Bi2Cd2I2Se4

Bi2Cd2I2Se4 is a metastable, semiconducting quaternary compound containing bismuth, cadmium, iodine, and selenium.

BiCdISe
Crystal structure of Bi2Cd2I2Se4 (monoclinic, C2/m (No. 12))
Ground-state structure · Materials Project
Overview

About Bi2Cd2I2Se4

Bi2Cd2I2Se4 is a complex quaternary compound composed of bismuth, cadmium, iodine, and selenium. As a semiconducting material, it exhibits electronic properties that make it a subject of interest for researchers investigating novel optoelectronic and sensing architectures.

This material is characterized by a metastable thermodynamic state, suggesting that its synthesis requires precise control over processing conditions. Its structural complexity and the presence of heavy elements like bismuth and selenium contribute to its distinct physical profile within the landscape of inorganic semiconductors.

At a glance

Key Properties

Cross-validated computational properties for Bi2Cd2I2Se4, aggregated across 3 databases.

Band Gap

1.27 eV
Range across DFT structures

Energy Above Hull

0.045 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

4
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Bi2Cd2I2Se4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
C2/m (No. 12)monoclinic1.270.0451-3.3916.71
C2/m (No. 12)
6.05
6.14
Uses

Applications

Where Bi2Cd2I2Se4 is used.

Optoelectronic researchSemiconductor device developmentMaterials science exploration
Reference

Frequently Asked Questions

Common questions about Bi2Cd2I2Se4, answered from cross-validated data.

What is Bi2Cd2I2Se4?

Bi2Cd2I2Se4 is a metastable, semiconducting quaternary compound containing bismuth, cadmium, iodine, and selenium.

More questions
What is Bi2Cd2I2Se4 used for?
Bi2Cd2I2Se4 is used in optoelectronic research, semiconductor device development, and materials science exploration.
What is the band gap of Bi2Cd2I2Se4?
Bi2Cd2I2Se4 has a DFT-computed band gap of 1.27 eV across 4 reported structures.
Is Bi2Cd2I2Se4 a metal, semiconductor, or insulator?
With a band gap up to 1.27 eV it is a semiconductor.
Is Bi2Cd2I2Se4 thermodynamically stable?
Bi2Cd2I2Se4 has a lowest energy above hull of 0.045 eV/atom (metastable).
What is the crystal structure of Bi2Cd2I2Se4?
The lowest-energy reported polymorph of Bi2Cd2I2Se4 is monoclinic symmetry, space group C2/m (No. 12).
What is the density of Bi2Cd2I2Se4?
The computed density of the ground-state structure of Bi2Cd2I2Se4 is 6.71 g/cm³.
How many polymorphs of Bi2Cd2I2Se4 are known?
4 structures of Bi2Cd2I2Se4 are reported across 3 databases, spanning 1 distinct space group.
What elements does Bi2Cd2I2Se4 contain?
Bi2Cd2I2Se4 contains Bi, Cd, I, and Se (4 elements).
Where does the data for Bi2Cd2I2Se4 come from?
Bi2Cd2I2Se4 data is cross-referenced from materials_project, aflow, omat24.
Comparison

How It Compares

As a unique quaternary chalcogenide-iodide, Bi2Cd2I2Se4 represents an specialized niche in semiconductor materials science. Unlike more common binary or ternary compounds, its multi-element composition allows for a highly tunable electronic environment, positioning it as a distinct candidate for exploratory research into complex, metastable crystalline systems.

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

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