Li2Ni3SbO8

This complex oxide is a lithium-containing material studied primarily for its magnetic properties and structural characteristics. It is investigated in solid-state chemistry research to understand how specific atomic arrangements influence electronic and magnetic behavior in crystalline lattices.

Crystal structure of Li2Ni3SbO8 (trigonal, R-3 (No. 148))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Li2Ni3SbO8, aggregated across 3 databases.

Band Gap

0.21–0.66 eV
Range across DFT structures

Energy Above Hull

0.001 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

17
3 databases, 7 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Li2Ni3SbO8, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
R-3 (No. 148)trigonal0.660.0007-6.1874.94
R-3c (No. 167)trigonal0.550.0129-6.1754.94
P31c (No. 159)trigonal0.470.0145-6.1735.25
C2/m (No. 12)monoclinic0.210.0166-6.1714.94
R-3m (No. 166)trigonal0.000.0172-6.1714.89
P4332 (No. 212)cubic0.230.0216-6.1665.00
P63mc (No. 186)hexagonal0.000.0296-6.1585.17
P63mc (No. 186)Hexagonal5.37
R-3m (No. 166)Trigonal5.12
R-3m (No. 166)Trigonal5.35
R-3 (No. 148)
R-3 (No. 148)
Uses

Applications

Where Li2Ni3SbO8 is used.

Solid-state physics researchMagnetic material studiesCrystallographic analysis
Reference

Frequently Asked Questions

Common questions about Li2Ni3SbO8, answered from cross-validated data.

What is Li2Ni3SbO8?

This complex oxide is a lithium-containing material studied primarily for its magnetic properties and structural characteristics. It is investigated in solid-state chemistry research to understand how specific atomic arrangements influence electronic and magnetic behavior in crystalline lattices.

More questions
What is Li2Ni3SbO8 used for?
Li2Ni3SbO8 is used in solid-state physics research, magnetic material studies, and crystallographic analysis.
What is the band gap of Li2Ni3SbO8?
Li2Ni3SbO8 has a DFT-computed band gap of 0.21–0.66 eV across 17 reported structures.
Is Li2Ni3SbO8 a metal, semiconductor, or insulator?
With a band gap up to 0.66 eV it is a semiconductor.
Is Li2Ni3SbO8 thermodynamically stable?
Yes — Li2Ni3SbO8 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Li2Ni3SbO8?
The lowest-energy reported polymorph of Li2Ni3SbO8 is trigonal symmetry, space group R-3 (No. 148).
What is the density of Li2Ni3SbO8?
The computed density of the ground-state structure of Li2Ni3SbO8 is 4.94 g/cm³.
How many polymorphs of Li2Ni3SbO8 are known?
17 structures of Li2Ni3SbO8 are reported across 3 databases, spanning 7 distinct space groups.
What elements does Li2Ni3SbO8 contain?
Li2Ni3SbO8 contains Li, Ni, O, and Sb (4 elements).
Where does the data for Li2Ni3SbO8 come from?
Li2Ni3SbO8 data is cross-referenced from materials_project, mpaloe, jarvis.
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Related Compounds

Other Layered Lithium Transition-Metal Oxides in the database.

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

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