Density functional based simulations of proton permeation of graphene and hexagonal boron nitride-Reference-Cited by-同舟云学术

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Density functional based simulations of proton permeation of graphene and hexagonal boron nitride

Published:2017 Issue:8 Volume:19 Page:5813-5817
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Kroes J. M. H.¹²³⁴,Fasolino A.¹²³⁴,Katsnelson M. I.¹²³⁴

Affiliation:

1. Radboud University

2. Institute for Molecules and Materials

3. 6525 AJ Nijmegen

4. The Netherlands

Abstract

Charging of an h-BN membrane by the presence of proton.

Funder

Stichting voor de Technische Wetenschappen

Horizon 2020

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2017/CP/C6CP08923B

Reference24 articles.

1. Proton transport through one-atom-thick crystals

2. Sieving hydrogen isotopes through two-dimensional crystals

3. The Deuterium Isotope Effect

4. Graphene hydrate: theoretical prediction of a new insulating form of graphene

5. First principles study of the permeability of graphene to hydrogen atoms

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1. DFT Analysis on the Separation Mechanism of Hydrogen Isotopes Through Graphene and Boron Nitride 2D Sheets;ACS Applied Nano Materials;2024-07-04

2. Control of proton transport and hydrogenation in double-gated graphene;Nature;2024-06-19

3. Electron and ion behaviors at the graphene/metal interface during the acidic water electrolysis;Chemical Physics Reviews;2023-12-01

4. Barrier Height Breakpoint in Employing the Arrhenius Equation to Proton Isotope Permeation through Stone–Wales Graphene;The Journal of Physical Chemistry Letters;2023-11-27

5. Proton and molecular permeation through the basal plane of monolayer graphene oxide;Nature Communications;2023-11-27

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