As4Cs4Se18Sn2

As4Cs4Se18Sn2 is a thermodynamically stable semiconducting material composed of arsenic, cesium, selenium, and tin, utilized in advanced materials research.

Crystal structure of As4Cs4Se18Sn2 (monoclinic, P21 (No. 4))
Ground-state structure · Materials Project
Overview

About As4Cs4Se18Sn2

As4Cs4Se18Sn2 is a complex semiconducting compound that occupies a stable position on the convex hull. Its unique structural arrangement of arsenic, cesium, selenium, and tin makes it a subject of interest for researchers investigating new pathways in solid-state chemistry and electronic materials.

This material is primarily studied for its potential utility in advanced photovoltaic and optoelectronic applications. By leveraging its stable electronic character, scientists aim to explore how such multi-element frameworks can contribute to the development of next-generation energy conversion technologies.

At a glance

Key Properties

Cross-validated computational properties for As4Cs4Se18Sn2, aggregated across 3 databases.

Band Gap

0.77 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
1 DFT source

Structures

3
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for As4Cs4Se18Sn2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P21 (No. 4)monoclinic0.770.0000-4.0754.23
No. 0unknown2.38
P21 (No. 4)
Uses

Applications

Where As4Cs4Se18Sn2 is used.

Photovoltaic researchOptoelectronic device developmentSolid-state semiconductor studies
Reference

Frequently Asked Questions

Common questions about As4Cs4Se18Sn2, answered from cross-validated data.

What is As4Cs4Se18Sn2?

As4Cs4Se18Sn2 is a thermodynamically stable semiconducting material composed of arsenic, cesium, selenium, and tin, utilized in advanced materials research.

More questions
What is As4Cs4Se18Sn2 used for?
As4Cs4Se18Sn2 is used in photovoltaic research, optoelectronic device development, and solid-state semiconductor studies.
What is the band gap of As4Cs4Se18Sn2?
As4Cs4Se18Sn2 has a DFT-computed band gap of 0.77 eV across 3 reported structures.
Is As4Cs4Se18Sn2 a metal, semiconductor, or insulator?
With a band gap up to 0.77 eV it is a semiconductor.
Is As4Cs4Se18Sn2 thermodynamically stable?
Yes — As4Cs4Se18Sn2 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of As4Cs4Se18Sn2?
The lowest-energy reported polymorph of As4Cs4Se18Sn2 is monoclinic symmetry, space group P21 (No. 4).
What is the density of As4Cs4Se18Sn2?
The computed density of the ground-state structure of As4Cs4Se18Sn2 is 4.23 g/cm³.
How many polymorphs of As4Cs4Se18Sn2 are known?
3 structures of As4Cs4Se18Sn2 are reported across 3 databases, spanning 2 distinct space groups.
What elements does As4Cs4Se18Sn2 contain?
As4Cs4Se18Sn2 contains As, Cs, Se, and Sn (4 elements).
Where does the data for As4Cs4Se18Sn2 come from?
As4Cs4Se18Sn2 data is cross-referenced from materials_project, cod, aflow.
Comparison

How It Compares

Within the halide perovskite photovoltaics class.

Within the broad landscape of halide-related photovoltaics, As4Cs4Se18Sn2 distinguishes itself through its complex chalcogenide composition compared to simpler, more traditional perovskite structures like CsPbBr3 or CsSnI3. While many of its class members rely on standard halide frameworks, this compound utilizes a more intricate anionic network, positioning it as a specialized alternative for exploring non-traditional semiconductor architectures.

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).
  • cod — Data from the Crystallography Open Database. Cite: Grazulis et al., Nucleic Acids Res. 40, D420 (2012).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).

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