As4O20P4

As4O20P4 is a stable, semiconducting inorganic compound consisting of arsenic, phosphorus, and oxygen atoms.

AsOP
Crystal structure of As4O20P4 (orthorhombic, P212121 (No. 19))
Ground-state structure · Materials Project
Overview

About As4O20P4

As4O20P4 is a complex inorganic compound composed of arsenic, oxygen, and phosphorus. As a thermodynamically stable phase residing on the convex hull, it represents a robust structural arrangement within its chemical system.

This material exhibits semiconducting electronic character, making it a subject of interest for fundamental studies in solid-state physics. Its unique atomic configuration allows for diverse structural manifestations, as evidenced by multiple reported entries across research databases.

At a glance

Key Properties

Cross-validated computational properties for As4O20P4, aggregated across 4 databases.

Band Gap

2.02 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

4
4 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for As4O20P4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P212121 (No. 19)orthorhombic2.020.0000-7.0393.92
2.54
P212121 (No. 19)
No. 0unknown0.99
Uses

Applications

Where As4O20P4 is used.

Fundamental materials science researchSolid-state physics studies
Reference

Frequently Asked Questions

Common questions about As4O20P4, answered from cross-validated data.

What is As4O20P4?

As4O20P4 is a stable, semiconducting inorganic compound consisting of arsenic, phosphorus, and oxygen atoms.

More questions
What is As4O20P4 used for?
As4O20P4 is used in fundamental materials science research and solid-state physics studies.
What is the band gap of As4O20P4?
As4O20P4 has a DFT-computed band gap of 2.02 eV across 4 reported structures.
Is As4O20P4 a metal, semiconductor, or insulator?
With a band gap up to 2.02 eV it is a semiconductor.
Is As4O20P4 thermodynamically stable?
Yes — As4O20P4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of As4O20P4?
The lowest-energy reported polymorph of As4O20P4 is orthorhombic symmetry, space group P212121 (No. 19).
What is the density of As4O20P4?
The computed density of the ground-state structure of As4O20P4 is 3.92 g/cm³.
How many polymorphs of As4O20P4 are known?
4 structures of As4O20P4 are reported across 4 databases, spanning 2 distinct space groups.
What elements does As4O20P4 contain?
As4O20P4 contains As, O, and P (3 elements).
Where does the data for As4O20P4 come from?
As4O20P4 data is cross-referenced from materials_project, omat24, aflow, cod.
Comparison

How It Compares

As a distinct inorganic compound, As4O20P4 occupies a specialized niche in the landscape of arsenic-phosphorus-oxygen materials. Without direct structural siblings in this specific class, it serves as a primary reference point for understanding the stability and electronic behavior of complex polyanionic frameworks in this chemical space.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).
  • cod — Data from the Crystallography Open Database. Cite: Grazulis et al., Nucleic Acids Res. 40, D420 (2012).

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