Bi4F20K8

Bi4F20K8 is a thermodynamically stable, insulating fluoride compound that belongs to the broader class of halide perovskite-related materials.

Crystal structure of Bi4F20K8 (orthorhombic, Pnma (No. 62))
Ground-state structure · Materials Project
Overview

About Bi4F20K8

Bi4F20K8 is a complex fluoride-based compound that sits within the broader family of halide perovskite materials. As a thermodynamically stable phase, it represents a well-defined structural arrangement that maintains integrity under standard conditions.

Characterized by a wide-gap insulating electronic profile, this material serves as a distinct entry in the study of perovskite-related structures. Its unique composition of bismuth, fluorine, and potassium makes it a subject of interest for researchers investigating the structural diversity of halide-based frameworks.

At a glance

Key Properties

Cross-validated computational properties for Bi4F20K8, aggregated across 3 databases.

Band Gap

4.77 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 Bi4F20K8, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Pnma (No. 62)orthorhombic4.770.0000-4.8994.60
3.46
Pnma (No. 62)
Uses

Applications

Where Bi4F20K8 is used.

Structural research in halide perovskite frameworksSolid-state electrolyte modelingFundamental materials science studies
Reference

Frequently Asked Questions

Common questions about Bi4F20K8, answered from cross-validated data.

What is Bi4F20K8?

Bi4F20K8 is a thermodynamically stable, insulating fluoride compound that belongs to the broader class of halide perovskite-related materials.

More questions
What is Bi4F20K8 used for?
Bi4F20K8 is used in structural research in halide perovskite frameworks, solid-state electrolyte modeling, and fundamental materials science studies.
What is the band gap of Bi4F20K8?
Bi4F20K8 has a DFT-computed band gap of 4.77 eV across 3 reported structures.
Is Bi4F20K8 a metal, semiconductor, or insulator?
With a wide band gap up to 4.77 eV it is an insulator / wide-band-gap material.
Is Bi4F20K8 thermodynamically stable?
Yes — Bi4F20K8 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Bi4F20K8?
The lowest-energy reported polymorph of Bi4F20K8 is orthorhombic symmetry, space group Pnma (No. 62).
What is the density of Bi4F20K8?
The computed density of the ground-state structure of Bi4F20K8 is 4.60 g/cm³.
How many polymorphs of Bi4F20K8 are known?
3 structures of Bi4F20K8 are reported across 3 databases, spanning 1 distinct space group.
What elements does Bi4F20K8 contain?
Bi4F20K8 contains Bi, F, and K (3 elements).
Where does the data for Bi4F20K8 come from?
Bi4F20K8 data is cross-referenced from materials_project, omat24, aflow.
Comparison

How It Compares

Within the halide perovskite photovoltaics class.

Unlike the more commonly studied semiconducting perovskites such as CsPbBr3 or CsSnI3, which are frequently utilized for their optoelectronic properties, Bi4F20K8 functions as a wide-gap insulator. While its siblings are often optimized for light absorption and charge transport, this compound occupies a different niche, providing a stable, insulating structural model that contrasts with the narrower-gap, metal-halide perovskites.

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).
  • 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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