RbRuF6

RbRuF6 is a thermodynamically stable, semiconducting ruthenium-based fluoride used in advanced materials research.

Crystal structure of RbRuF6 (trigonal, R-3m (No. 166))
Ground-state structure · Materials Project
Overview

About RbRuF6

RbRuF6 is a distinct semiconducting compound that occupies a stable position on the convex hull, indicating significant thermodynamic robustness. As a member of the broader platinum-group alloy catalyst class, it leverages the unique electronic properties of ruthenium to facilitate specialized chemical transformations. Its structural reliability is evidenced by consistent reporting across multiple material databases. The compound serves as a critical subject for researchers investigating the intersection of noble metal chemistry and halide frameworks. By maintaining structural stability, it provides a reliable platform for studying electronic behavior in complex inorganic lattices, which is essential for advancing high-performance catalytic materials.

At a glance

Key Properties

Cross-validated computational properties for RbRuF6, aggregated across 3 databases.

Band Gap

1.18 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

5
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for RbRuF6, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
R-3m (No. 166)trigonal1.180.0000-5.1703.88
R-3m (No. 166)
R-3m (No. 166)Trigonal3.63
R-3m (No. 166)Trigonal3.53
R-3m (No. 166)Trigonal3.78
Uses

Applications

Where RbRuF6 is used.

Catalysis researchSolid-state electronic material developmentInorganic structural analysis
Reference

Frequently Asked Questions

Common questions about RbRuF6, answered from cross-validated data.

What is RbRuF6?

RbRuF6 is a thermodynamically stable, semiconducting ruthenium-based fluoride used in advanced materials research.

More questions
What is RbRuF6 used for?
RbRuF6 is used in catalysis research, solid-state electronic material development, and inorganic structural analysis.
What is the band gap of RbRuF6?
RbRuF6 has a DFT-computed band gap of 1.18 eV across 5 reported structures.
Is RbRuF6 a metal, semiconductor, or insulator?
With a band gap up to 1.18 eV it is a semiconductor.
Is RbRuF6 thermodynamically stable?
Yes — RbRuF6 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of RbRuF6?
The lowest-energy reported polymorph of RbRuF6 is trigonal symmetry, space group R-3m (No. 166).
What is the density of RbRuF6?
The computed density of the ground-state structure of RbRuF6 is 3.88 g/cm³.
How many polymorphs of RbRuF6 are known?
5 structures of RbRuF6 are reported across 3 databases, spanning 1 distinct space group.
What elements does RbRuF6 contain?
RbRuF6 contains F, Rb, and Ru (3 elements).
Where does the data for RbRuF6 come from?
RbRuF6 data is cross-referenced from materials_project, jarvis, mpaloe.
Comparison

How It Compares

Within the platinum-group alloy catalysts class.

Unlike many metallic or intermetallic members of the platinum-group alloy class such as GeRu or Ga2Ru, RbRuF6 is characterized by its semiconducting electronic nature and fluoride-based composition. While siblings like As2Pt or BaPd often exhibit typical metallic conduction, this compound represents a more specialized niche within the class, focusing on the stability afforded by its specific anionic framework.

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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).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).
  • mpaloe — Data from mpaloe.

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