CoF2

Cobalt(II) fluoride · Cobaltous fluoride

Cobalt(II) fluoride is a crystalline inorganic compound that typically appears as a pink or red solid. It is primarily utilized as a chemical reagent in specialized industrial processes and as a precursor for the synthesis of other cobalt-containing materials.

CoF
Crystal structure of CoF2 (tetragonal, P42/mnm (No. 136))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Cobalt(II) fluoride, aggregated across 3 databases.

Band Gap

2.27 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

168
3 databases, 28 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for CoF2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P42/mnm (No. 136)tetragonal2.270.0000-5.9954.67
Cm (No. 8)Monoclinic4.59
P-1 (No. 2)Triclinic5.63
P-1 (No. 2)Triclinic4.98
P-1 (No. 2)Triclinic4.86
C2/m (No. 12)Monoclinic6.11
P-1 (No. 2)Triclinic4.31
P-1 (No. 2)Triclinic4.56
C2/m (No. 12)Monoclinic7.30
C2/m (No. 12)Monoclinic4.92
C2/m (No. 12)Monoclinic5.66
P42/mnm (No. 136)
Uses

Applications

Where Cobalt(II) fluoride is used.

Chemical synthesisCatalyst preparationFluorinating agentLaboratory reagent
Reference

Frequently Asked Questions

Common questions about Cobalt(II) fluoride, answered from cross-validated data.

What is CoF2?

Cobalt(II) fluoride is a crystalline inorganic compound that typically appears as a pink or red solid. It is primarily utilized as a chemical reagent in specialized industrial processes and as a precursor for the synthesis of other cobalt-containing materials.

More questions
What is CoF2 used for?
Cobalt(II) fluoride (CoF2) is used in chemical synthesis, catalyst preparation, fluorinating agent, and laboratory reagent.
What is the band gap of CoF2?
Cobalt(II) fluoride (CoF2) has a DFT-computed band gap of 2.27 eV across 168 reported structures.
Is CoF2 a metal, semiconductor, or insulator?
With a band gap up to 2.27 eV it is a semiconductor.
Is CoF2 thermodynamically stable?
Yes — Cobalt(II) fluoride (CoF2) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of CoF2?
The lowest-energy reported polymorph of Cobalt(II) fluoride (CoF2) is tetragonal symmetry, space group P42/mnm (No. 136).
What is the density of CoF2?
The computed density of the ground-state structure of Cobalt(II) fluoride (CoF2) is 4.67 g/cm³.
How many polymorphs of CoF2 are known?
168 structures of CoF2 are reported across 3 databases, spanning 28 distinct space groups.
What elements does CoF2 contain?
Cobalt(II) fluoride (CoF2) contains Co and F (2 elements).
Where does the data for CoF2 come from?
CoF2 data is cross-referenced from materials_project, mpaloe, jarvis.
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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