Li4Na4Te4

This compound is a complex quaternary telluride containing lithium, sodium, and tellurium. It is primarily studied in academic research settings to understand the structural properties and ionic conductivity of alkali metal telluride systems.

LiNaTe
Crystal structure of Li4Na4Te4 (orthorhombic, Pnma (No. 62))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Li4Na4Te4, aggregated across 3 databases.

Band Gap

2.15–2.28 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
Crystallography

Reported Structures

Lowest-energy structures reported for Li4Na4Te4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Pnma (No. 62)orthorhombic2.280.0000-3.2613.58
F-43m (No. 216)cubic2.150.3299-2.9313.14
2.99
Pnma (No. 62)
2.85
Pnma (No. 62)
Uses

Applications

Where Li4Na4Te4 is used.

Solid-state ionics researchMaterials science characterizationFundamental crystallographic studies
Reference

Frequently Asked Questions

Common questions about Li4Na4Te4, answered from cross-validated data.

What is Li4Na4Te4?

This compound is a complex quaternary telluride containing lithium, sodium, and tellurium. It is primarily studied in academic research settings to understand the structural properties and ionic conductivity of alkali metal telluride systems.

More questions
What is Li4Na4Te4 used for?
Li4Na4Te4 is used in solid-state ionics research, materials science characterization, and fundamental crystallographic studies.
What is the band gap of Li4Na4Te4?
Li4Na4Te4 has a DFT-computed band gap of 2.15–2.28 eV across 6 reported structures.
Is Li4Na4Te4 a metal, semiconductor, or insulator?
With a band gap up to 2.28 eV it is a semiconductor.
Is Li4Na4Te4 thermodynamically stable?
Yes — Li4Na4Te4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Li4Na4Te4?
The lowest-energy reported polymorph of Li4Na4Te4 is orthorhombic symmetry, space group Pnma (No. 62).
What is the density of Li4Na4Te4?
The computed density of the ground-state structure of Li4Na4Te4 is 3.58 g/cm³.
How many polymorphs of Li4Na4Te4 are known?
6 structures of Li4Na4Te4 are reported across 3 databases, spanning 2 distinct space groups.
What elements does Li4Na4Te4 contain?
Li4Na4Te4 contains Li, Na, and Te (3 elements).
Where does the data for Li4Na4Te4 come from?
Li4Na4Te4 data is cross-referenced from materials_project, omat24, aflow.
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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