Cu1O2Pr1

Praseodymium cuprate · PrCuO2

Praseodymium cuprate is a ceramic material belonging to the family of copper-based oxides. It is primarily studied in condensed matter physics for its magnetic properties and its role in understanding the behavior of complex transition metal oxides.

Crystal structure of Cu1O2Pr1 (trigonal, R-3m (No. 166))
Ground-state structure · Materials Project
Overview

Key Properties

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

Band Gap

2.36 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
1 DFT source

Structures

5
3 databases, 3 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Cu1O2Pr1, 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)trigonal2.360.0000-7.2795.57
I41/a (No. 88)tetragonal0.000.0000-6.6918.35
R-3m (No. 166)
R-3m (No. 166)
No. 0unknown2.04
Uses

Applications

Where Praseodymium cuprate is used.

Materials science researchSolid-state physics studiesInvestigation of magnetic ordering
Reference

Frequently Asked Questions

Common questions about Praseodymium cuprate, answered from cross-validated data.

What is Cu1O2Pr1?

Praseodymium cuprate is a ceramic material belonging to the family of copper-based oxides. It is primarily studied in condensed matter physics for its magnetic properties and its role in understanding the behavior of complex transition metal oxides.

More questions
What is Cu1O2Pr1 used for?
Praseodymium cuprate (Cu1O2Pr1) is used in materials science research, solid-state physics studies, and investigation of magnetic ordering.
What is the band gap of Cu1O2Pr1?
Praseodymium cuprate (Cu1O2Pr1) has a DFT-computed band gap of 2.36 eV across 5 reported structures.
Is Cu1O2Pr1 a metal, semiconductor, or insulator?
With a band gap up to 2.36 eV it is a semiconductor.
Is Cu1O2Pr1 thermodynamically stable?
Yes — Praseodymium cuprate (Cu1O2Pr1) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Cu1O2Pr1?
The lowest-energy reported polymorph of Praseodymium cuprate (Cu1O2Pr1) is trigonal symmetry, space group R-3m (No. 166).
What is the density of Cu1O2Pr1?
The computed density of the ground-state structure of Praseodymium cuprate (Cu1O2Pr1) is 5.57 g/cm³.
How many polymorphs of Cu1O2Pr1 are known?
5 structures of Cu1O2Pr1 are reported across 3 databases, spanning 3 distinct space groups.
What elements does Cu1O2Pr1 contain?
Praseodymium cuprate (Cu1O2Pr1) contains Cu, O, and Pr (3 elements).
Where does the data for Cu1O2Pr1 come from?
Cu1O2Pr1 data is cross-referenced from materials_project, aflow, cod.
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Related Compounds

Other Spinel Oxide Catalysts in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).
  • cod — Data from the Crystallography Open Database. Cite: Grazulis et al., Nucleic Acids Res. 40, D420 (2012).

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