Bi4In8S18

Bi4In8S18 is a semiconducting ternary sulfide compound that is thermodynamically stable and structurally well-characterized.

BiInS
Crystal structure of Bi4In8S18 (monoclinic, P21/m (No. 11))
Ground-state structure · Materials Project
Overview

About Bi4In8S18

Bi4In8S18 is a complex ternary sulfide composed of bismuth, indium, and sulfur. As a semiconducting material, it exhibits electronic properties that make it a subject of interest for specialized solid-state research and potential functional device integration.

This compound is characterized by its proximity to the thermodynamic hull, suggesting that it is a stable phase capable of being synthesized in a laboratory setting. Its presence across multiple structural databases highlights its significance as a well-documented member of the bismuth-indium-sulfur system.

At a glance

Key Properties

Cross-validated computational properties for Bi4In8S18, aggregated across 3 databases.

Band Gap

1.63 eV
Range across DFT structures

Energy Above Hull

0.002 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

4
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Bi4In8S18, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P21/m (No. 11)monoclinic1.630.0022-19.2735.31
4.08
P21/m (No. 11)
P21/m (No. 11)
Uses

Applications

Where Bi4In8S18 is used.

Semiconductor researchSolid-state electronicsOptoelectronic material development
Reference

Frequently Asked Questions

Common questions about Bi4In8S18, answered from cross-validated data.

What is Bi4In8S18?

Bi4In8S18 is a semiconducting ternary sulfide compound that is thermodynamically stable and structurally well-characterized.

More questions
What is Bi4In8S18 used for?
Bi4In8S18 is used in semiconductor research, solid-state electronics, and optoelectronic material development.
What is the band gap of Bi4In8S18?
Bi4In8S18 has a DFT-computed band gap of 1.63 eV across 4 reported structures.
Is Bi4In8S18 a metal, semiconductor, or insulator?
With a band gap up to 1.63 eV it is a semiconductor.
Is Bi4In8S18 thermodynamically stable?
Bi4In8S18 has a lowest energy above hull of 0.002 eV/atom (near hull (likely stable)).
What is the crystal structure of Bi4In8S18?
The lowest-energy reported polymorph of Bi4In8S18 is monoclinic symmetry, space group P21/m (No. 11).
What is the density of Bi4In8S18?
The computed density of the ground-state structure of Bi4In8S18 is 5.31 g/cm³.
How many polymorphs of Bi4In8S18 are known?
4 structures of Bi4In8S18 are reported across 3 databases, spanning 1 distinct space group.
What elements does Bi4In8S18 contain?
Bi4In8S18 contains Bi, In, and S (3 elements).
Where does the data for Bi4In8S18 come from?
Bi4In8S18 data is cross-referenced from materials_project, omat24, aflow.
Comparison

How It Compares

As a unique ternary sulfide, Bi4In8S18 serves as a distinct representative of complex chalcogenide systems. It occupies a specialized niche in materials science where the interplay between heavy metal cations and sulfur anions allows for diverse structural arrangements, distinguishing it from simpler binary or ternary sulfide phases.

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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