Li2V2SnO6

Li2V2SnO6 is a metastable semiconducting oxide composed of lithium, vanadium, tin, and oxygen.

LiOSnV
Crystal structure of Li2V2SnO6 (orthorhombic, Cmce (No. 64))
Ground-state structure · Materials Project
Overview

About Li2V2SnO6

Li2V2SnO6 is a complex oxide containing lithium, vanadium, tin, and oxygen. As a semiconducting material, it exhibits electronic properties that make it a subject of interest for researchers investigating new functional inorganic compounds. Its status as a metastable phase suggests unique structural configurations that can be accessed under specific synthesis conditions. Because it is a relatively niche compound, it represents an opportunity to explore how transition metal and main group elements interact within a crystal lattice to influence charge transport. The ongoing study of this material across multiple databases highlights its importance in the broader effort to map the landscape of complex oxides.

At a glance

Key Properties

Cross-validated computational properties for Li2V2SnO6, aggregated across 3 databases.

Band Gap

1.83 eV
Range across DFT structures

Energy Above Hull

0.087 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

5
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Li2V2SnO6, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Cmce (No. 64)orthorhombic1.830.0868-7.3654.29
Cmce (No. 64)Orthorhombic4.29
Cmce (No. 64)Orthorhombic4.64
Cmce (No. 64)Orthorhombic4.46
Cmce (No. 64)
Uses

Applications

Where Li2V2SnO6 is used.

Materials science researchSolid-state chemistry studiesExploratory electronic materials development
Reference

Frequently Asked Questions

Common questions about Li2V2SnO6, answered from cross-validated data.

What is Li2V2SnO6?

Li2V2SnO6 is a metastable semiconducting oxide composed of lithium, vanadium, tin, and oxygen.

More questions
What is Li2V2SnO6 used for?
Li2V2SnO6 is used in materials science research, solid-state chemistry studies, and exploratory electronic materials development.
What is the band gap of Li2V2SnO6?
Li2V2SnO6 has a DFT-computed band gap of 1.83 eV across 5 reported structures.
Is Li2V2SnO6 a metal, semiconductor, or insulator?
With a band gap up to 1.83 eV it is a semiconductor.
Is Li2V2SnO6 thermodynamically stable?
Li2V2SnO6 has a lowest energy above hull of 0.087 eV/atom (metastable).
What is the crystal structure of Li2V2SnO6?
The lowest-energy reported polymorph of Li2V2SnO6 is orthorhombic symmetry, space group Cmce (No. 64).
What is the density of Li2V2SnO6?
The computed density of the ground-state structure of Li2V2SnO6 is 4.29 g/cm³.
How many polymorphs of Li2V2SnO6 are known?
5 structures of Li2V2SnO6 are reported across 3 databases, spanning 1 distinct space group.
What elements does Li2V2SnO6 contain?
Li2V2SnO6 contains Li, O, Sn, and V (4 elements).
Where does the data for Li2V2SnO6 come from?
Li2V2SnO6 data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

As a unique quaternary oxide, Li2V2SnO6 occupies a specialized niche in materials science where the interplay between vanadium and tin cations dictates its semiconducting behavior. Unlike more common binary or ternary oxides, this compound provides a distinct structural framework that allows for the investigation of complex ion coordination in a metastable state.

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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