Theoretical insight into hydrogen adsorption onto graphene: a first-principles B3LYP-D3 study-Reference-Cited by-同舟云学术

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Theoretical insight into hydrogen adsorption onto graphene: a first-principles B3LYP-D3 study

Published:2015 Issue:4 Volume:17 Page:2504-2511
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Darvish Ganji M.¹²³⁴⁵,Hosseini-khah S. M.⁶⁷⁸⁵,Amini-tabar Z.⁹¹⁰¹¹⁵

Affiliation:

1. Nanoscale Simulation Group

2. Nanotechnology Research Institute

3. Babol Noshirvani University of Technology

4. Babol

5. Iran

6. School of Chemistry

7. Damghan University

8. Damghan

9. Department of Chemistry

10. Islamic Azad University

11. Qaemshahr

Abstract

This work investigates hydrogen adsorption onto graphene flakes as suitable models of graphene within the framework of the B3LYP-D3 method.

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2015/CP/C4CP04399E

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3. Water Splitting Goes Au Naturel

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5. Tailoring of Nanoscale Porosity in Carbide-Derived Carbons for Hydrogen Storage

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