RbSbS2

RbSbS2 is a thermodynamically stable semiconducting ternary sulfide used in materials science research.

RbSSb
Crystal structure of RbSbS2 (triclinic, P-1 (No. 2))
Ground-state structure · Materials Project
Overview

About RbSbS2

RbSbS2 is a ternary chalcogenide that exists as a thermodynamically stable phase, sitting directly on the convex hull. Its electronic character as a semiconductor makes it an intriguing candidate for optoelectronic and energy-related applications where stable, well-defined material properties are essential. The compound has been characterized through multiple structural studies, highlighting its reliability for further experimental investigation. As a member of the alkali metal-antimony-sulfur family, it represents a stable building block for complex inorganic synthesis. Its structural diversity, evidenced by multiple reported configurations, suggests a versatile framework for tuning physical characteristics in solid-state devices.

At a glance

Key Properties

Cross-validated computational properties for RbSbS2, aggregated across 3 databases.

Band Gap

1.95 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

6
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for RbSbS2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P-1 (No. 2)triclinic1.950.0000-4.3113.69
P-1 (No. 2)
P-1 (No. 2)Triclinic3.63
P-1 (No. 2)
P-1 (No. 2)Triclinic3.50
P-1 (No. 2)Triclinic3.58
Uses

Applications

Where RbSbS2 is used.

Semiconductor researchSolid-state chemistryOptoelectronic material development
Reference

Frequently Asked Questions

Common questions about RbSbS2, answered from cross-validated data.

What is RbSbS2?

RbSbS2 is a thermodynamically stable semiconducting ternary sulfide used in materials science research.

More questions
What is RbSbS2 used for?
RbSbS2 is used in semiconductor research, solid-state chemistry, and optoelectronic material development.
What is the band gap of RbSbS2?
RbSbS2 has a DFT-computed band gap of 1.95 eV across 6 reported structures.
Is RbSbS2 a metal, semiconductor, or insulator?
With a band gap up to 1.95 eV it is a semiconductor.
Is RbSbS2 thermodynamically stable?
Yes — RbSbS2 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of RbSbS2?
The lowest-energy reported polymorph of RbSbS2 is triclinic symmetry, space group P-1 (No. 2).
What is the density of RbSbS2?
The computed density of the ground-state structure of RbSbS2 is 3.69 g/cm³.
How many polymorphs of RbSbS2 are known?
6 structures of RbSbS2 are reported across 3 databases, spanning 1 distinct space group.
What elements does RbSbS2 contain?
RbSbS2 contains Rb, S, and Sb (3 elements).
Where does the data for RbSbS2 come from?
RbSbS2 data is cross-referenced from materials_project, jarvis, mpaloe.
Comparison

How It Compares

As a stable ternary chalcogenide, RbSbS2 serves as a foundational example of how alkali metal incorporation can stabilize antimony-sulfur frameworks. Unlike more volatile or metastable variants in similar chemical families, its position on the convex hull ensures robust structural integrity, making it a reliable reference point for researchers exploring the broader landscape of semiconducting ternary sulfides.

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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