RhSe

RhSe is a metallic rhodium-selenium alloy catalyst that is frequently studied for its structural complexity and potential applications in chemical catalysis.

Crystal structure of RhSe
Ground-state structure · Materials Project
Overview

About RhSe

RhSe is a metallic compound belonging to the class of platinum-group alloy catalysts. Its electronic structure indicates a lack of a band gap, characteristic of its metallic nature, which is a critical feature for materials intended for charge transfer or catalytic surface reactions. Despite its status as a metallic conductor, the compound is identified as being above the thermodynamic hull, suggesting it is a metastable phase that requires specific synthesis conditions to stabilize. The significant number of reported structures across multiple databases highlights its importance as a subject of ongoing structural and catalytic investigation. Its utility is primarily focused on its potential as a catalyst, where the synergy between rhodium and selenium can be leveraged for specific chemical transformations. The compound serves as a model for understanding how transition metal-chalcogenide interactions influence the performance of platinum-group alloys in demanding environments.

At a glance

Key Properties

Cross-validated computational properties for RhSe, aggregated across 4 databases.

Band Gap

Metallic / not reported

Energy Above Hull

0.113 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

172
4 databases, 30 space groups
Validation

Cross-Source DFT Agreement

How well independent DFT databases agree on the thermodynamics of RhSe. Tight agreement means computed properties can be trusted without re-running calculations.

Agreement Score

1.00 / 1.00
Trust tier: medium

Hull Spread

0.000 eV
EAH spread across sources

Sources Compared

2
jarvis, materials_project

Space Group Consensus

All match
Uses

Applications

Where RhSe is used.

Catalytic researchMaterials science studiesSurface chemistry investigations
Reference

Frequently Asked Questions

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

What is RhSe?

RhSe is a metallic rhodium-selenium alloy catalyst that is frequently studied for its structural complexity and potential applications in chemical catalysis.

More questions
What is RhSe used for?
RhSe is used in catalytic research, materials science studies, and surface chemistry investigations.
What is the band gap of RhSe?
RhSe is computed to be metallic (no band gap) in the reported DFT structures.
Is RhSe a metal, semiconductor, or insulator?
Computed band structures report no gap, so it is metallic.
Is RhSe thermodynamically stable?
RhSe has a lowest energy above hull of 0.113 eV/atom (above hull).
How many polymorphs of RhSe are known?
172 structures of RhSe are reported across 4 databases, spanning 30 distinct space groups.
What elements does RhSe contain?
RhSe contains Rh and Se (2 elements).
Where does the data for RhSe come from?
RhSe data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the platinum-group alloy catalysts class.

Within the diverse group of platinum-group alloy catalysts, RhSe occupies a distinct position compared to more stable or common phases like LaRh or IrSe2. While some siblings in this class exhibit higher thermodynamic stability, RhSe is notable for its high structural diversity, with numerous reported configurations that distinguish it from simpler binary intermetallics like BaPd or Ga2Ru.

Explore

Related Compounds

Other Platinum-Group Alloy Catalysts in the database.

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

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