AgO

Silver(I,III) oxide · Silver peroxide

AgO is a stable, semiconducting mixed-valence oxide of silver widely utilized for its high energy density in advanced battery technologies.

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

About Silver(I,III) oxide

Silver(I,III) oxide is a distinct inorganic compound characterized by its mixed-valence state, where silver atoms occupy two different oxidation environments within the crystal lattice. As a thermodynamically stable material situated on the convex hull, it exhibits robust structural integrity that makes it a reliable candidate for electrochemical applications.

This semiconducting oxide is primarily recognized for its high energy density and efficient charge-transfer capabilities. Its ability to undergo specific reduction processes allows it to function effectively in demanding power storage environments where consistent performance and stability are required.

At a glance

Key Properties

Cross-validated computational properties for Silver(I,III) oxide, aggregated across 6 databases.

Band Gap

0.08–0.19 eV
Range across DFT structures · ground state: metal

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

Stable
4 DFT sources

Structures

322
6 databases, 36 space groups
Validation

Cross-Source DFT Agreement

How well independent DFT databases agree on the thermodynamics of AgO. Tight agreement means computed properties can be trusted without re-running calculations.

Agreement Score

1.00 / 1.00
Trust tier: high

Hull Spread

0.000 eV
EAH spread across sources

Sources Compared

3
jarvis, materials_project, oqmd

Space Group Consensus

All match
Crystallography

Reported Structures

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

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P42/mmc (No. 131)tetragonal0.000.0000-4.3386.73
P42/mmc (No. 131)tetragonal0.000.0000-0.223—
P42/mmc (No. 131)tetragonal0.000.0000-0.223—
——0.000.0000-0.315—
C2/c (No. 15)monoclinic0.000.0002-0.223—
C2/c (No. 15)monoclinic0.000.0008-0.223—
Cccm (No. 66)orthorhombic0.000.0026-4.3357.13
C2/c (No. 15)monoclinic0.000.0055-4.3337.14
C2/c (No. 15)monoclinic0.000.0087-4.3296.80
P21/c (No. 14)monoclinic0.080.0213-0.202—
I41/a (No. 88)tetragonal0.190.0251-0.198—
P21/c (No. 14)monoclinic0.120.0423-4.2967.62
Uses

Applications

Where Silver(I,III) oxide is used.

Primary silver-zinc batteriesHigh-energy density electrochemical cellsOxidizing agent in chemical synthesis
Intellectual Property

Patent Landscape

5 patents reference AgO or close compositional variants.

PatentTitleAssigneeGranted
4835077AgO cathode material——
6001508AgO cathode battery——
5389469AgO battery, and material——
3953239Al-AgO primary battery——
4056664Electrochemical cell having an AgO electrode discharging at an Ag.sub.2 O voltage level——
Reference

Frequently Asked Questions

Common questions about Silver(I,III) oxide, answered from cross-validated data.

What is AgO?

AgO is a stable, semiconducting mixed-valence oxide of silver widely utilized for its high energy density in advanced battery technologies.

More questions
What is AgO used for?
Silver(I,III) oxide (AgO) is used in primary silver-zinc batteries, high-energy density electrochemical cells, and oxidizing agent in chemical synthesis.
What is the band gap of AgO?
Silver(I,III) oxide (AgO) has a DFT-computed band gap of 0.08–0.19 eV across 322 reported structures. Standard DFT underestimates band gaps, so the measured gap is typically larger.
Is AgO a metal, semiconductor, or insulator?
DFT predicts a band gap of up to 0.19 eV (a semiconductor). Measured gaps are typically larger.
Is AgO thermodynamically stable?
Yes — Silver(I,III) oxide (AgO) sits on the convex hull (energy above hull 0 eV/atom), i.e. stable.
What is the crystal structure of AgO?
The reference structure of Silver(I,III) oxide (AgO) is monoclinic symmetry, space group P21/c (No. 14).
How many polymorphs of AgO are known?
322 structures of AgO are reported across 6 databases, spanning 36 distinct space groups.
What elements does AgO contain?
Silver(I,III) oxide (AgO) contains Ag and O (2 elements).
Where does the data for AgO come from?
AgO data is cross-referenced from materials_project, jarvis, oqmd.
Comparison

How It Compares

As a singular, highly studied compound in its category, AgO serves as a benchmark for silver-based oxides. Its status as a thermodynamically stable semiconductor distinguishes it from less stable or more transient metal oxide phases, positioning it as a primary choice for applications requiring high electrochemical reliability.

Data sources & attribution
  • materials_project — Data from the Materials Project (materialsproject.org). Cite: Jain et al., APL Materials 1, 011002 (2013). (CC-BY-4.0)
  • jarvis — Data from JARVIS (jarvis.nist.gov), NIST. Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020). (LicenseRef-US-Gov-PD)
  • oqmd — Data from the OQMD (oqmd.org). Cite: Saal et al., JOM 65, 1501 (2013); Kirklin et al., npj Comp. Mater. 1, 15010 (2015). (CC-BY-4.0)

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