BxCyNz hybrid graphenylene: stability and electronic properties-Reference-Cited by-同舟云学术

BxCyNz hybrid graphenylene: stability and electronic properties

Published:2018 Issue:44 Volume:8 Page:24847-24856
ISSN:2046-2069
Container-title:RSC Advances
language:en
Short-container-title:RSC Adv.

Author:

Freitas A.¹²³⁴^ORCID,Machado L. D.¹²³⁴^ORCID,Bezerra C. G.¹²³⁴,Tromer R. M.¹²³⁴,Pereira L. F. C.¹²³⁴^ORCID,Azevedo S.¹⁵⁶⁷⁴

Affiliation:

1. Departamento de Física

2. Universidade Federal do Rio Grande do Norte

3. Natal

4. Brazil

5. CCEN

6. Universidade Federal da Paraíba

7. João Pessoa

Abstract

We combine density functional theory and molecular dynamics to investigate the stability and electronic properties of 20 structures composed of boron, carbon, and nitrogen arranged in the pattern of the two-dimensional carbon allotrope graphenylene.

Funder

Conselho Nacional de Desenvolvimento Científico e Tecnológico

Coordenação de Aperfeiçoamento de Pessoal de Nível Superior

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2018/RA/C8RA02188K

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