FeRe3

This intermetallic compound consists of iron and rhenium atoms arranged in a specific crystalline structure. It is primarily studied by researchers in materials science to understand the fundamental magnetic and structural properties of transition metal alloys.

FeRe
Crystal structure of FeRe3 (hexagonal, P63/mmc (No. 194))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for FeRe3, aggregated across 5 databases.

Band Gap

Metallic / not reported

Energy Above Hull

0.014 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
4 DFT sources

Structures

46
5 databases, 14 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for FeRe3, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P63/mmc (No. 194)hexagonal0.000.0144-11.44518.32
Pm (No. 6)Monoclinic14.41
Cmcm (No. 63)Orthorhombic14.68
P21/m (No. 11)Monoclinic19.77
Amm2 (No. 38)Orthorhombic19.92
Cmcm (No. 63)Orthorhombic18.21
18.02
Amm2 (No. 38)Orthorhombic14.52
Cmmm (No. 65)Orthorhombic9.63
Amm2 (No. 38)Orthorhombic16.65
P63/mmc (No. 194)Hexagonal18.18
P63/mmc (No. 194)Hexagonal18.39
Uses

Applications

Where FeRe3 is used.

Materials science researchFundamental physics studies
Reference

Frequently Asked Questions

Common questions about FeRe3, answered from cross-validated data.

What is FeRe3?

This intermetallic compound consists of iron and rhenium atoms arranged in a specific crystalline structure. It is primarily studied by researchers in materials science to understand the fundamental magnetic and structural properties of transition metal alloys.

More questions
What is FeRe3 used for?
FeRe3 is used in materials science research and fundamental physics studies.
What is the band gap of FeRe3?
FeRe3 is computed to be metallic (no band gap) in the reported DFT structures.
Is FeRe3 a metal, semiconductor, or insulator?
Computed band structures report no gap, so it is metallic.
Is FeRe3 thermodynamically stable?
FeRe3 has a lowest energy above hull of 0.014 eV/atom (near hull (likely stable)).
What is the crystal structure of FeRe3?
The lowest-energy reported polymorph of FeRe3 is hexagonal symmetry, space group P63/mmc (No. 194).
What is the density of FeRe3?
The computed density of the ground-state structure of FeRe3 is 18.32 g/cm³.
How many polymorphs of FeRe3 are known?
46 structures of FeRe3 are reported across 5 databases, spanning 14 distinct space groups.
What elements does FeRe3 contain?
FeRe3 contains Fe and Re (2 elements).
Where does the data for FeRe3 come from?
FeRe3 data is cross-referenced from materials_project, mpaloe, omat24, nomad.
Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
  • nomad — Data from NOMAD. Cite: Draxl & Scheffler, J. Phys. Mater. 2, 036001 (2019).

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