As4Cd4P4

As4Cd4P4 is a metastable semiconducting material composed of arsenic, cadmium, and phosphorus used in materials science research.

AsCdP
Crystal structure of As4Cd4P4 (orthorhombic, I212121 (No. 24))
Ground-state structure · Materials Project
Overview

About As4Cd4P4

As4Cd4P4 is a complex quaternary compound composed of arsenic, cadmium, and phosphorus. Its electronic character identifies it as a semiconductor, positioning it as a subject of interest for specialized electronic and optoelectronic material research.

As a metastable phase, this material represents a specific structural arrangement that requires precise synthesis conditions. It is primarily studied within academic and materials science contexts to understand the interplay between its constituent elements and its potential for functional applications.

At a glance

Key Properties

Cross-validated computational properties for As4Cd4P4, aggregated across 3 databases.

Band Gap

0.42 eV
Range across DFT structures

Energy Above Hull

0.034 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

4
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for As4Cd4P4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
I212121 (No. 24)orthorhombic0.420.0340-3.7324.89
5.46
3.97
Pnma (No. 62)
Uses

Applications

Where As4Cd4P4 is used.

Semiconductor researchMaterials science studiesElectronic property investigation
Reference

Frequently Asked Questions

Common questions about As4Cd4P4, answered from cross-validated data.

What is As4Cd4P4?

As4Cd4P4 is a metastable semiconducting material composed of arsenic, cadmium, and phosphorus used in materials science research.

More questions
What is As4Cd4P4 used for?
As4Cd4P4 is used in semiconductor research, materials science studies, and electronic property investigation.
What is the band gap of As4Cd4P4?
As4Cd4P4 has a DFT-computed band gap of 0.42 eV across 4 reported structures.
Is As4Cd4P4 a metal, semiconductor, or insulator?
With a band gap up to 0.42 eV it is a semiconductor.
Is As4Cd4P4 thermodynamically stable?
As4Cd4P4 has a lowest energy above hull of 0.034 eV/atom (metastable).
What is the crystal structure of As4Cd4P4?
The lowest-energy reported polymorph of As4Cd4P4 is orthorhombic symmetry, space group I212121 (No. 24).
What is the density of As4Cd4P4?
The computed density of the ground-state structure of As4Cd4P4 is 4.89 g/cm³.
How many polymorphs of As4Cd4P4 are known?
4 structures of As4Cd4P4 are reported across 3 databases, spanning 2 distinct space groups.
What elements does As4Cd4P4 contain?
As4Cd4P4 contains As, Cd, and P (3 elements).
Where does the data for As4Cd4P4 come from?
As4Cd4P4 data is cross-referenced from materials_project, omat24, aflow.
Comparison

How It Compares

As4Cd4P4 occupies a niche position in materials science as a metastable semiconductor. Without direct structural siblings in its immediate class, it serves as a unique case study for how ternary and quaternary combinations of pnictogens and transition metals can be stabilized to achieve specific electronic behaviors.

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).

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