Au2K2Na4O4

This compound is a complex oxide containing gold, potassium, and sodium. It is primarily studied in the field of solid-state chemistry to understand the structural properties and bonding characteristics of alkali metal aurates.

AuKNaO
Crystal structure of Au2K2Na4O4 (orthorhombic, Pnnm (No. 58))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Au2K2Na4O4, aggregated across 3 databases.

Band Gap

2.05 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

4
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Au2K2Na4O4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Pnnm (No. 58)orthorhombic2.050.0000-4.1444.63
4.59
Pnnm (No. 58)
4.59
Uses

Applications

Where Au2K2Na4O4 is used.

Fundamental materials science researchSolid-state chemistry studies
Reference

Frequently Asked Questions

Common questions about Au2K2Na4O4, answered from cross-validated data.

What is Au2K2Na4O4?

This compound is a complex oxide containing gold, potassium, and sodium. It is primarily studied in the field of solid-state chemistry to understand the structural properties and bonding characteristics of alkali metal aurates.

More questions
What is Au2K2Na4O4 used for?
Au2K2Na4O4 is used in fundamental materials science research and solid-state chemistry studies.
What is the band gap of Au2K2Na4O4?
Au2K2Na4O4 has a DFT-computed band gap of 2.05 eV across 4 reported structures.
Is Au2K2Na4O4 a metal, semiconductor, or insulator?
With a band gap up to 2.05 eV it is a semiconductor.
Is Au2K2Na4O4 thermodynamically stable?
Yes — Au2K2Na4O4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Au2K2Na4O4?
The lowest-energy reported polymorph of Au2K2Na4O4 is orthorhombic symmetry, space group Pnnm (No. 58).
What is the density of Au2K2Na4O4?
The computed density of the ground-state structure of Au2K2Na4O4 is 4.63 g/cm³.
How many polymorphs of Au2K2Na4O4 are known?
4 structures of Au2K2Na4O4 are reported across 3 databases, spanning 1 distinct space group.
What elements does Au2K2Na4O4 contain?
Au2K2Na4O4 contains Au, K, Na, and O (4 elements).
Where does the data for Au2K2Na4O4 come from?
Au2K2Na4O4 data is cross-referenced from materials_project, omat24, aflow.
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).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).

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