CeMgSe3

This compound is a ternary chalcogenide belonging to a class of materials often studied for their electronic and structural properties. It is primarily utilized in academic research to explore semiconductor behavior and potential optoelectronic functionality.

CeMgSe
Crystal structure of CeMgSe3 (trigonal, R-3 (No. 148))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for CeMgSe3, aggregated across 3 databases.

Band Gap

0.15–0.88 eV
Range across DFT structures

Energy Above Hull

0.102 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

6
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for CeMgSe3, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
R-3 (No. 148)trigonal0.880.1022-5.2624.80
C2/m (No. 12)monoclinic0.150.2704-5.0944.65
R-3 (No. 148)Trigonal4.80
R-3 (No. 148)Trigonal4.95
R-3 (No. 148)Trigonal4.90
Uses

Applications

Where CeMgSe3 is used.

Materials science researchSemiconductor developmentSolid-state physics studies
Reference

Frequently Asked Questions

Common questions about CeMgSe3, answered from cross-validated data.

What is CeMgSe3?

This compound is a ternary chalcogenide belonging to a class of materials often studied for their electronic and structural properties. It is primarily utilized in academic research to explore semiconductor behavior and potential optoelectronic functionality.

More questions
What is CeMgSe3 used for?
CeMgSe3 is used in materials science research, semiconductor development, and solid-state physics studies.
What is the band gap of CeMgSe3?
CeMgSe3 has a DFT-computed band gap of 0.15–0.88 eV across 6 reported structures.
Is CeMgSe3 a metal, semiconductor, or insulator?
With a band gap up to 0.88 eV it is a semiconductor.
Is CeMgSe3 thermodynamically stable?
CeMgSe3 has a lowest energy above hull of 0.102 eV/atom (above hull).
What is the crystal structure of CeMgSe3?
The lowest-energy reported polymorph of CeMgSe3 is trigonal symmetry, space group R-3 (No. 148).
What is the density of CeMgSe3?
The computed density of the ground-state structure of CeMgSe3 is 4.80 g/cm³.
How many polymorphs of CeMgSe3 are known?
6 structures of CeMgSe3 are reported across 3 databases, spanning 2 distinct space groups.
What elements does CeMgSe3 contain?
CeMgSe3 contains Ce, Mg, and Se (3 elements).
Where does the data for CeMgSe3 come from?
CeMgSe3 data is cross-referenced from materials_project, mpaloe, alexandria.
Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.
  • alexandria — Data from alexandria.

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