCoPO5 has a lowest energy above hull of 0.117 eV/atom (above hull).
How many polymorphs of MgCoPO5 are known?
5 structures of MgCoPO5 are reported across 3 databases, spanning 1 distinct space group.
What elements does MgCoPO5 contain?
MgCoPO5 contains Co, Mg, O, and P (4 elements).
Where does the data for MgCoPO5 come from?
MgCoPO5 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the transition-metal phosphates class.

Unlike the highly stable and technologically vital olivine-structured phosphates such as LiFePO4 and LiCoPO4, which are widely utilized in electrochemical energy storage, MgCoPO5 lacks the same thermodynamic robustness. While its siblings like LiFePO4 exhibit well-defined, reversible redox chemistry, MgCoPO5 remains a more elusive member of the class, primarily serving as a subject for structural exploration rather than immediate commercial application.

Explore

Related Compounds

Other Transition-Metal Phosphates in the database.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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