Li3V2O6 — Properties & Data | MatWorld

Li3V2O6

ceramic

· Li3V2O6

Li3V2O6 is a lithium vanadium oxide ceramic compound being investigated as a cathode material for lithium-ion and post-lithium battery systems. This research material is notable for its potential to deliver high energy density and improved cycle stability compared to conventional layered oxide cathodes, making it of particular interest for next-generation energy storage where vanadium-based architectures offer tunable redox activity and structural flexibility.

lithium-ion battery cathodesadvanced energy storage researchhigh-energy-density cellselectric vehicle batteriesgrid-scale energy storagematerials research and development

Compliance & Regulations

?Conflict Free?RoHS?REACH?TSCA?Prop 65

Units:

si imperial

Property	Value	Unit	Conditions
Bulk Modulus(K)	95.44	GPa	DFT · OptB88vdW
Poisson's Ratio(ν)	0.2400	-	DFT · OptB88vdW
Shear Modulus(G)	63.59	GPa	DFT · OptB88vdW

Verified Unverified Low confidence (<80%) Link to source

Property	Value	Unit	Conditions	Source
Density(ρ)	3.525	kg/m³	DFT · OptB88vdW

Verified Unverified Low confidence (<80%) Link to source

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Method

Carrier

Property	Value	Unit	Conditions
Band Gap(Eg)2 entries	0.2850	eV	DFT · OptB88vdW
↳	2.549	eV	DFT · TBmBJ
Dielectric Constant (Relative Permittivity)(εr)	39.86	-	DFT · OptB88vdW
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries	12.24	-	DFT · OptB88vdW
↳	54.69	-	DFT · TBmBJ
Electron Effective Mass(m*e)	0.02000	me	DFT · OptB88vdW · 27°C
Hole Effective Mass(m*h)	0.02000	me	DFT · OptB88vdW · 27°C
Magnetic Moment(μB)	0.9880	µB	DFT · OptB88vdW
Piezoelectric Modulus(eij)2 entries	0.000	C/m²	DFT · OptB88vdW
↳	0.4851	C/m²	DFT · PBE
Piezoelectric Stress Tensor(eij)	Matrix (redacted)	C/m²	DFT · PBE
Thermoelectric Power Factor(PF)2 entries	0.000286	W/(m·K²)	DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C
↳	0.000304	W/(m·K²)	DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C
Seebeck Coefficient(S)2 entries	-160	μV/K	DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C
↳	159	μV/K	DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C
Spectroscopic Limited Maximum Efficiency (SLME)(SLME)	11.70	%	DFT · TBmBJ

N entriesMultiple entries per property — large groups are collapsed; click a summary row to expand. Use filters above to narrow by form, heat treatment, basis, or test environment.

Verified Unverified Low confidence (<80%) Link to source

Property	Value	Unit	Conditions	Source
Energy Above Hull(ΔEhull)	0.08420	eV/atom	DFT · OptB88vdW
Formation Energy(ΔHf)	-2.475	eV/atom	DFT · OptB88vdW

Verified Unverified Low confidence (<80%) Link to source

Reference data from cited sources. Not verified or certified by MatWorld Inc. Verify against the source before use in design. Terms: engineering data

Regulatory Screening

Environmental

RoHS, REACH, and Prop 65 statuses are validated against official substance lists (ECHA SVHC Candidate List, OEHHA Prop 65, RoHS Annex II). Other regulations are estimated from composition and material classification. All screening is a starting point for due diligence — always verify with your supplier before making compliance decisions.

Li3V2O6

Mechanical Properties

Physical Properties

Electrical Properties

Other Properties

Regulatory Screening

Environmental