Mechanisms of Single-Walled Carbon Nanotube Nucleation, Growth, and Healing Determined Using QM/MD Methods

2010 ◽  
Vol 43 (10) ◽  
pp. 1375-1385 ◽  
Author(s):  
Alister J. Page ◽  
Yasuhito Ohta ◽  
Stephan Irle ◽  
Keiji Morokuma
Keyword(s):  
Carbon Nanotube ◽  
Single Walled Carbon Nanotube ◽  
Single Walled Carbon ◽  
Nucleation Growth

scholarly journals A semi-grand canonical kinetic Monte Carlo study of single-walled carbon nanotube growth

AIP Advances ◽  
2021 ◽  
Vol 11 (4) ◽  
pp. 045306
Author(s):  
Georg Daniel Förster ◽  
Thomas D. Swinburne ◽  
Hua Jiang ◽  
Esko Kauppinen ◽  
Christophe Bichara
Keyword(s):  
Monte Carlo ◽  
Carbon Nanotube ◽  
Kinetic Monte Carlo ◽  
Monte Carlo Study ◽  
Single Walled Carbon Nanotube ◽  
Single Walled Carbon ◽  
Carbon Nanotube Growth ◽  
Nanotube Growth ◽  
Grand Canonical

scholarly journals Tuning spin–orbit coupling in (6,5) single-walled carbon nanotube doped with sp3 defects

2021 ◽  
Vol 129 (1) ◽  
pp. 014309
Author(s):  
Kasidet Jing Trerayapiwat ◽  
Sven Lohmann ◽  
Xuedan Ma ◽  
Sahar Sharifzadeh
Keyword(s):  
Carbon Nanotube ◽  
Orbit Coupling ◽  
Spin Orbit Coupling ◽  
Spin Orbit ◽  
Single Walled Carbon Nanotube ◽  
Single Walled Carbon
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