ReaxFF molecular dynamics of graphene oxide/NaCl aqueous solution interfaces-Reference-Cited by-同舟云学术

ReaxFF molecular dynamics of graphene oxide/NaCl aqueous solution interfaces

Published:2024 Issue: Volume: Page:
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Akbarzadeh Rokhsareh¹^ORCID,Předota Milan¹^ORCID

Affiliation:

1. Department of Physics, Faculty of Science, University of South Bohemia, Branišovská 1760, 370 05 České Budějovice, Czech Republic

Abstract

Structural and dynamical properties of graphene (G), graphene oxide (GO), and graphite oxide (GTO) interfaces with NaCl aqueous solution: functional groups, radial distribution functions, density profiles and diffusivities of water and ions.

Funder

Grantová Agentura České Republiky

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2024/CP/D3CP04735K

Reference52 articles.

1. Capacitive Deionization of Saline Water by Using MoS2–Graphene Hybrid Electrodes with High Volumetric Adsorption Capacity

2. Desalination Using the Capacitive Deionization Technology with Graphite/AC Electrodes: Effect of the Flow Rate and Electrode Thickness

3. Exploring fast water permeation through aquaporin-mimicking membranes

4. Molecular Dynamics Simulation of Water Transport Mechanisms through Nanoporous Boron Nitride and Graphene Multilayers

5. Tunable Graphene Systems for Water Desalination

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