In5CuSe8

In5CuSe8 is a stable semiconducting chalcogenide material primarily investigated for its potential as an absorber layer in photovoltaic solar cells.

Crystal structure of In5CuSe8 (tetragonal, P-42m (No. 111))
Ground-state structure · Materials Project
Overview

About In5CuSe8

In5CuSe8 is a semiconducting chalcogenide compound that exists as a thermodynamically stable phase within its chemical system. Its electronic structure and stability make it a compelling candidate for research in thin-film solar cell technologies.

This material serves as a specialized absorber layer designed to capture light across the solar spectrum. By leveraging its unique composition, researchers aim to optimize charge carrier dynamics and improve the overall efficiency of next-generation photovoltaic devices.

At a glance

Key Properties

Cross-validated computational properties for In5CuSe8, aggregated across 3 databases.

Band Gap

0.45 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

5
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for In5CuSe8, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P-42m (No. 111)tetragonal0.450.0000-17.6675.34
P-42m (No. 111)Tetragonal5.18
P-42m (No. 111)Tetragonal5.42
P-42m (No. 111)Tetragonal5.35
P-42m (No. 111)
Uses

Applications

Where In5CuSe8 is used.

Photovoltaic solar cellsThin-film semiconductor researchOptoelectronic devices
Reference

Frequently Asked Questions

Common questions about In5CuSe8, answered from cross-validated data.

What is In5CuSe8?

In5CuSe8 is a stable semiconducting chalcogenide material primarily investigated for its potential as an absorber layer in photovoltaic solar cells.

More questions
What is In5CuSe8 used for?
In5CuSe8 is used in photovoltaic solar cells, thin-film semiconductor research, and optoelectronic devices.
What is the band gap of In5CuSe8?
In5CuSe8 has a DFT-computed band gap of 0.45 eV across 5 reported structures.
Is In5CuSe8 a metal, semiconductor, or insulator?
With a band gap up to 0.45 eV it is a semiconductor.
Is In5CuSe8 thermodynamically stable?
Yes — In5CuSe8 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of In5CuSe8?
The lowest-energy reported polymorph of In5CuSe8 is tetragonal symmetry, space group P-42m (No. 111).
What is the density of In5CuSe8?
The computed density of the ground-state structure of In5CuSe8 is 5.34 g/cm³.
How many polymorphs of In5CuSe8 are known?
5 structures of In5CuSe8 are reported across 3 databases, spanning 1 distinct space group.
What elements does In5CuSe8 contain?
In5CuSe8 contains Cu, In, and Se (3 elements).
Where does the data for In5CuSe8 come from?
In5CuSe8 data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

Within the chalcogenide photovoltaic absorbers class.

Within the diverse family of chalcogenide photovoltaic absorbers, In5CuSe8 occupies a distinct niche compared to multi-component systems like Cu2SnSe3. While many class members focus on copper-tin-chalcogenide frameworks, this indium-rich compound offers a different stoichiometric balance that influences its structural stability and optoelectronic response, positioning it as a valuable alternative for band-gap engineering in thin-film applications.

Explore

Related Compounds

Other Chalcogenide Photovoltaic Absorbers in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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