Te8Mo3W

Te8Mo3W is a semiconducting ternary telluride compound that is considered a likely candidate for laboratory synthesis due to its favorable thermodynamic stability.

MoTeW
Crystal structure of Te8Mo3W (trigonal, P3m1 (No. 156))
Ground-state structure · Materials Project
Overview

About Te8Mo3W

Te8Mo3W is a complex ternary telluride characterized by its semiconducting electronic structure. Its position near the thermodynamic stability hull suggests it is a viable target for experimental synthesis and structural characterization. The material represents a unique intersection of transition metal chemistry and chalcogenide frameworks, offering potential for tunable electronic properties in thin-film or bulk configurations. Given its presence across multiple structural databases, it serves as a significant subject for researchers exploring novel ternary systems. Its structural complexity provides a rich landscape for investigating how the substitution of tungsten into a molybdenum-telluride matrix influences overall lattice stability and charge transport behavior.

At a glance

Key Properties

Cross-validated computational properties for Te8Mo3W, aggregated across 3 databases.

Band Gap

0.55 eV
Range across DFT structures

Energy Above Hull

0.006 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

10
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Te8Mo3W, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P3m1 (No. 156)trigonal0.530.0062-27.9975.64
P3m1 (No. 156)trigonal0.550.0064-27.9975.63
P3m1 (No. 156)
P3m1 (No. 156)
P3m1 (No. 156)Trigonal5.63
P3m1 (No. 156)Trigonal5.70
P3m1 (No. 156)Trigonal5.79
P3m1 (No. 156)Trigonal5.64
P3m1 (No. 156)Trigonal5.81
P3m1 (No. 156)Trigonal5.70
Uses

Applications

Where Te8Mo3W is used.

Semiconductor researchMaterials science explorationSolid-state chemistry
Reference

Frequently Asked Questions

Common questions about Te8Mo3W, answered from cross-validated data.

What is Te8Mo3W?

Te8Mo3W is a semiconducting ternary telluride compound that is considered a likely candidate for laboratory synthesis due to its favorable thermodynamic stability.

More questions
What is Te8Mo3W used for?
Te8Mo3W is used in semiconductor research, materials science exploration, and solid-state chemistry.
What is the band gap of Te8Mo3W?
Te8Mo3W has a DFT-computed band gap of 0.55 eV across 10 reported structures.
Is Te8Mo3W a metal, semiconductor, or insulator?
With a band gap up to 0.55 eV it is a semiconductor.
Is Te8Mo3W thermodynamically stable?
Te8Mo3W has a lowest energy above hull of 0.006 eV/atom (near hull (likely stable)).
What is the crystal structure of Te8Mo3W?
The lowest-energy reported polymorph of Te8Mo3W is trigonal symmetry, space group P3m1 (No. 156).
What is the density of Te8Mo3W?
The computed density of the ground-state structure of Te8Mo3W is 5.64 g/cm³.
How many polymorphs of Te8Mo3W are known?
10 structures of Te8Mo3W are reported across 3 databases, spanning 1 distinct space group.
What elements does Te8Mo3W contain?
Te8Mo3W contains Mo, Te, and W (3 elements).
Where does the data for Te8Mo3W come from?
Te8Mo3W data is cross-referenced from materials_project, jarvis, mpaloe.
Comparison

How It Compares

As a ternary telluride, Te8Mo3W occupies a distinct niche in the landscape of transition metal chalcogenides. While many binary tellurides are well-characterized, this compound exemplifies the emerging class of complex, multi-metal systems that bridge the gap between simple semiconductors and more intricate topological materials.

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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