Molecular Dynamics Simulations of Cross-Linked Phenolic Resins Using a United-Atom Model

2018 ◽  
Vol 27 (4) ◽  
pp. 1700103 ◽  
Author(s):  
Atsushi Izumi ◽  
Yasuyuki Shudo ◽  
Katsumi Hagita ◽  
Mitsuhiro Shibayama
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Phenolic Resins ◽  
Atom Model ◽  
Dynamics Simulations

Diffusion Behavior of Methanol Molecules Confined in Cross-Linked Phenolic Resins Studied Using Neutron Scattering and Molecular Dynamics Simulations

2018 ◽  
Vol 51 (16) ◽  
pp. 6334-6343 ◽  
Author(s):  
Yasuyuki Shudo ◽  
Atsushi Izumi ◽  
Katsumi Hagita ◽  
Takeshi Yamada ◽  
Kaoru Shibata ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Neutron Scattering ◽  
Molecular Dynamics Simulations ◽  
Phenolic Resins ◽  
Diffusion Behavior ◽  
Dynamics Simulations

scholarly journals All-Atom Model of Atactic 2-Vinyl Pyridine Polymer: Structural Properties Investigation by Molecular Dynamics Simulations

2019 ◽  
Vol 166 (9) ◽  
pp. B3309-B3315 ◽  
Author(s):  
Stefano Caputo ◽  
Antonio De Nicola ◽  
Greta Donati ◽  
Alessio David ◽  
Guido Raos ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Structural Properties ◽  
Atom Model ◽  
Vinyl Pyridine ◽  
Dynamics Simulations
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