Lattice thermal conductivity of monolayer AsP from first-principles molecular dynamics-Reference-Cited by-同舟云学术

Lattice thermal conductivity of monolayer AsP from first-principles molecular dynamics

Published:2018 Issue:20 Volume:20 Page:14024-14030
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Sun Yajing¹²³⁴⁵^ORCID,Shuai Zhigang¹²³⁴⁵^ORCID,Wang Dong¹²³⁴⁵^ORCID

Affiliation:

1. MOE Key Laboratory of Organic Opto Electronics and Molecular Engineering

2. Department of Chemistry

3. Tsinghua University

4. Beijing 100084

5. P. R. China

Abstract

Our first-principles molecular dynamics simulation demonstrates that puckered AsP monolayer has reduced thermal conductivity and increased anisotropy as compared to black phosphorene.

Funder

National Natural Science Foundation of China

Ministry of Science and Technology of the People's Republic of China

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2018/CP/C8CP01840E

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