RbPb

RbPb is a stable semiconducting compound formed by the combination of rubidium and lead.

PbRb
Crystal structure of RbPb (tetragonal, I41/acd (No. 142))
Ground-state structure · Materials Project
Overview

About RbPb

RbPb is a binary intermetallic compound formed from rubidium and lead. As a thermodynamically stable phase residing on the convex hull, it maintains structural integrity under standard conditions.

This material exhibits semiconducting electronic properties, making it a subject of interest for fundamental solid-state research. With numerous documented structural variations across databases, it serves as a key reference point for understanding alkali-metal plumbide behavior.

At a glance

Key Properties

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

Band Gap

0.60 eV
Range across DFT structures · ground state: narrow gap

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

Stable
3 DFT sources

Structures

26
3 databases, 8 space groups
Validation

Cross-Source DFT Agreement

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

Agreement Score

0.70 / 1.00
Trust tier: medium

Hull Spread

0.075 eV
EAH spread across sources

Sources Compared

3
jarvis, materials_project, oqmd

Space Group Consensus

Mixed (most: I41/acd (No. 142))
Crystallography

Reported Structures

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

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
——0.600.0000-0.227—
I41/acd (No. 142)tetragonal0.410.0000-2.5645.48
P-6m2 (No. 187)hexagonal0.000.07530.003—
——0.000.33400.107—
——0.000.33900.112—
——0.000.34770.121—
——0.000.45040.224—
——0.000.70550.479—
——0.001.01760.791—
P21/m (No. 11)monoclinic———6.45
P1 (No. 1)triclinic———4.85
Cm (No. 8)monoclinic———5.00
Uses

Applications

Where RbPb is used.

Solid-state researchFundamental materials science
Reference

Frequently Asked Questions

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

What is RbPb?

RbPb is a stable semiconducting compound formed by the combination of rubidium and lead.

More questions
What is RbPb used for?
RbPb is used in solid-state research and fundamental materials science.
What is the band gap of RbPb?
RbPb has a DFT-computed band gap of 0.60 eV across 26 reported structures. Standard DFT underestimates band gaps, so the measured gap is typically larger.
Is RbPb a metal, semiconductor, or insulator?
DFT predicts a band gap of up to 0.60 eV (a semiconductor). Measured gaps are typically larger.
Is RbPb thermodynamically stable?
Yes — RbPb sits on the convex hull (energy above hull 0 eV/atom), i.e. stable.
What is the crystal structure of RbPb?
The reference structure of RbPb is tetragonal symmetry, space group I41/acd (No. 142).
What is the density of RbPb?
The computed density of the ground-state structure of RbPb is 5.48 g/cm³.
How many polymorphs of RbPb are known?
26 structures of RbPb are reported across 3 databases, spanning 8 distinct space groups.
What elements does RbPb contain?
RbPb contains Pb and Rb (2 elements).
Where does the data for RbPb come from?
RbPb data is cross-referenced from oqmd, materials_project, jarvis, mpaloe, cod.
Comparison

How It Compares

As a stable binary phase, RbPb represents a well-defined structural arrangement within the broader field of alkali-metal plumbides, serving as a primary example of how these elements combine to form consistent, predictable semiconducting architectures.

Data sources & attribution
  • oqmd — Data from the OQMD (oqmd.org). Cite: Saal et al., JOM 65, 1501 (2013); Kirklin et al., npj Comp. Mater. 1, 15010 (2015). (CC-BY-4.0)
  • materials_project — Data from the Materials Project (materialsproject.org). Cite: Jain et al., APL Materials 1, 011002 (2013). (CC-BY-4.0)
  • jarvis — Data from JARVIS (jarvis.nist.gov), NIST. Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020). (LicenseRef-US-Gov-PD)
  • mpaloe — Data from MP-ALOE. Cite: Kuner et al., npj Comput. Mater. (2025), doi:10.1038/s41524-025-01834-9.
  • cod — Data from the Crystallography Open Database (crystallography.net/cod/). Cite: Grazulis et al., J. Appl. Cryst. 42, 726 (2009). (CC0-1.0)

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