Li5ReO6

Li5ReO6 is a thermodynamically stable, semiconducting lithium oxide that is a subject of interest for its structural complexity.

Crystal structure of Li5ReO6
Ground-state structure · Materials Project
Overview

About Li5ReO6

Li5ReO6 is a thermodynamically stable member of the lithium oxide family that exhibits semiconducting electronic behavior. Its position on the convex hull underscores its structural integrity and potential for research in advanced materials science.

As a complex oxide, it serves as a subject of interest for understanding lithium-rich environments. The compound is characterized by significant structural diversity, with multiple reported configurations across various databases, highlighting its complexity in solid-state chemistry.

At a glance

Key Properties

Cross-validated computational properties for Li5ReO6, aggregated across 3 databases.

Band Gap

2.21 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
3 databases, 2 space groups
Uses

Applications

Where Li5ReO6 is used.

Solid-state researchMaterials science explorationLithium-based oxide studies
Reference

Frequently Asked Questions

Common questions about Li5ReO6, answered from cross-validated data.

What is Li5ReO6?

Li5ReO6 is a thermodynamically stable, semiconducting lithium oxide that is a subject of interest for its structural complexity.

More questions
What is Li5ReO6 used for?
Li5ReO6 is used in solid-state research, materials science exploration, and lithium-based oxide studies.
What is the band gap of Li5ReO6?
Li5ReO6 has a DFT-computed band gap of 2.21 eV across 6 reported structures.
Is Li5ReO6 a metal, semiconductor, or insulator?
With a band gap up to 2.21 eV it is a semiconductor.
Is Li5ReO6 thermodynamically stable?
Yes — Li5ReO6 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Li5ReO6 are known?
6 structures of Li5ReO6 are reported across 3 databases, spanning 2 distinct space groups.
What elements does Li5ReO6 contain?
Li5ReO6 contains Li, O, and Re (3 elements).
Where does the data for Li5ReO6 come from?
Li5ReO6 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the lithium oxides class.

Unlike the widely utilized cathode materials LiCoO2 and LiMn2O4, which are staples in battery technology, Li5ReO6 represents a more specialized structural arrangement within the lithium oxide class. While it shares the fundamental ionic nature of Li2O, its semiconducting character and unique stoichiometry distinguish it from the more common transition metal oxides like LiNiO2.

Explore

Related Compounds

Other Lithium Oxides in the database.

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

Analyze Li5ReO6 in the Lattice Graph platform

Polymorph comparison, confidence scoring, supply-chain risk, and patent monitoring — across 53 integrated data sources.

Explore the Platform →