AgCa2Li

AgCa2Li is a semiconducting ternary intermetallic compound composed of silver, calcium, and lithium that exhibits metastable thermodynamic characteristics.

AgCaLi
Crystal structure of AgCa2Li
Ground-state structure · Materials Project
Overview

About AgCa2Li

AgCa2Li is a ternary intermetallic compound characterized by its semiconducting electronic nature. As a complex arrangement of silver, calcium, and lithium, it represents a unique intersection of metallic elements that deviate from typical metallic conductivity, suggesting specialized electronic behavior. The compound is currently identified as being above the thermodynamic hull, indicating that it is likely metastable under standard conditions. Its existence across multiple structural databases highlights its interest in materials science research despite its inherent instability.

At a glance

Key Properties

Cross-validated computational properties for AgCa2Li, aggregated across 3 databases.

Band Gap

0.65 eV
Range across DFT structures

Energy Above Hull

1.440 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

3
3 databases, 2 space groups
Reference

Frequently Asked Questions

Common questions about AgCa2Li, answered from cross-validated data.

What is AgCa2Li?

AgCa2Li is a semiconducting ternary intermetallic compound composed of silver, calcium, and lithium that exhibits metastable thermodynamic characteristics.

More questions
What is the band gap of AgCa2Li?
AgCa2Li has a DFT-computed band gap of 0.65 eV across 3 reported structures.
Is AgCa2Li a metal, semiconductor, or insulator?
With a band gap up to 0.65 eV it is a semiconductor.
Is AgCa2Li thermodynamically stable?
AgCa2Li has a lowest energy above hull of 1.440 eV/atom (above hull).
How many polymorphs of AgCa2Li are known?
3 structures of AgCa2Li are reported across 3 databases, spanning 2 distinct space groups.
What elements does AgCa2Li contain?
AgCa2Li contains Ag, Ca, and Li (3 elements).
Where does the data for AgCa2Li come from?
AgCa2Li data is cross-referenced from latticegraph.
Comparison

How It Compares

As a specialized ternary intermetallic, AgCa2Li occupies a niche position in materials chemistry where the interplay of its constituent elements creates a semiconducting profile that is distinct from more traditional, highly stable metallic alloys.

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

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