Mg2P2S6
Mg2P2S6 is a thermodynamically stable semiconducting material composed of magnesium, phosphorus, and sulfur.

About Mg2P2S6
Mg2P2S6 is a semiconducting compound composed of magnesium, phosphorus, and sulfur. As a thermodynamically stable material located on the convex hull, it represents a robust phase within its compositional space, offering a reliable structural foundation for further investigation.
Its electronic character as a semiconductor makes it an intriguing candidate for specialized electronic and optoelectronic applications. The material has been documented with multiple reported structures, reflecting a significant level of interest in its potential for structural diversity and functional performance.
Key Properties
Cross-validated computational properties for Mg2P2S6, aggregated across 3 databases.
Band GapEnergy needed to move an electron from the valence band to the conduction band. Lower or zero values tend to behave more metallic; larger gaps are more insulating or semiconducting.
Energy Above HullThermodynamic distance from the most stable set of competing phases. 0 eV/atom is on the convex hull; small positive values may still be experimentally accessible.
StabilityA plain-language summary of the best reported energy-above-hull result. It reflects whether the lowest-energy structure is on, near, or far from the stability hull.
StructuresCount of reported calculated crystal structures for this formula, including alternate polymorphs, source databases, and observed space groups.
Applications
Where Mg2P2S6 is used.
Frequently Asked Questions
Common questions about Mg2P2S6, answered from cross-validated data.
What is Mg2P2S6?
Mg2P2S6 is a thermodynamically stable semiconducting material composed of magnesium, phosphorus, and sulfur.
What is Mg2P2S6 used for?
What is the band gap of Mg2P2S6?
Is Mg2P2S6 a metal, semiconductor, or insulator?
Is Mg2P2S6 thermodynamically stable?
How many polymorphs of Mg2P2S6 are known?
What elements does Mg2P2S6 contain?
Where does the data for Mg2P2S6 come from?
How It Compares
As a thermodynamically stable member of its chemical family, Mg2P2S6 serves as a foundational reference point for exploring the broader potential of magnesium-phosphorus-sulfur compounds in solid-state chemistry.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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