NbTiW2

NbTiW2 is a semimetallic ternary alloy composed of niobium, titanium, and tungsten that exists in a metastable state.

NbTiW
Crystal structure of NbTiW2
Ground-state structure · Materials Project
Overview

About NbTiW2

NbTiW2 is a ternary metallic compound composed of niobium, titanium, and tungsten. Characterized by a near-zero band gap, this material exhibits semimetallic electronic behavior that is of significant interest for fundamental condensed matter research. Its structural complexity is reflected in the multiple distinct configurations reported across various materials databases. As a metastable phase residing above the thermodynamic hull, NbTiW2 represents a challenging target for synthesis and stabilization. Its unique elemental combination makes it a subject of interest for exploring high-entropy or refractory alloy systems where structural stability and electronic properties are delicately balanced.

At a glance

Key Properties

Cross-validated computational properties for NbTiW2, aggregated across 3 databases.

Band Gap

0.08 eV
Range across DFT structures

Energy Above Hull

4.794 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

4
3 databases, 2 space groups
Uses

Applications

Where NbTiW2 is used.

Fundamental condensed matter researchRefractory alloy development studies
Reference

Frequently Asked Questions

Common questions about NbTiW2, answered from cross-validated data.

What is NbTiW2?

NbTiW2 is a semimetallic ternary alloy composed of niobium, titanium, and tungsten that exists in a metastable state.

More questions
What is NbTiW2 used for?
NbTiW2 is used in fundamental condensed matter research and refractory alloy development studies.
What is the band gap of NbTiW2?
NbTiW2 has a DFT-computed band gap of 0.08 eV across 4 reported structures.
Is NbTiW2 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is NbTiW2 thermodynamically stable?
NbTiW2 has a lowest energy above hull of 4.794 eV/atom (above hull).
How many polymorphs of NbTiW2 are known?
4 structures of NbTiW2 are reported across 3 databases, spanning 2 distinct space groups.
What elements does NbTiW2 contain?
NbTiW2 contains Nb, Ti, and W (3 elements).
Where does the data for NbTiW2 come from?
NbTiW2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a ternary system containing refractory elements, NbTiW2 occupies a specialized niche in materials science where its semimetallic nature distinguishes it from more common insulating or purely metallic alloys. Without direct structural siblings in its immediate class, it serves as a critical case study for understanding how the integration of niobium, titanium, and tungsten influences phase stability and electronic density of states in complex metallic systems.

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

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