Phase-Field Crystal Model for Fe Connected to MEAM Molecular Dynamics Simulations

JOM ◽  
2014 ◽  
Vol 66 (3) ◽  
pp. 429-436 ◽  
Author(s):  
Ebrahim Asadi ◽  
Mohsen Asle Zaeem ◽  
Michael I. Baskes
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Phase Field ◽  
Crystal Model ◽  
Dynamics Simulations ◽  
Phase Field Crystal

scholarly journals Heat transport in pristine and polycrystalline single-layer hexagonal boron nitride

2018 ◽  
Vol 20 (38) ◽  
pp. 24602-24612 ◽  
Author(s):  
Haikuan Dong ◽  
Petri Hirvonen ◽  
Zheyong Fan ◽  
Tapio Ala-Nissila
Keyword(s):  
Molecular Dynamics ◽  
Boron Nitride ◽  
Molecular Dynamics Simulations ◽  
Heat Transport ◽  
Phase Field ◽  
Large Scale ◽  
Hexagonal Boron Nitride ◽  
Single Layer ◽  
Crystal Model ◽  
Dynamics Simulations

Unusual thermal transport in polycrystalline h-BN prepared by phase field crystal model is revealed by large-scale molecular dynamics simulations.

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