K4TiO4

K4TiO4 is a stable, wide-gap insulating oxide that serves as an important structural member of the perovskite-related material class.

Crystal structure of K4TiO4
Ground-state structure · Materials Project
Overview

About K4TiO4

K4TiO4 is a thermodynamically stable oxide that occupies a distinct position within the perovskite-related family. As a wide-gap insulating material, it exhibits electronic properties characteristic of highly ionic oxide structures, making it a subject of interest for fundamental materials research.

Its stability on the convex hull suggests a robust structural configuration, supported by multiple documented experimental and computational reports. This reliability makes K4TiO4 a valuable reference point for understanding the phase space and chemical bonding trends in alkali-metal-based titanates.

At a glance

Key Properties

Cross-validated computational properties for K4TiO4, aggregated across 3 databases.

Band Gap

3.15–3.35 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

10
3 databases, 3 space groups
Uses

Applications

Where K4TiO4 is used.

Fundamental materials researchSolid-state chemistry modelingOxide phase stability studies
Reference

Frequently Asked Questions

Common questions about K4TiO4, answered from cross-validated data.

What is K4TiO4?

K4TiO4 is a stable, wide-gap insulating oxide that serves as an important structural member of the perovskite-related material class.

More questions
What is K4TiO4 used for?
K4TiO4 is used in fundamental materials research, solid-state chemistry modeling, and oxide phase stability studies.
What is the band gap of K4TiO4?
K4TiO4 has a DFT-computed band gap of 3.15–3.35 eV across 10 reported structures.
Is K4TiO4 a metal, semiconductor, or insulator?
With a wide band gap up to 3.35 eV it is an insulator / wide-band-gap material.
Is K4TiO4 thermodynamically stable?
Yes — K4TiO4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of K4TiO4 are known?
10 structures of K4TiO4 are reported across 3 databases, spanning 3 distinct space groups.
What elements does K4TiO4 contain?
K4TiO4 contains K, O, and Ti (3 elements).
Where does the data for K4TiO4 come from?
K4TiO4 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the perovskite oxides class.

Unlike the more commonly studied transition-metal perovskites such as BaTiO3 or LaMnO3, which are frequently investigated for their ferroelectric or magnetic properties, K4TiO4 is characterized by its insulating nature and specific alkali-metal stoichiometry. While siblings like LaAlO3 are often utilized as substrate materials, K4TiO4 serves as a unique structural example of how alkali-rich environments influence the stability of titanium-centered oxide frameworks.

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Related Compounds

Other Perovskite Oxides in the database.

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

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