LuSF

Lutetium sulfur fluoride is a rare-earth chalcogenide halide material. It is primarily utilized in advanced materials research, particularly in the study of solid-state chemistry and the development of specialized optical or electronic components.

FLuS
Crystal structure of LuSF (trigonal, R-3m (No. 166))
Ground-state structure · Materials Project
Overview

Key Properties

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

Band Gap

2.61 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

5
3 databases, 2 space groups
Crystallography

Reported Structures

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

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
R-3m (No. 166)trigonal2.610.0000-19.7036.87
C2/m (No. 12)Monoclinic7.14
C2/m (No. 12)Monoclinic7.26
C2/m (No. 12)Monoclinic7.36
R-3m (No. 166)
Uses

Applications

Where LuSF is used.

Materials science researchSolid-state chemistry studiesOptical component development
Reference

Frequently Asked Questions

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

What is LuSF?

Lutetium sulfur fluoride is a rare-earth chalcogenide halide material. It is primarily utilized in advanced materials research, particularly in the study of solid-state chemistry and the development of specialized optical or electronic components.

More questions
What is LuSF used for?
LuSF is used in materials science research, solid-state chemistry studies, and optical component development.
What is the band gap of LuSF?
LuSF has a DFT-computed band gap of 2.61 eV across 5 reported structures.
Is LuSF a metal, semiconductor, or insulator?
With a band gap up to 2.61 eV it is a semiconductor.
Is LuSF thermodynamically stable?
Yes — LuSF sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of LuSF?
The lowest-energy reported polymorph of LuSF is trigonal symmetry, space group R-3m (No. 166).
What is the density of LuSF?
The computed density of the ground-state structure of LuSF is 6.87 g/cm³.
How many polymorphs of LuSF are known?
5 structures of LuSF are reported across 3 databases, spanning 2 distinct space groups.
What elements does LuSF contain?
LuSF contains F, Lu, and S (3 elements).
Where does the data for LuSF come from?
LuSF 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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