Bi4K12Te12

This compound is a complex ternary chalcogenide containing bismuth, potassium, and tellurium. It is primarily studied in solid-state chemistry research for its structural properties and potential electronic characteristics.

Crystal structure of Bi4K12Te12 (cubic, P213 (No. 198))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Bi4K12Te12, aggregated across 3 databases.

Band Gap

1.23 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

3
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Bi4K12Te12, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P213 (No. 198)cubic1.230.0000-22.7884.16
P213 (No. 198)
3.20
Uses

Applications

Where Bi4K12Te12 is used.

Solid-state chemistry researchMaterials science exploration
Reference

Frequently Asked Questions

Common questions about Bi4K12Te12, answered from cross-validated data.

What is Bi4K12Te12?

This compound is a complex ternary chalcogenide containing bismuth, potassium, and tellurium. It is primarily studied in solid-state chemistry research for its structural properties and potential electronic characteristics.

More questions
What is Bi4K12Te12 used for?
Bi4K12Te12 is used in solid-state chemistry research and materials science exploration.
What is the band gap of Bi4K12Te12?
Bi4K12Te12 has a DFT-computed band gap of 1.23 eV across 3 reported structures.
Is Bi4K12Te12 a metal, semiconductor, or insulator?
With a band gap up to 1.23 eV it is a semiconductor.
Is Bi4K12Te12 thermodynamically stable?
Yes — Bi4K12Te12 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Bi4K12Te12?
The lowest-energy reported polymorph of Bi4K12Te12 is cubic symmetry, space group P213 (No. 198).
What is the density of Bi4K12Te12?
The computed density of the ground-state structure of Bi4K12Te12 is 4.16 g/cm³.
How many polymorphs of Bi4K12Te12 are known?
3 structures of Bi4K12Te12 are reported across 3 databases, spanning 1 distinct space group.
What elements does Bi4K12Te12 contain?
Bi4K12Te12 contains Bi, K, and Te (3 elements).
Where does the data for Bi4K12Te12 come from?
Bi4K12Te12 data is cross-referenced from materials_project, aflow, omat24.
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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).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).

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