scholarly journals Comment on “A nonequilibrium molecular-dynamics method for thermal conductivities based on thermal noise” [J. Chem. Phys. 122, 081103 (2005)]

2005 ◽  
Vol 123 (21) ◽  
pp. 217101 ◽  
Author(s):  
Takamichi Terao ◽  
Florian Müller-Plathe
Keyword(s):  
Molecular Dynamics ◽  
Thermal Noise ◽  
Chem Phys ◽  
Molecular Dynamics Method ◽  
Nonequilibrium Molecular Dynamics ◽  
Dynamics Method ◽  
Thermal Conductivities

scholarly journals Tunable thermal conductivities of graphene and graphyne under in-plane torsion

RSC Advances ◽  
2017 ◽  
Vol 7 (86) ◽  
pp. 54734-54740 ◽  
Author(s):  
Yinfeng Li ◽  
Qianling Lin ◽  
Ye Li ◽  
Daxiang Cui
Keyword(s):  
Molecular Dynamics ◽  
Surface Morphology ◽  
Molecular Dynamics Method ◽  
Non Equilibrium Molecular Dynamics ◽  
Dynamics Method ◽  
Non Equilibrium ◽  
Thermal Conductivities

Thermal conductivities of graphene and graphyne are revealed to be tunable under in-plane circular rotations caused by the evolution of surface morphology using non-equilibrium molecular dynamics method.

Molecular Dynamics Simulation of Thermal Conductivity of 3C-SiC Nanowire

2013 ◽  
Vol 800 ◽  
pp. 210-212
Author(s):  
Zan Wang ◽  
Hong Chao Cao ◽  
Hua Wei Guan
Keyword(s):  
Thermal Conductivity ◽  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Important Application ◽  
Molecular Dynamics Method ◽  
Dynamics Simulation ◽  
Nonequilibrium Molecular Dynamics ◽  
Third Generation ◽  
Different Temperatures ◽  
Dynamics Method

SiC is one of the most important third-generation semiconductors, which has important application value. Based on the nonequilibrium Molecular Dynamics method, a model of 3C-SiC nanowire is proposed, and thermal transport under different temperatures is investigated. The results show about 200K the thermal conductivity of 3C-SiC nanowire approaches to the peak 7.84W/m.K.

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