Hg3PO4

Hg3PO4 is a thermodynamically stable semiconducting mercury phosphate used in materials research.

HgOP
Crystal structure of Hg3PO4
Ground-state structure · Materials Project
Overview

About Hg3PO4

Hg3PO4 is a mercury-based phosphate compound that exhibits semiconducting electronic behavior. As a thermodynamically stable phase located on the convex hull, it represents a well-defined chemical system that has been extensively documented across multiple structural databases.

Its unique composition makes it a subject of interest for researchers investigating mercury-containing inorganic materials. The stability of this compound suggests potential for specialized applications where precise electronic properties are required within a solid-state framework.

At a glance

Key Properties

Cross-validated computational properties for Hg3PO4, aggregated across 3 databases.

Band Gap

0.74–2.20 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

10
3 databases, 1 space group
Uses

Applications

Where Hg3PO4 is used.

Materials science researchSolid-state chemistry studies
Reference

Frequently Asked Questions

Common questions about Hg3PO4, answered from cross-validated data.

What is Hg3PO4?

Hg3PO4 is a thermodynamically stable semiconducting mercury phosphate used in materials research.

More questions
What is Hg3PO4 used for?
Hg3PO4 is used in materials science research and solid-state chemistry studies.
What is the band gap of Hg3PO4?
Hg3PO4 has a DFT-computed band gap of 0.74–2.20 eV across 10 reported structures.
Is Hg3PO4 a metal, semiconductor, or insulator?
With a band gap up to 2.20 eV it is a semiconductor.
Is Hg3PO4 thermodynamically stable?
Yes — Hg3PO4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Hg3PO4 are known?
10 structures of Hg3PO4 are reported across 3 databases, spanning 1 distinct space group.
What elements does Hg3PO4 contain?
Hg3PO4 contains Hg, O, and P (3 elements).
Where does the data for Hg3PO4 come from?
Hg3PO4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct mercury phosphate, Hg3PO4 serves as a foundational reference point for exploring the chemical landscape of mercury-based oxoanion compounds, representing a stable benchmark in its structural class.

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

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