Rb3SbS3

Rb3SbS3 is a stable, semiconducting ternary sulfide compound composed of rubidium, antimony, and sulfur.

RbSSb
Crystal structure of Rb3SbS3 (cubic, P213 (No. 198))
Ground-state structure · Materials Project
Overview

About Rb3SbS3

Rb3SbS3 is a ternary chalcogenide that exhibits semiconducting electronic properties. As a thermodynamically stable phase located on the convex hull, it represents a robust structural arrangement of rubidium, antimony, and sulfur atoms.

This compound is of significant interest in materials science due to its well-defined composition and stability. Its electronic character makes it a candidate for investigation in various solid-state applications where semiconducting behavior is required.

At a glance

Key Properties

Cross-validated computational properties for Rb3SbS3, aggregated across 3 databases.

Band Gap

2.42 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 Rb3SbS3, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P213 (No. 198)cubic2.420.0000-3.9643.25
P213 (No. 198)Cubic3.14
P213 (No. 198)Cubic3.22
P213 (No. 198)Cubic3.20
P213 (No. 198)
Reference

Frequently Asked Questions

Common questions about Rb3SbS3, answered from cross-validated data.

What is Rb3SbS3?

Rb3SbS3 is a stable, semiconducting ternary sulfide compound composed of rubidium, antimony, and sulfur.

More questions
What is the band gap of Rb3SbS3?
Rb3SbS3 has a DFT-computed band gap of 2.42 eV across 5 reported structures.
Is Rb3SbS3 a metal, semiconductor, or insulator?
With a band gap up to 2.42 eV it is a semiconductor.
Is Rb3SbS3 thermodynamically stable?
Yes — Rb3SbS3 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Rb3SbS3?
The lowest-energy reported polymorph of Rb3SbS3 is cubic symmetry, space group P213 (No. 198).
What is the density of Rb3SbS3?
The computed density of the ground-state structure of Rb3SbS3 is 3.25 g/cm³.
How many polymorphs of Rb3SbS3 are known?
5 structures of Rb3SbS3 are reported across 3 databases, spanning 1 distinct space group.
What elements does Rb3SbS3 contain?
Rb3SbS3 contains Rb, S, and Sb (3 elements).
Where does the data for Rb3SbS3 come from?
Rb3SbS3 data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

As a stable ternary chalcogenide, Rb3SbS3 occupies a distinct position in the landscape of complex sulfides, serving as a reliable reference point for structural and electronic studies within this chemical family.

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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