Li4Fe3SbO8

Li4Fe3SbO8 is a semiconducting quaternary oxide that is considered a likely candidate for laboratory synthesis due to its favorable thermodynamic stability.

FeLiOSb
Crystal structure of Li4Fe3SbO8 (monoclinic, C2/m (No. 12))
Ground-state structure · Materials Project
Overview

About Li4Fe3SbO8

Li4Fe3SbO8 is a complex quaternary oxide that exhibits semiconducting electronic behavior. Its structural configuration, characterized by the arrangement of lithium, iron, antimony, and oxygen, suggests a degree of stability that places it near the thermodynamic hull, indicating it is a viable target for experimental synthesis.

This material is of significant interest in the study of multi-component oxides where the interplay between transition metals and p-block elements dictates unique physical properties. Its potential for structural diversity, evidenced by multiple reported configurations, positions it as a subject of interest for researchers exploring new functional materials.

At a glance

Key Properties

Cross-validated computational properties for Li4Fe3SbO8, aggregated across 3 databases.

Band Gap

1.30 eV
Range across DFT structures

Energy Above Hull

0.015 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

5
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Li4Fe3SbO8, 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)monoclinic1.300.0150-6.7474.57
C2/m (No. 12)
C2/m (No. 12)Monoclinic4.57
C2/m (No. 12)Monoclinic4.99
C2/m (No. 12)Monoclinic4.90
Uses

Applications

Where Li4Fe3SbO8 is used.

Materials science researchSolid-state chemistryElectronic component development
Reference

Frequently Asked Questions

Common questions about Li4Fe3SbO8, answered from cross-validated data.

What is Li4Fe3SbO8?

Li4Fe3SbO8 is a semiconducting quaternary oxide that is considered a likely candidate for laboratory synthesis due to its favorable thermodynamic stability.

More questions
What is Li4Fe3SbO8 used for?
Li4Fe3SbO8 is used in materials science research, solid-state chemistry, and electronic component development.
What is the band gap of Li4Fe3SbO8?
Li4Fe3SbO8 has a DFT-computed band gap of 1.30 eV across 5 reported structures.
Is Li4Fe3SbO8 a metal, semiconductor, or insulator?
With a band gap up to 1.30 eV it is a semiconductor.
Is Li4Fe3SbO8 thermodynamically stable?
Li4Fe3SbO8 has a lowest energy above hull of 0.015 eV/atom (near hull (likely stable)).
What is the crystal structure of Li4Fe3SbO8?
The lowest-energy reported polymorph of Li4Fe3SbO8 is monoclinic symmetry, space group C2/m (No. 12).
What is the density of Li4Fe3SbO8?
The computed density of the ground-state structure of Li4Fe3SbO8 is 4.57 g/cm³.
How many polymorphs of Li4Fe3SbO8 are known?
5 structures of Li4Fe3SbO8 are reported across 3 databases, spanning 1 distinct space group.
What elements does Li4Fe3SbO8 contain?
Li4Fe3SbO8 contains Fe, Li, O, and Sb (4 elements).
Where does the data for Li4Fe3SbO8 come from?
Li4Fe3SbO8 data is cross-referenced from materials_project, jarvis, mpaloe.
Comparison

How It Compares

As a quaternary oxide, Li4Fe3SbO8 represents a specialized niche in materials science where the combination of iron and antimony within an oxygen framework provides a unique platform for tuning electronic properties compared to simpler binary or ternary oxides.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).
  • mpaloe — Data from mpaloe.

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