Li2ZrF6

metal

· Li2ZrF6

Li₂ZrF₆ is a lithium zirconium fluoride compound belonging to the inorganic fluoride material family, typically studied for electrochemical and solid-state applications rather than conventional structural use. This material is primarily investigated in research contexts for lithium-ion battery electrolytes, solid electrolyte interfaces, and fluoride-based ion conductors where its ionic conductivity and electrochemical stability are exploited. Engineers and researchers consider this compound for next-generation energy storage systems seeking alternatives to organic liquid electrolytes, as fluoride-based ceramics offer thermal stability and potential for solid-state battery architectures.

solid-state battery electrolyteslithium-ion energy storageion conductor materialselectrochemical researchhigh-temperature ionic applicationsfluoride-based ceramics

Compliance & Regulations

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

Units:

si imperial

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Method

Property	Value	Unit	Conditions
Bulk Modulus(K)2 entries	8,391.6	ksi	DFT
↳	9,395.5	ksi	DFT · OptB88vdW
Poisson's Ratio(ν)	0.2400	-	DFT · OptB88vdW
Shear Modulus(G)2 entries	5,142.8	ksi	DFT
↳	6,023.4	ksi	DFT · OptB88vdW

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
Density(ρ)	0.1359	lb/in³	DFT · OptB88vdW

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

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Method

Carrier

Property	Value	Unit	Conditions
Band Gap(Eg)	6.736	eV	DFT · OptB88vdW
Dielectric Constant (Relative Permittivity)(εr)	6.072 range 2.368–9.777median of 2 measurements	-	DFT · PBEsol
High-Frequency Dielectric Constant (ε∞)(ε∞)	2.484	-	DFT · OptB88vdW
Magnetic Moment(μB)	0.000	µB	DFT · OptB88vdW
Thermoelectric Power Factor(PF)2 entries	0.000344	W/(m·K²)	DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C
↳	0.000527	W/(m·K²)	DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C
Seebeck Coefficient(S)2 entries	-512.4	μV/K	DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C
↳	570.1	μV/K	DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C

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)	0.00200	eV/atom	DFT · OptB88vdW
Formation Energy(ΔHf)	-3.609	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

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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.

Li2ZrF6 — Properties & Data | MatWorld

Li2ZrF6

Mechanical Properties

Physical Properties

Electrical Properties

Other Properties

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