Cu3W

Cu3W is a metallic copper-tungsten intermetallic compound that exists as a metastable phase.

CuW
Crystal structure of Cu3W (cubic, Fm-3m (No. 225))
Ground-state structure · Materials Project
Overview

About Cu3W

Cu3W is a metallic intermetallic compound composed of copper and tungsten. As a material lacking a band gap, it exhibits characteristic metallic electronic properties, making it a subject of interest for fundamental studies in transition metal alloy systems.

Despite its existence in multiple structural configurations across various databases, it is considered a metastable phase that sits above the thermodynamic hull. This suggests that while it can be synthesized under specific conditions, it remains a complex subject for experimental phase stabilization.

At a glance

Key Properties

Cross-validated computational properties for Cu3W, aggregated across 5 databases.

Band Gap

Metallic / not reported

Energy Above Hull

0.441 eV/atom
Best (lowest) across sources

Stability

Above hull
4 DFT sources

Structures

11
5 databases, 6 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Cu3W, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Fm-3m (No. 225)cubic0.000.4405-20.53712.01
P4/mmm (No. 123)
P-3m1 (No. 164)Trigonal6.91
P-3m1 (No. 164)Trigonal9.39
P3m1 (No. 156)Trigonal11.31
P3m1 (No. 156)Trigonal11.35
P-3m1 (No. 164)Trigonal8.55
Cm (No. 8)Monoclinic11.27
12.08
12.02
Pm-3m (No. 221)
Uses

Applications

Where Cu3W is used.

Fundamental materials researchAlloy phase stability studies
Reference

Frequently Asked Questions

Common questions about Cu3W, answered from cross-validated data.

What is Cu3W?

Cu3W is a metallic copper-tungsten intermetallic compound that exists as a metastable phase.

More questions
What is Cu3W used for?
Cu3W is used in fundamental materials research and alloy phase stability studies.
What is the band gap of Cu3W?
Cu3W is computed to be metallic (no band gap) in the reported DFT structures.
Is Cu3W a metal, semiconductor, or insulator?
Computed band structures report no gap, so it is metallic.
Is Cu3W thermodynamically stable?
Cu3W has a lowest energy above hull of 0.441 eV/atom (above hull).
What is the crystal structure of Cu3W?
The lowest-energy reported polymorph of Cu3W is cubic symmetry, space group Fm-3m (No. 225).
What is the density of Cu3W?
The computed density of the ground-state structure of Cu3W is 12.01 g/cm³.
How many polymorphs of Cu3W are known?
11 structures of Cu3W are reported across 5 databases, spanning 6 distinct space groups.
What elements does Cu3W contain?
Cu3W contains Cu and W (2 elements).
Where does the data for Cu3W come from?
Cu3W data is cross-referenced from materials_project, nomad, mpaloe, omat24, jarvis.
Comparison

How It Compares

As an unclassified intermetallic system, Cu3W represents a unique binary combination of copper and tungsten that does not belong to a broader, well-defined structural family, highlighting the diverse and often challenging nature of transition metal alloying.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • nomad — Data from NOMAD. Cite: Draxl & Scheffler, J. Phys. Mater. 2, 036001 (2019).
  • mpaloe — Data from mpaloe.
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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