Investigation of the influence factors of polyethylene molecule encapsulated into carbon nanotubes by molecular dynamics simulation

2011 ◽  
Vol 257 (23) ◽  
pp. 10022-10030 ◽  
Author(s):  
Qun Li ◽  
Guofang He ◽  
Rengao Zhao ◽  
Yanfei Li
Keyword(s):  
Carbon Nanotubes ◽  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Influence Factors ◽  
Dynamics Simulation ◽  
Polyethylene Molecule

scholarly journals Molecular dynamics simulation of the evaporation of the surface wall of multi-wall carbon nanotubes at high temperature

2010 ◽  
Vol 59 (4) ◽  
pp. 2672
Author(s):  
Wang Wei ◽  
Zhang Kai-Wang ◽  
Meng Li-Jun ◽  
Li Zhong-Qiu ◽  
Zuo Xue-Yun ◽  
...  
Keyword(s):  
Carbon Nanotubes ◽  
Molecular Dynamics ◽  
High Temperature ◽  
Molecular Dynamics Simulation ◽  
Dynamics Simulation ◽  
Multi Wall Carbon Nanotubes

Understanding enzymatic degradation of single-walled carbon nanotubes triggered by functionalization using molecular dynamics simulation

2017 ◽  
Vol 4 (3) ◽  
pp. 720-727 ◽  
Author(s):  
Ming Chen ◽  
Guangming Zeng ◽  
Piao Xu ◽  
Yi Zhang ◽  
Danni Jiang ◽  
...  
Keyword(s):  
Carbon Nanotubes ◽  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Horseradish Peroxidase ◽  
Enzymatic Degradation ◽  
Single Walled Carbon Nanotubes ◽  
Dynamics Simulation ◽  
Single Walled Carbon ◽  
Degrading Enzymes ◽  
Walled Carbon Nanotubes

Interactions of SWCNTs with their degrading enzymes (horseradish peroxidase and lactoperoxidase) during biodegradation.

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