NaCl

Sodium chloride · Table salt, Halite, Rock salt

Sodium chloride is a common, stable ionic compound widely known as table salt that plays a vital role in both biological systems and industrial chemical production.

ClNa
Crystal structure of NaCl
Ground-state structure · Materials Project
Overview

About Sodium chloride

Sodium chloride is a fundamental ionic compound characterized by its high thermodynamic stability and insulating electronic nature. It forms a robust crystal lattice that serves as the standard reference for simple ionic bonding in materials science.

Beyond its ubiquity in culinary applications, this compound is a critical feedstock for the chlor-alkali industry. Its chemical reliability and abundance make it a cornerstone material for producing essential chemical precursors used in manufacturing and water treatment.

At a glance

Key Properties

Cross-validated computational properties for Sodium chloride, aggregated across 4 databases.

Band Gap

3.97–5.00 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

76
4 databases, 10 space groups
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting NaCl.

Sol Gel
Procedure available · ceder_sol_gel
Solid State
Procedure available · ceder_solid_state
Sol Gel
Procedure available · ceder_sol_gel
Solid State
Procedure available · ceder_solid_state
Solid State
Procedure available · ceder_solid_state
Uses

Applications

Where Sodium chloride is used.

Food seasoning and preservationChlor-alkali industrial processesDe-icing and road maintenanceWater softeningChemical synthesis
Intellectual Property

Patent Landscape

11 patents reference NaCl or close compositional variants.

PatentTitleAssigneeGranted
6063345Method of separating NaCl from a LiCl solution
4522951Removal of Mg.sup.++ and Ca.sup.++ ions from NaCl brine
4067751Aqueous NaCl test solution for aluminum and its alloys
4472361Method of recovering alumina values from a starting solid mixture comprising AlCl.sub.3 and NaCl
6547948Method of increasing the concentration of dilute brine in NaCl electrolysis plants using the membrane process
7988763Use of a binary salt flux of NaCl and MgCl2 for the purification of aluminium or aluminium alloys, and method
4125586Removal of AlCl.sub.3 from crude TiCl.sub.4 by addition of H.sub.2 O and NaCl
11040903Purification of NaCl brine containing iodine
4405574Removal of Mg.sup.++ and Ca.sup.++ ions from NaCl brine
4519806Enhanced recovery of soda ash from aqueous sodium carbonate solutions containing Na.sub.2 SO.sub.4 - and NaCl
Reference

Frequently Asked Questions

Common questions about Sodium chloride, answered from cross-validated data.

What is NaCl?

Sodium chloride is a common, stable ionic compound widely known as table salt that plays a vital role in both biological systems and industrial chemical production.

More questions
What is NaCl used for?
Sodium chloride (NaCl) is used in food seasoning and preservation, chlor-alkali industrial processes, de-icing and road maintenance, water softening, and chemical synthesis.
What is the band gap of NaCl?
Sodium chloride (NaCl) has a DFT-computed band gap of 3.97–5.00 eV across 76 reported structures.
Is NaCl a metal, semiconductor, or insulator?
With a wide band gap up to 5.00 eV it is an insulator / wide-band-gap material.
Is NaCl thermodynamically stable?
Yes — Sodium chloride (NaCl) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of NaCl are known?
76 structures of NaCl are reported across 4 databases, spanning 10 distinct space groups.
How is NaCl synthesized?
Literature-reported routes for NaCl include sol gel, solid state (5 procedures documented).
What elements does NaCl contain?
Sodium chloride (NaCl) contains Cl and Na (2 elements).
Where does the data for NaCl come from?
NaCl data is cross-referenced from latticegraph.
Comparison

How It Compares

As one of the most extensively studied and structurally documented compounds in existence, sodium chloride serves as the primary benchmark for ionic solids. Its stability and predictable behavior provide the baseline against which other binary ionic materials are evaluated.

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

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