LiNdO2

Lithium neodymium oxide

Lithium neodymium oxide is a complex oxide material typically synthesized for its magnetic and structural properties. It is primarily utilized in solid-state chemistry research and as a precursor for developing advanced ceramic materials with specific electronic characteristics.

Crystal structure of LiNdO2 (monoclinic, P21/c (No. 14))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for LiNdO2, aggregated across 3 databases.

Band Gap

3.66 eV
Range across DFT structures

Energy Above Hull

0.008 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

5
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for LiNdO2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P21/c (No. 14)monoclinic3.660.0083-7.2716.18
P21/c (No. 14)monoclinic3.610.0112-7.2695.21
4.83
4.83
P21/c (No. 14)
Uses

Applications

Where LiNdO2 is used.

Solid-state researchCeramic material developmentMagnetic materials study
Reference

Frequently Asked Questions

Common questions about LiNdO2, answered from cross-validated data.

What is LiNdO2?

Lithium neodymium oxide is a complex oxide material typically synthesized for its magnetic and structural properties. It is primarily utilized in solid-state chemistry research and as a precursor for developing advanced ceramic materials with specific electronic characteristics.

More questions
What is LiNdO2 used for?
LiNdO2 is used in solid-state research, ceramic material development, and magnetic materials study.
What is the band gap of LiNdO2?
LiNdO2 has a DFT-computed band gap of 3.66 eV across 5 reported structures.
Is LiNdO2 a metal, semiconductor, or insulator?
With a wide band gap up to 3.66 eV it is an insulator / wide-band-gap material.
Is LiNdO2 thermodynamically stable?
LiNdO2 has a lowest energy above hull of 0.008 eV/atom (near hull (likely stable)).
What is the crystal structure of LiNdO2?
The lowest-energy reported polymorph of LiNdO2 is monoclinic symmetry, space group P21/c (No. 14).
What is the density of LiNdO2?
The computed density of the ground-state structure of LiNdO2 is 6.18 g/cm³.
How many polymorphs of LiNdO2 are known?
5 structures of LiNdO2 are reported across 3 databases, spanning 1 distinct space group.
What elements does LiNdO2 contain?
LiNdO2 contains Li, Nd, and O (3 elements).
Where does the data for LiNdO2 come from?
LiNdO2 data is cross-referenced from materials_project, omat24, jarvis.
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Related Compounds

Other Lithium Oxides in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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