K4Sn3Se8

K4Sn3Se8 is a stable, semiconducting chalcogenide material investigated for its potential applications in next-generation photovoltaic and optoelectronic devices.

Crystal structure of K4Sn3Se8 (orthorhombic, Ccce (No. 68))
Ground-state structure · Materials Project
Overview

About K4Sn3Se8

K4Sn3Se8 is a semiconducting compound that occupies a stable position on the thermodynamic convex hull. Its structural integrity and electronic nature make it a subject of interest for researchers investigating alternative materials for energy conversion applications. The compound has been well-documented across multiple structural databases, reflecting its significance in materials science. It serves as a candidate for exploring the complex interplay between alkali metals and tin-selenium frameworks within the broader context of perovskite-inspired photovoltaics. By leveraging its stable crystalline arrangement, scientists aim to tune its electronic properties for potential use in optoelectronic devices.

At a glance

Key Properties

Cross-validated computational properties for K4Sn3Se8, aggregated across 3 databases.

Band Gap

1.50 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 K4Sn3Se8, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Ccce (No. 68)orthorhombic1.500.0000-4.0063.94
Ccce (No. 68)
Ccce (No. 68)Orthorhombic3.78
Ccce (No. 68)Orthorhombic3.93
Ccce (No. 68)Orthorhombic3.89
Uses

Applications

Where K4Sn3Se8 is used.

Photovoltaic researchOptoelectronic device developmentSemiconductor materials science
Reference

Frequently Asked Questions

Common questions about K4Sn3Se8, answered from cross-validated data.

What is K4Sn3Se8?

K4Sn3Se8 is a stable, semiconducting chalcogenide material investigated for its potential applications in next-generation photovoltaic and optoelectronic devices.

More questions
What is K4Sn3Se8 used for?
K4Sn3Se8 is used in photovoltaic research, optoelectronic device development, and semiconductor materials science.
What is the band gap of K4Sn3Se8?
K4Sn3Se8 has a DFT-computed band gap of 1.50 eV across 5 reported structures.
Is K4Sn3Se8 a metal, semiconductor, or insulator?
With a band gap up to 1.50 eV it is a semiconductor.
Is K4Sn3Se8 thermodynamically stable?
Yes — K4Sn3Se8 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of K4Sn3Se8?
The lowest-energy reported polymorph of K4Sn3Se8 is orthorhombic symmetry, space group Ccce (No. 68).
What is the density of K4Sn3Se8?
The computed density of the ground-state structure of K4Sn3Se8 is 3.94 g/cm³.
How many polymorphs of K4Sn3Se8 are known?
5 structures of K4Sn3Se8 are reported across 3 databases, spanning 1 distinct space group.
What elements does K4Sn3Se8 contain?
K4Sn3Se8 contains K, Se, and Sn (3 elements).
Where does the data for K4Sn3Se8 come from?
K4Sn3Se8 data is cross-referenced from materials_project, jarvis, mpaloe.
Comparison

How It Compares

Within the halide perovskite photovoltaics class.

Unlike the widely studied lead-based perovskites such as CsPbBr3 or CsSnI3, K4Sn3Se8 represents a distinct structural class that avoids the toxicity concerns associated with heavy metal halides. While siblings like Cs4I12Sn4 rely on halide frameworks, this compound utilizes selenium to achieve its semiconducting behavior, offering a different pathway for bandgap engineering in thin-film technologies.

Explore

Related Compounds

Other Halide Perovskite Photovoltaics in the database.

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

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