Ag2ScY

This compound is a ternary intermetallic material composed of silver, scandium, and yttrium. It is primarily studied in materials science research for its structural properties and potential behavior in complex metallic systems.

AgScY
Crystal structure of Ag2ScY (orthorhombic, Immm (No. 71))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Ag2ScY, aggregated across 3 databases.

Band Gap

0.08 eV
Range across DFT structures

Energy Above Hull

2.355 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

8
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Ag2ScY, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Immm (No. 71)orthorhombic0.082.3551-16.5460.50
6.55
6.55
6.51
6.51
6.51
Uses

Applications

Where Ag2ScY is used.

Materials science researchSolid-state chemistry studies
Reference

Frequently Asked Questions

Common questions about Ag2ScY, answered from cross-validated data.

What is Ag2ScY?

This compound is a ternary intermetallic material composed of silver, scandium, and yttrium. It is primarily studied in materials science research for its structural properties and potential behavior in complex metallic systems.

More questions
What is Ag2ScY used for?
Ag2ScY is used in materials science research and solid-state chemistry studies.
What is the band gap of Ag2ScY?
Ag2ScY has a DFT-computed band gap of 0.08 eV across 8 reported structures.
Is Ag2ScY a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is Ag2ScY thermodynamically stable?
Ag2ScY has a lowest energy above hull of 2.355 eV/atom (above hull).
What is the crystal structure of Ag2ScY?
The lowest-energy reported polymorph of Ag2ScY is orthorhombic symmetry, space group Immm (No. 71).
What is the density of Ag2ScY?
The computed density of the ground-state structure of Ag2ScY is 0.50 g/cm³.
How many polymorphs of Ag2ScY are known?
8 structures of Ag2ScY are reported across 3 databases, spanning 1 distinct space group.
What elements does Ag2ScY contain?
Ag2ScY contains Ag, Sc, and Y (3 elements).
Where does the data for Ag2ScY come from?
Ag2ScY data is cross-referenced from materials_project, omat24, alexandria.
Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
  • alexandria — Data from alexandria.

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