Defect Healing during Single-Walled Carbon Nanotube Growth: A Density-Functional Tight-Binding Molecular Dynamics Investigation

2009 ◽  
Vol 113 (47) ◽  
pp. 20198-20207 ◽  
Author(s):  
Alister J. Page ◽  
Yasuhito Ohta ◽  
Yoshiko Okamoto ◽  
Stephan Irle ◽  
Keiji Morokuma
Keyword(s):  
Molecular Dynamics ◽  
Carbon Nanotube ◽  
Density Functional ◽  
Tight Binding ◽  
Single Walled Carbon Nanotube ◽  
Single Walled Carbon ◽  
Defect Healing ◽  
Carbon Nanotube Growth ◽  
Nanotube 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

Computational studies of catalyst-free single walled carbon nanotube growth

2013 ◽  
Vol 139 (5) ◽  
pp. 054308 ◽  
Author(s):  
S. Haghighatpanah ◽  
A. Mohsenzadeh ◽  
H. Amara ◽  
C. Bichara ◽  
K. Bolton
Keyword(s):  
Carbon Nanotube ◽  
Computational Studies ◽  
Single Walled Carbon Nanotube ◽  
Single Walled Carbon ◽  
Catalyst Free ◽  
Carbon Nanotube Growth ◽  
Nanotube Growth

scholarly journals The kinetics of chirality assignment in catalytic single-walled carbon nanotube growth and the routes towards selective growth

2018 ◽  
Vol 9 (11) ◽  
pp. 3056-3061 ◽  
Author(s):  
Ziwei Xu ◽  
Lu Qiu ◽  
Feng Ding
Keyword(s):  
Carbon Nanotube ◽  
Kinetic Modelling ◽  
Selective Growth ◽  
Single Walled Carbon Nanotube ◽  
Single Walled Carbon ◽  
Carbon Nanotube Growth ◽  
Chirality Control ◽  
Nanotube Growth ◽  
Kinetics Of

The routes towards carbon nanotube's chirality control during growth was revealed by kinetic modelling.

scholarly journals Fe Ti O based catalyst for large-chiral-angle single-walled carbon nanotube growth

Carbon ◽  
2016 ◽  
Vol 107 ◽  
pp. 865-871 ◽  
Author(s):  
Maoshuai He ◽  
Lili Zhang ◽  
Hua Jiang ◽  
He Yang ◽  
Frédéric Fossard ◽  
...  
Keyword(s):  
Carbon Nanotube ◽  
Chiral Angle ◽  
Single Walled Carbon Nanotube ◽  
Single Walled Carbon ◽  
Carbon Nanotube Growth ◽  
Nanotube Growth
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