InOF2

Indium oxyfluoride is an inorganic compound that combines indium, oxygen, and fluorine. It is primarily studied for its potential utility in advanced materials science, particularly in the development of specialized optical or electronic components.

Crystal structure of InOF2 (monoclinic, C2 (No. 5))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for InOF2, aggregated across 3 databases.

Band Gap

0.56 eV
Range across DFT structures

Energy Above Hull

0.347 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

7
3 databases, 3 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for InOF2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
C2 (No. 5)monoclinic0.560.3466-4.8444.33
P-1 (No. 2)Triclinic6.58
P-1 (No. 2)Triclinic5.93
P-1 (No. 2)Triclinic5.73
P4mm (No. 99)
C2 (No. 5)
C2 (No. 5)
Uses

Applications

Where InOF2 is used.

Materials science researchOptical materials developmentSemiconductor research
Reference

Frequently Asked Questions

Common questions about InOF2, answered from cross-validated data.

What is InOF2?

Indium oxyfluoride is an inorganic compound that combines indium, oxygen, and fluorine. It is primarily studied for its potential utility in advanced materials science, particularly in the development of specialized optical or electronic components.

More questions
What is InOF2 used for?
InOF2 is used in materials science research, optical materials development, and semiconductor research.
What is the band gap of InOF2?
InOF2 has a DFT-computed band gap of 0.56 eV across 7 reported structures.
Is InOF2 a metal, semiconductor, or insulator?
With a band gap up to 0.56 eV it is a semiconductor.
Is InOF2 thermodynamically stable?
InOF2 has a lowest energy above hull of 0.347 eV/atom (above hull).
What is the crystal structure of InOF2?
The lowest-energy reported polymorph of InOF2 is monoclinic symmetry, space group C2 (No. 5).
What is the density of InOF2?
The computed density of the ground-state structure of InOF2 is 4.33 g/cm³.
How many polymorphs of InOF2 are known?
7 structures of InOF2 are reported across 3 databases, spanning 3 distinct space groups.
What elements does InOF2 contain?
InOF2 contains F, In, and O (3 elements).
Where does the data for InOF2 come from?
InOF2 data is cross-referenced from materials_project, mpaloe, jarvis.
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Related Compounds

Other Transparent Conducting 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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