Thermal transport properties of single-layer black phosphorus from extensive molecular dynamics simulations

We compute the anisotropic in-plane thermal conductivity of suspended single-layer black phosphorus (SLBP) using three molecular dynamics (MD) based methods, including the equilibrium MD method, the nonequilibrium MD (NEMD) method, and the homogeneous NEMD (HNEMD) method. Two existing parameterizati...

Full description

Saved in:
Bibliographic Details
Main Authors: Ke Xu, Zheyong Fan, Jicheng Zhang, Ning Wei, Tapio Ala-Nissila
Format: Default Article
Published: 2018
Subjects:
Other mathematical sciences not elsewhere classified
Thermal conductivity
Black phosphorus
Molecular dynamics
Mathematical Sciences not elsewhere classified
Online Access:https://hdl.handle.net/2134/36237
Tags: Add Tag
No Tags, Be the first to tag this record!

Internet

https://hdl.handle.net/2134/36237

Similar Items