Doped penta-graphene and hydrogenation of its related structures: a structural and electronic DFT-D study-Reference-Cited by-同舟云学术

Doped penta-graphene and hydrogenation of its related structures: a structural and electronic DFT-D study

Published:2016 Issue:23 Volume:18 Page:15505-15509
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Quijano-Briones J. J.¹²³⁴,Fernández-Escamilla H. N.¹²³⁴,Tlahuice-Flores A.¹²³⁴

Affiliation:

1. CICFIM-Facultad de Ciencias Físico-Matemáticas

2. Universidad Autónoma de Nuevo León

3. San Nicolás de los Garza

4. Mexico

Abstract

We carried out a dispersion-corrected density functional theory (DFT-D) study of penta-C doped with Si, Ge and Sn atoms and its related hydrogenated penta-C structures (H–penta-C–X).

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2016/CP/C6CP02781D

Reference48 articles.

1. Electric Field Effect in Atomically Thin Carbon Films

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