CrCuSe2

CrCuSe2 is a metastable, semimetallic ternary chalcogenide containing chromium, copper, and selenium.

CrCuSe
Crystal structure of CrCuSe2
Ground-state structure · Materials Project
Overview

About CrCuSe2

CrCuSe2 is a complex ternary chalcogenide composed of chromium, copper, and selenium. As a near-zero-gap material, it exhibits semimetallic electronic character that makes it a subject of significant interest for fundamental research into tunable electronic states.

Despite its metastable nature, the compound has been identified across multiple structural databases, reflecting its role as a notable subject for experimental and computational exploration. Its specific arrangement of transition metals and chalcogens provides a distinct platform for investigating charge transport behaviors.

At a glance

Key Properties

Cross-validated computational properties for CrCuSe2, aggregated across 4 databases.

Band Gap

0.08 eV
Range across DFT structures

Energy Above Hull

0.055 eV/atom
Best (lowest) across sources

Stability

Metastable
3 DFT sources

Structures

7
4 databases, 2 space groups
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting CrCuSe2.

Solid State
Procedure available · ceder_solid_state
Uses

Applications

Where CrCuSe2 is used.

Fundamental condensed matter researchElectronic property investigationMaterials science studies
Reference

Frequently Asked Questions

Common questions about CrCuSe2, answered from cross-validated data.

What is CrCuSe2?

CrCuSe2 is a metastable, semimetallic ternary chalcogenide containing chromium, copper, and selenium.

More questions
What is CrCuSe2 used for?
CrCuSe2 is used in fundamental condensed matter research, electronic property investigation, and materials science studies.
What is the band gap of CrCuSe2?
CrCuSe2 has a DFT-computed band gap of 0.08 eV across 7 reported structures.
Is CrCuSe2 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is CrCuSe2 thermodynamically stable?
CrCuSe2 has a lowest energy above hull of 0.055 eV/atom (metastable).
How many polymorphs of CrCuSe2 are known?
7 structures of CrCuSe2 are reported across 4 databases, spanning 2 distinct space groups.
How is CrCuSe2 synthesized?
Literature-reported routes for CrCuSe2 include solid state.
What elements does CrCuSe2 contain?
CrCuSe2 contains Cr, Cu, and Se (3 elements).
Where does the data for CrCuSe2 come from?
CrCuSe2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a ternary chalcogenide, CrCuSe2 serves as a specialized example of complex metal-selenium systems. Without direct structural siblings in this context, it stands as a representative of metastable, semimetallic phases that challenge conventional stability paradigms in inorganic chemistry.

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

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