Mg2CrWO6

This complex oxide is a member of the double perovskite family, characterized by its specific crystalline arrangement of metal cations and oxygen atoms. It is primarily studied by researchers for its potential magnetic and electronic properties in advanced materials science.

CrMgOW
Crystal structure of Mg2CrWO6 (trigonal, R3 (No. 146))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Mg2CrWO6, aggregated across 3 databases.

Band Gap

0.05–2.17 eV
Range across DFT structures

Energy Above Hull

0.046 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

11
3 databases, 3 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Mg2CrWO6, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
R3 (No. 146)trigonal1.600.0456-8.1175.81
P1 (No. 1)triclinic2.170.0461-8.1165.82
P21/c (No. 14)monoclinic0.050.0688-8.0945.96
R3 (No. 146)
P21/c (No. 14)
P21/c (No. 14)Monoclinic5.96
P21/c (No. 14)Monoclinic6.22
P1 (No. 1)Triclinic5.82
P21/c (No. 14)Monoclinic6.61
P1 (No. 1)Triclinic6.44
P1 (No. 1)Triclinic6.08
Uses

Applications

Where Mg2CrWO6 is used.

Fundamental condensed matter researchSolid-state physics studiesExploratory materials synthesis
Reference

Frequently Asked Questions

Common questions about Mg2CrWO6, answered from cross-validated data.

What is Mg2CrWO6?

This complex oxide is a member of the double perovskite family, characterized by its specific crystalline arrangement of metal cations and oxygen atoms. It is primarily studied by researchers for its potential magnetic and electronic properties in advanced materials science.

More questions
What is Mg2CrWO6 used for?
Mg2CrWO6 is used in fundamental condensed matter research, solid-state physics studies, and exploratory materials synthesis.
What is the band gap of Mg2CrWO6?
Mg2CrWO6 has a DFT-computed band gap of 0.05–2.17 eV across 11 reported structures.
Is Mg2CrWO6 a metal, semiconductor, or insulator?
With a band gap up to 2.17 eV it is a semiconductor.
Is Mg2CrWO6 thermodynamically stable?
Mg2CrWO6 has a lowest energy above hull of 0.046 eV/atom (metastable).
What is the crystal structure of Mg2CrWO6?
The lowest-energy reported polymorph of Mg2CrWO6 is trigonal symmetry, space group R3 (No. 146).
What is the density of Mg2CrWO6?
The computed density of the ground-state structure of Mg2CrWO6 is 5.81 g/cm³.
How many polymorphs of Mg2CrWO6 are known?
11 structures of Mg2CrWO6 are reported across 3 databases, spanning 3 distinct space groups.
What elements does Mg2CrWO6 contain?
Mg2CrWO6 contains Cr, Mg, O, and W (4 elements).
Where does the data for Mg2CrWO6 come from?
Mg2CrWO6 data is cross-referenced from materials_project, jarvis, mpaloe.
Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).
  • mpaloe — Data from mpaloe.

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