Ca2H38O46V10

Ca2H38O46V10 is a metastable, semiconducting compound containing calcium, hydrogen, oxygen, and vanadium.

CaHOV
Crystal structure of Ca2H38O46V10
Ground-state structure · Materials Project
Overview

About Ca2H38O46V10

Ca2H38O46V10 is a complex inorganic compound composed of calcium, hydrogen, oxygen, and vanadium. As a semiconducting material, it exhibits electronic properties that distinguish it from simple metallic or insulating oxides, making it a subject of interest for fundamental materials research.

This compound is characterized as metastable, suggesting it exists in a specific structural state that requires precise synthesis conditions to maintain. Its intricate composition highlights the diversity of vanadium-based chemistry and the potential for discovering novel functional materials within complex hydrated systems.

At a glance

Key Properties

Cross-validated computational properties for Ca2H38O46V10, aggregated across 3 databases.

Band Gap

2.34 eV
Range across DFT structures

Energy Above Hull

0.030 eV/atom
Best (lowest) across sources

Stability

Metastable
1 DFT source

Structures

4
3 databases, 2 space groups
Reference

Frequently Asked Questions

Common questions about Ca2H38O46V10, answered from cross-validated data.

What is Ca2H38O46V10?

Ca2H38O46V10 is a metastable, semiconducting compound containing calcium, hydrogen, oxygen, and vanadium.

More questions
What is the band gap of Ca2H38O46V10?
Ca2H38O46V10 has a DFT-computed band gap of 2.34 eV across 4 reported structures.
Is Ca2H38O46V10 a metal, semiconductor, or insulator?
With a band gap up to 2.34 eV it is a semiconductor.
Is Ca2H38O46V10 thermodynamically stable?
Ca2H38O46V10 has a lowest energy above hull of 0.030 eV/atom (metastable).
How many polymorphs of Ca2H38O46V10 are known?
4 structures of Ca2H38O46V10 are reported across 3 databases, spanning 2 distinct space groups.
What elements does Ca2H38O46V10 contain?
Ca2H38O46V10 contains Ca, H, O, and V (4 elements).
Where does the data for Ca2H38O46V10 come from?
Ca2H38O46V10 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique inorganic assembly, Ca2H38O46V10 represents a specialized structural motif within the broader landscape of vanadium-oxygen frameworks. While many vanadium compounds are studied for their redox capabilities, this specific stoichiometry occupies a distinct niche, serving as a reference point for understanding how hydration and calcium coordination influence the electronic behavior of complex vanadium-based semiconductors.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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