CsGe

CsGe is a stable, semiconducting binary compound formed from cesium and germanium.

CsGe
Crystal structure of CsGe (cubic, P-43n (No. 218))
Ground-state structure · Materials Project
Overview

About CsGe

CsGe is a binary inorganic compound composed of cesium and germanium. As a thermodynamically stable phase located on the convex hull, it represents a robust structural configuration that has been extensively documented across various crystallographic databases.

This material exhibits semiconducting electronic characteristics, making it an object of interest for fundamental studies in solid-state physics. Its stable nature provides a reliable baseline for researchers investigating the interplay between alkali metals and group fourteen elements in semiconductor design.

At a glance

Key Properties

Cross-validated computational properties for CsGe, aggregated across 4 databases.

Band Gap

0.98–1.33 eV
Range across DFT structures · ground state: narrow gap

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

Stable
2 DFT sources

Structures

53
4 databases, 12 space groups
Validation

Cross-Source DFT Agreement

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

Agreement Score

1.00 / 1.00
Trust tier: medium

Hull Spread

0.000 eV
EAH spread across sources

Sources Compared

2
materials_project, oqmd

Space Group Consensus

—
Crystallography

Reported Structures

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

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P-43n (No. 218)cubic1.330.0000-2.9714.22
——1.160.0000-0.211—
I41/acd (No. 142)tetragonal0.980.0198-2.9514.36
Cmcm (No. 63)orthorhombic0.000.1399-2.8314.03
——0.000.76820.557—
——0.000.77660.565—
——0.000.78510.574—
——0.000.80010.589—
——0.001.13900.928—
——0.001.34581.134—
P1 (No. 1)triclinic———2.66
P1 (No. 1)triclinic———2.46
Uses

Applications

Where CsGe is used.

Semiconductor researchSolid-state physics investigationsMaterials science modeling
Reference

Frequently Asked Questions

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

What is CsGe?

CsGe is a stable, semiconducting binary compound formed from cesium and germanium.

More questions
What is CsGe used for?
CsGe is used in semiconductor research, solid-state physics investigations, and materials science modeling.
What is the band gap of CsGe?
CsGe has a DFT-computed band gap of 0.98–1.33 eV across 53 reported structures. Standard DFT underestimates band gaps, so the measured gap is typically larger.
Is CsGe a metal, semiconductor, or insulator?
DFT predicts a band gap of up to 1.33 eV (a semiconductor). Measured gaps are typically larger.
Is CsGe thermodynamically stable?
Yes — CsGe sits on the convex hull (energy above hull 0 eV/atom), i.e. stable.
What is the crystal structure of CsGe?
The reference structure of CsGe is cubic symmetry, space group P-43n (No. 218).
What is the density of CsGe?
The computed density of the ground-state structure of CsGe is 4.22 g/cm³.
How many polymorphs of CsGe are known?
53 structures of CsGe are reported across 4 databases, spanning 12 distinct space groups.
What elements does CsGe contain?
CsGe contains Cs and Ge (2 elements).
Where does the data for CsGe come from?
CsGe data is cross-referenced from materials_project, oqmd, mpaloe.
Comparison

How It Compares

As a distinct binary phase, CsGe serves as a primary example of stable cesium-germanium intermetallics. It occupies a unique position within the broader landscape of alkali-metal germanides, offering a well-defined structural framework that contrasts with more complex or less stable compositions in the same chemical family.

Data sources & attribution
  • materials_project — Data from the Materials Project (materialsproject.org). Cite: Jain et al., APL Materials 1, 011002 (2013). (CC-BY-4.0)
  • 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)
  • mpaloe — Data from MP-ALOE. Cite: Kuner et al., npj Comput. Mater. (2025), doi:10.1038/s41524-025-01834-9.

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