Sc2

Sc2 is a thermodynamically stable metallic dimer composed entirely of scandium atoms.

Sc
Crystal structure of Sc2
Ground-state structure · Materials Project
Overview

About Sc2

Sc2 is a metallic scandium dimer that exists as a thermodynamically stable phase on the convex hull. Its electronic character is defined by its metallic nature, lacking a band gap, which makes it a subject of significant interest in fundamental condensed matter studies.

With hundreds of reported structures across major databases, this compound serves as a key reference point for understanding scandium-based bonding and cluster behavior. Its stability and structural diversity provide essential data for computational modeling and experimental validation in inorganic chemistry.

At a glance

Key Properties

Cross-validated computational properties for Sc2, aggregated across 4 databases.

Band Gap

Metallic / not reported

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
3 DFT sources

Structures

310
4 databases, 13 space groups
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting Sc2.

Sol Gel
Procedure available · ceder_sol_gel
Sol Gel
Procedure available · ceder_sol_gel
Sol Gel
Procedure available · ceder_sol_gel
Sol Gel
Procedure available · ceder_sol_gel
Sol Gel
Procedure available · ceder_sol_gel
Sol Gel
Procedure available · ceder_sol_gel
Uses

Applications

Where Sc2 is used.

Fundamental materials science researchComputational modeling of metallic clustersStudy of scandium bonding behavior
Reference

Frequently Asked Questions

Common questions about Sc2, answered from cross-validated data.

What is Sc2?

Sc2 is a thermodynamically stable metallic dimer composed entirely of scandium atoms.

More questions
What is Sc2 used for?
Sc2 is used in fundamental materials science research, computational modeling of metallic clusters, and study of scandium bonding behavior.
What is the band gap of Sc2?
Sc2 is computed to be metallic (no band gap) in the reported DFT structures.
Is Sc2 a metal, semiconductor, or insulator?
Computed band structures report no gap, so it is metallic.
Is Sc2 thermodynamically stable?
Yes — Sc2 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Sc2 are known?
310 structures of Sc2 are reported across 4 databases, spanning 13 distinct space groups.
How is Sc2 synthesized?
Literature-reported routes for Sc2 include sol gel (10 procedures documented).
What elements does Sc2 contain?
Sc2 contains Sc (1 element).
Where does the data for Sc2 come from?
Sc2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a fundamental metallic dimer, Sc2 represents a primary building block within scandium-based systems, serving as a baseline for understanding how these atoms interact in isolation versus within more complex crystalline lattices.

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

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