Role of Basic Surface Groups of Activated Carbon in Chlordecone and β-Hexachlorocyclohexane Adsorption: A Molecular Modelling Study

The influence of nitrogen-containing surface groups (SGs) onto activated carbon (AC) over the adsorption of chlordecone (CLD) and β-hexachlorocyclohexane (β-HCH) was characterized by a molecular modelling study, considering pH (single protonated SGs) and hydration effect (up to three water molecules...

Full description

Saved in:
Bibliographic Details
Main Authors: Kenia Melchor-Rodríguez, Chayan Carmenate-Rodríguez, Anthuan Ferino-Pérez, Sarra Gaspard, Ulises J. Jáuregui-Haza
Format: article
Language:EN
Published: MDPI AG 2021
Subjects:
Online Access:https://doaj.org/article/261a99de62c14364bbbfcfc10bab3925
Tags: Add Tag
No Tags, Be the first to tag this record!