Bi2LiPd

This compound is a ternary intermetallic material composed of bismuth, lithium, and palladium. It is primarily studied in the field of condensed matter physics for its unique electronic properties and potential as a topological material.

Crystal structure of Bi2LiPd (orthorhombic, Immm (No. 71))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Bi2LiPd, aggregated across 3 databases.

Band Gap

0.24 eV
Range across DFT structures

Energy Above Hull

1.530 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

5
3 databases, 3 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Bi2LiPd, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Immm (No. 71)orthorhombic0.241.5298-34.4170.88
Fm-3m (No. 225)
9.31
9.31
F-43m (No. 216)
Uses

Applications

Where Bi2LiPd is used.

Materials science researchSolid-state physics studies
Reference

Frequently Asked Questions

Common questions about Bi2LiPd, answered from cross-validated data.

What is Bi2LiPd?

This compound is a ternary intermetallic material composed of bismuth, lithium, and palladium. It is primarily studied in the field of condensed matter physics for its unique electronic properties and potential as a topological material.

More questions
What is Bi2LiPd used for?
Bi2LiPd is used in materials science research and solid-state physics studies.
What is the band gap of Bi2LiPd?
Bi2LiPd has a DFT-computed band gap of 0.24 eV across 5 reported structures.
Is Bi2LiPd a metal, semiconductor, or insulator?
With a band gap up to 0.24 eV it is a semiconductor.
Is Bi2LiPd thermodynamically stable?
Bi2LiPd has a lowest energy above hull of 1.530 eV/atom (above hull).
What is the crystal structure of Bi2LiPd?
The lowest-energy reported polymorph of Bi2LiPd is orthorhombic symmetry, space group Immm (No. 71).
What is the density of Bi2LiPd?
The computed density of the ground-state structure of Bi2LiPd is 0.88 g/cm³.
How many polymorphs of Bi2LiPd are known?
5 structures of Bi2LiPd are reported across 3 databases, spanning 3 distinct space groups.
What elements does Bi2LiPd contain?
Bi2LiPd contains Bi, Li, and Pd (3 elements).
Where does the data for Bi2LiPd come from?
Bi2LiPd data is cross-referenced from materials_project, nomad, omat24.
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Related Compounds

Other Platinum-Group Alloy Catalysts in the database.

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).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).

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