Gd8Mo4O24

Gd8Mo4O24 is a stable, semiconducting gadolinium molybdenum oxide used in fundamental materials research.

GdMoO
Crystal structure of Gd8Mo4O24 (monoclinic, C2/c (No. 15))
Ground-state structure · Materials Project
Overview

About Gd8Mo4O24

Gd8Mo4O24 is a complex oxide composed of gadolinium, molybdenum, and oxygen. As a thermodynamically stable phase residing on the convex hull, it represents a robust crystalline arrangement that is well-defined within structural databases.

This material exhibits semiconducting electronic characteristics, positioning it as an interesting candidate for electronic or sensing applications. Its structural integrity makes it a reliable subject for fundamental studies into rare-earth molybdate systems.

At a glance

Key Properties

Cross-validated computational properties for Gd8Mo4O24, aggregated across 3 databases.

Band Gap

2.17 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

3
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Gd8Mo4O24, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
C2/c (No. 15)monoclinic2.170.0000-10.7727.07
C2/c (No. 15)
C2/c (No. 15)
Uses

Applications

Where Gd8Mo4O24 is used.

Materials science researchSolid-state electronics development
Reference

Frequently Asked Questions

Common questions about Gd8Mo4O24, answered from cross-validated data.

What is Gd8Mo4O24?

Gd8Mo4O24 is a stable, semiconducting gadolinium molybdenum oxide used in fundamental materials research.

More questions
What is Gd8Mo4O24 used for?
Gd8Mo4O24 is used in materials science research and solid-state electronics development.
What is the band gap of Gd8Mo4O24?
Gd8Mo4O24 has a DFT-computed band gap of 2.17 eV across 3 reported structures.
Is Gd8Mo4O24 a metal, semiconductor, or insulator?
With a band gap up to 2.17 eV it is a semiconductor.
Is Gd8Mo4O24 thermodynamically stable?
Yes — Gd8Mo4O24 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Gd8Mo4O24?
The lowest-energy reported polymorph of Gd8Mo4O24 is monoclinic symmetry, space group C2/c (No. 15).
What is the density of Gd8Mo4O24?
The computed density of the ground-state structure of Gd8Mo4O24 is 7.07 g/cm³.
How many polymorphs of Gd8Mo4O24 are known?
3 structures of Gd8Mo4O24 are reported across 3 databases, spanning 1 distinct space group.
What elements does Gd8Mo4O24 contain?
Gd8Mo4O24 contains Gd, Mo, and O (3 elements).
Where does the data for Gd8Mo4O24 come from?
Gd8Mo4O24 data is cross-referenced from materials_project, nomad, aflow.
Comparison

How It Compares

As a unique member of the rare-earth molybdate family, Gd8Mo4O24 serves as a benchmark for understanding the stability and electronic behavior of complex oxides in this class, providing a stable reference point for future structural investigations.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • nomad — Data from NOMAD. Cite: Draxl & Scheffler, J. Phys. Mater. 2, 036001 (2019).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).

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