LuTaO4

Lutetium tantalate · Lutetium orthotantalate

Lutetium tantalate is a stable, insulating oxide widely utilized as a high-density phosphor host in X-ray imaging technology.

LuOTa
Crystal structure of LuTaO4 (monoclinic, P2/c (No. 13))
Ground-state structure · Materials Project
Overview

About Lutetium tantalate

Lutetium tantalate is a robust, thermodynamically stable inorganic oxide that functions as a wide-gap insulator. Its structural integrity and electronic properties make it a highly reliable material for demanding optical and sensing environments.

Because it sits firmly on the convex hull, this compound exhibits excellent chemical and thermal stability. These characteristics are essential for its role in high-performance applications where material longevity and consistent performance under radiation are critical.

At a glance

Key Properties

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

Band Gap

4.05–4.32 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

7
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for LuTaO4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P2/c (No. 13)monoclinic4.320.0000-9.7849.88
C2/c (No. 15)monoclinic4.050.0042-9.7809.97
P2/c (No. 13)
C2/c (No. 15)
P2/c (No. 13)Monoclinic9.22
P2/c (No. 13)Monoclinic9.87
P2/c (No. 13)Monoclinic9.44
Uses

Applications

Where Lutetium tantalate is used.

X-ray intensifying screensScintillation detectorsMedical diagnostic imagingPhosphor host materials
Reference

Frequently Asked Questions

Common questions about Lutetium tantalate, answered from cross-validated data.

What is LuTaO4?

Lutetium tantalate is a stable, insulating oxide widely utilized as a high-density phosphor host in X-ray imaging technology.

More questions
What is LuTaO4 used for?
Lutetium tantalate (LuTaO4) is used in x-ray intensifying screens, scintillation detectors, medical diagnostic imaging, and phosphor host materials.
What is the band gap of LuTaO4?
Lutetium tantalate (LuTaO4) has a DFT-computed band gap of 4.05–4.32 eV across 7 reported structures.
Is LuTaO4 a metal, semiconductor, or insulator?
With a wide band gap up to 4.32 eV it is an insulator / wide-band-gap material.
Is LuTaO4 thermodynamically stable?
Yes — Lutetium tantalate (LuTaO4) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of LuTaO4?
The lowest-energy reported polymorph of Lutetium tantalate (LuTaO4) is monoclinic symmetry, space group P2/c (No. 13).
What is the density of LuTaO4?
The computed density of the ground-state structure of Lutetium tantalate (LuTaO4) is 9.88 g/cm³.
How many polymorphs of LuTaO4 are known?
7 structures of LuTaO4 are reported across 3 databases, spanning 2 distinct space groups.
What elements does LuTaO4 contain?
Lutetium tantalate (LuTaO4) contains Lu, O, and Ta (3 elements).
Where does the data for LuTaO4 come from?
LuTaO4 data is cross-referenced from materials_project, jarvis, mpaloe.
Comparison

How It Compares

As a member of the rare-earth tantalate family, this compound is recognized for its superior density and stability compared to many other luminescent host materials. It serves as a benchmark for high-performance scintillators, offering a unique combination of structural reliability and optical efficiency that distinguishes it from less stable oxide alternatives.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).
  • mpaloe — Data from mpaloe.

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