Ho6O6Sb2

Ho6O6Sb2 is a metastable semiconducting oxide of holmium, oxygen, and antimony.

HoOSb
Crystal structure of Ho6O6Sb2 (monoclinic, C2/m (No. 12))
Ground-state structure · Materials Project
Overview

About Ho6O6Sb2

Ho6O6Sb2 is a complex ternary oxide composed of holmium, oxygen, and antimony. As a semiconducting material, it exhibits specific electronic characteristics that make it a subject of interest for researchers investigating the interplay between rare-earth elements and pnictogens in oxide lattices.

Although it is classified as a metastable compound, its existence is supported by multiple structural reports across various databases. This indicates a complex energy landscape that warrants further investigation into its synthesis pathways and potential for specialized electronic applications.

At a glance

Key Properties

Cross-validated computational properties for Ho6O6Sb2, aggregated across 4 databases.

Band Gap

0.37 eV
Range across DFT structures

Energy Above Hull

0.035 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

6
4 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Ho6O6Sb2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
C2/m (No. 12)monoclinic0.370.0350-7.8648.52
7.92
C2/m (No. 12)
No. 0unknown2.16
7.92
7.48
Uses

Applications

Where Ho6O6Sb2 is used.

Materials science researchSolid-state chemistry studiesElectronic property exploration
Reference

Frequently Asked Questions

Common questions about Ho6O6Sb2, answered from cross-validated data.

What is Ho6O6Sb2?

Ho6O6Sb2 is a metastable semiconducting oxide of holmium, oxygen, and antimony.

More questions
What is Ho6O6Sb2 used for?
Ho6O6Sb2 is used in materials science research, solid-state chemistry studies, and electronic property exploration.
What is the band gap of Ho6O6Sb2?
Ho6O6Sb2 has a DFT-computed band gap of 0.37 eV across 6 reported structures.
Is Ho6O6Sb2 a metal, semiconductor, or insulator?
With a band gap up to 0.37 eV it is a semiconductor.
Is Ho6O6Sb2 thermodynamically stable?
Ho6O6Sb2 has a lowest energy above hull of 0.035 eV/atom (metastable).
What is the crystal structure of Ho6O6Sb2?
The lowest-energy reported polymorph of Ho6O6Sb2 is monoclinic symmetry, space group C2/m (No. 12).
What is the density of Ho6O6Sb2?
The computed density of the ground-state structure of Ho6O6Sb2 is 8.52 g/cm³.
How many polymorphs of Ho6O6Sb2 are known?
6 structures of Ho6O6Sb2 are reported across 4 databases, spanning 2 distinct space groups.
What elements does Ho6O6Sb2 contain?
Ho6O6Sb2 contains Ho, O, and Sb (3 elements).
Where does the data for Ho6O6Sb2 come from?
Ho6O6Sb2 data is cross-referenced from materials_project, omat24, aflow, cod.
Comparison

How It Compares

As a unique ternary oxide, Ho6O6Sb2 represents a niche area of study within the broader landscape of rare-earth antimony oxides. Without direct structural siblings in this specific class, it serves as an important reference point for understanding how holmium-based oxides can be stabilized or manipulated to achieve semiconducting behavior.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
  • 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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