Theoretical study of the interaction between molecular hydrogen and [MC60]+ complexes-Reference-Cited by-同舟云学术

Theoretical study of the interaction between molecular hydrogen and [MC60]+ complexes

Published:2016 Issue:33 Volume:6 Page:27447-27451
ISSN:2046-2069
Container-title:RSC Advances
language:en
Short-container-title:RSC Adv.

Author:

Robledo Maitreyi¹²³⁴,Díaz-Tendero Sergio¹²³⁴⁵,Martín Fernando¹²³⁴⁶,Alcamí Manuel¹²³⁴⁶

Affiliation:

1. Departamento de Química, Módulo 13

2. Universidad Autónoma de Madrid

3. 28049 Madrid

4. Spain

5. Condensed Matter Physics Center (IFIMAC)

6. Instituto Madrileño de Estudios Avanzados en Nanociencias (IMDEA_Nanociencia)

Abstract

In this work we present a density functional theory study of the interaction between a positively charged exohedral metallofullerene and several hydrogen molecules.

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2016/RA/C6RA00501B

Reference34 articles.

1. Analytical and experimental evaluation of insulated pressure vessels for cryogenic hydrogen storage

2. Chemical hydrides: A solution to high capacity hydrogen storage and supply

3. The Chemistry and Applications of Metal-Organic Frameworks

4. Selective gas adsorption and separation in metal–organic frameworks

5. Titanium-Decorated Carbon Nanotubes as a Potential High-Capacity Hydrogen Storage Medium

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1. The electronic properties, stability and catalytic activity of metallofullerene (M@C60) for robust hydrogen evolution reaction: DFT insights;International Journal of Hydrogen Energy;2024-01

2. Metallofullerenes as Robust Single-Atom Catalysts for Adsorption and Dissociation of Hydrogen Molecules: A Density Functional Study;ACS Omega;2023-09-18

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4. Li-decorated carbyne for hydrogen storage: charge induced polarization and van't Hoff hydrogen desorption temperature;Sustainable Energy & Fuels;2020

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