Ag4Cl12Rb8

Ag4Cl12Rb8 is a thermodynamically stable semiconducting halide perovskite used in materials research for photovoltaic technologies.

Crystal structure of Ag4Cl12Rb8 (orthorhombic, Pnma (No. 62))
Ground-state structure · Materials Project
Overview

About Ag4Cl12Rb8

Ag4Cl12Rb8 is a complex halide perovskite characterized by its semiconducting electronic structure. As a thermodynamically stable phase residing on the convex hull, it represents a structurally robust candidate within the broader family of halide-based materials currently under investigation for optoelectronic applications. Its unique arrangement of silver, chlorine, and rubidium ions provides a distinct framework for studying charge carrier dynamics in crystalline solids. The material is primarily of interest to researchers developing sustainable and efficient thin-film photovoltaic devices. By leveraging its stable lattice configuration, scientists aim to overcome degradation challenges often associated with more volatile perovskite compositions, making it a valuable subject for fundamental materials science research.

At a glance

Key Properties

Cross-validated computational properties for Ag4Cl12Rb8, aggregated across 3 databases.

Band Gap

2.96 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
1 DFT source

Structures

3
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Ag4Cl12Rb8, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Pnma (No. 62)orthorhombic2.960.0000-3.4903.46
Pnma (No. 62)
No. 0unknown0.87
Uses

Applications

Where Ag4Cl12Rb8 is used.

Photovoltaic device researchOptoelectronic material developmentSemiconductor thin-film studies
Reference

Frequently Asked Questions

Common questions about Ag4Cl12Rb8, answered from cross-validated data.

What is Ag4Cl12Rb8?

Ag4Cl12Rb8 is a thermodynamically stable semiconducting halide perovskite used in materials research for photovoltaic technologies.

More questions
What is Ag4Cl12Rb8 used for?
Ag4Cl12Rb8 is used in photovoltaic device research, optoelectronic material development, and semiconductor thin-film studies.
What is the band gap of Ag4Cl12Rb8?
Ag4Cl12Rb8 has a DFT-computed band gap of 2.96 eV across 3 reported structures.
Is Ag4Cl12Rb8 a metal, semiconductor, or insulator?
With a band gap up to 2.96 eV it is a semiconductor.
Is Ag4Cl12Rb8 thermodynamically stable?
Yes — Ag4Cl12Rb8 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Ag4Cl12Rb8?
The lowest-energy reported polymorph of Ag4Cl12Rb8 is orthorhombic symmetry, space group Pnma (No. 62).
What is the density of Ag4Cl12Rb8?
The computed density of the ground-state structure of Ag4Cl12Rb8 is 3.46 g/cm³.
How many polymorphs of Ag4Cl12Rb8 are known?
3 structures of Ag4Cl12Rb8 are reported across 3 databases, spanning 2 distinct space groups.
What elements does Ag4Cl12Rb8 contain?
Ag4Cl12Rb8 contains Ag, Cl, and Rb (3 elements).
Where does the data for Ag4Cl12Rb8 come from?
Ag4Cl12Rb8 data is cross-referenced from materials_project, aflow, cod.
Comparison

How It Compares

Within the halide perovskite photovoltaics class.

Within the diverse class of halide perovskites, Ag4Cl12Rb8 stands out for its thermodynamic stability compared to more conventional lead-based counterparts like CsPbBr3 or CsSnI3. While many high-performing perovskites in this category rely on heavy metals to achieve optimal band structures, this silver-rubidium-chloride system offers a distinct chemical pathway that avoids toxic components while maintaining a stable structural profile.

Explore

Related Compounds

Other Halide Perovskite Photovoltaics in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).
  • cod — Data from the Crystallography Open Database. Cite: Grazulis et al., Nucleic Acids Res. 40, D420 (2012).

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