Bi4K4S16Si4

Bi4K4S16Si4 is a thermodynamically stable semiconducting quaternary sulfide composed of bismuth, potassium, sulfur, and silicon.

BiKSSi
Crystal structure of Bi4K4S16Si4
Ground-state structure · Materials Project
Overview

About Bi4K4S16Si4

Bi4K4S16Si4 is a complex quaternary sulfide characterized by its semiconducting electronic nature. As a thermodynamically stable phase residing on the convex hull, it represents a well-defined structural arrangement of bismuth, potassium, sulfur, and silicon atoms.

This material is of significant interest in solid-state chemistry due to its structural complexity and stability. Its unique composition makes it a subject of study for researchers exploring new semiconducting materials for specialized technological applications.

At a glance

Key Properties

Cross-validated computational properties for Bi4K4S16Si4, aggregated across 4 databases.

Band Gap

2.05 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

6
4 databases, 2 space groups
Uses

Applications

Where Bi4K4S16Si4 is used.

Semiconductor researchSolid-state materials development
Reference

Frequently Asked Questions

Common questions about Bi4K4S16Si4, answered from cross-validated data.

What is Bi4K4S16Si4?

Bi4K4S16Si4 is a thermodynamically stable semiconducting quaternary sulfide composed of bismuth, potassium, sulfur, and silicon.

More questions
What is Bi4K4S16Si4 used for?
Bi4K4S16Si4 is used in semiconductor research and solid-state materials development.
What is the band gap of Bi4K4S16Si4?
Bi4K4S16Si4 has a DFT-computed band gap of 2.05 eV across 6 reported structures.
Is Bi4K4S16Si4 a metal, semiconductor, or insulator?
With a band gap up to 2.05 eV it is a semiconductor.
Is Bi4K4S16Si4 thermodynamically stable?
Yes — Bi4K4S16Si4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Bi4K4S16Si4 are known?
6 structures of Bi4K4S16Si4 are reported across 4 databases, spanning 2 distinct space groups.
What elements does Bi4K4S16Si4 contain?
Bi4K4S16Si4 contains Bi, K, S, and Si (4 elements).
Where does the data for Bi4K4S16Si4 come from?
Bi4K4S16Si4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique quaternary compound, Bi4K4S16Si4 serves as a distinct example of how bismuth and silicon can be integrated into a stable sulfide framework. While many similar chalcogenides are explored for their optoelectronic properties, this specific stoichiometry highlights the structural diversity possible within complex sulfur-based systems.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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