RbAs

RbAs is a stable, semiconducting binary compound composed of rubidium and arsenic.

AsRb
Crystal structure of RbAs (orthorhombic, P212121 (No. 19))
Ground-state structure · Materials Project
Overview

About RbAs

RbAs is a binary arsenide characterized by its semiconducting electronic nature. As a thermodynamically stable phase located on the convex hull, it represents a robust structural arrangement of rubidium and arsenic atoms that maintains integrity under standard conditions. The compound has garnered significant research interest, evidenced by its presence in multiple structural databases across numerous reported configurations. Its stability and electronic properties make it a subject of fundamental study for understanding alkali metal pnictide behavior. By providing a stable platform for investigating charge transport in binary systems, RbAs serves as a valuable reference point for researchers exploring the broader landscape of semiconducting pnictides.

At a glance

Key Properties

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

Band Gap

0.59 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

33
3 databases, 13 space groups
Crystallography

Reported Structures

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

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P212121 (No. 19)orthorhombic0.590.0000-3.2433.80
P-1 (No. 2)Triclinic3.94
C2/m (No. 12)Monoclinic3.12
P212121 (No. 19)Orthorhombic3.75
P-1 (No. 2)Triclinic2.69
P212121 (No. 19)Orthorhombic3.64
P212121 (No. 19)Orthorhombic3.74
P212121 (No. 19)
P21 (No. 4)Monoclinic2.33
P21 (No. 4)Monoclinic2.19
Pmmm (No. 47)Orthorhombic2.15
Pmmm (No. 47)Orthorhombic2.46
Uses

Applications

Where RbAs is used.

Fundamental materials researchSemiconductor physics studiesSolid-state chemistry investigations
Reference

Frequently Asked Questions

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

What is RbAs?

RbAs is a stable, semiconducting binary compound composed of rubidium and arsenic.

More questions
What is RbAs used for?
RbAs is used in fundamental materials research, semiconductor physics studies, and solid-state chemistry investigations.
What is the band gap of RbAs?
RbAs has a DFT-computed band gap of 0.59 eV across 33 reported structures.
Is RbAs a metal, semiconductor, or insulator?
With a band gap up to 0.59 eV it is a semiconductor.
Is RbAs thermodynamically stable?
Yes — RbAs sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of RbAs?
The lowest-energy reported polymorph of RbAs is orthorhombic symmetry, space group P212121 (No. 19).
What is the density of RbAs?
The computed density of the ground-state structure of RbAs is 3.80 g/cm³.
How many polymorphs of RbAs are known?
33 structures of RbAs are reported across 3 databases, spanning 13 distinct space groups.
What elements does RbAs contain?
RbAs contains As and Rb (2 elements).
Where does the data for RbAs come from?
RbAs data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

As a thermodynamically stable binary compound, RbAs occupies a distinct position in the landscape of alkali metal arsenides, serving as a primary example of stable stoichiometry within this chemical class.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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