Vibrational and Electronic Structure Analysis of a Carbon Dioxide Interaction with Functionalized Single-Walled Carbon Nanotubes

2013 ◽  
Vol 117 (13) ◽  
pp. 2854-2861 ◽  
Author(s):  
Edson Nunes Costa Paura ◽  
Wiliam F. da Cunha ◽  
Pedro H. de Oliveira Neto ◽  
Geraldo M. e Silva ◽  
Joao B. L. Martins ◽  
...  
Keyword(s):  
Carbon Dioxide ◽  
Carbon Nanotubes ◽  
Electronic Structure ◽  
Structure Analysis ◽  
Single Walled Carbon Nanotubes ◽  
Single Walled Carbon ◽  
Walled Carbon Nanotubes

scholarly journals From cyclic nanorings to single-walled carbon nanotubes: disclosing the evolution of their electronic structure with the help of theoretical methods

2019 ◽  
Vol 21 (5) ◽  
pp. 2547-2557 ◽  
Author(s):  
A. Pérez-Guardiola ◽  
R. Ortiz-Cano ◽  
M. E. Sandoval-Salinas ◽  
J. Fernández-Rossier ◽  
D. Casanova ◽  
...  
Keyword(s):  
Carbon Nanotubes ◽  
Electronic Structure ◽  
Finite Size ◽  
Single Walled Carbon Nanotubes ◽  
Electronic Effects ◽  
Theoretical Methods ◽  
Single Walled Carbon ◽  
Walled Carbon Nanotubes

We systematically investigate the relationships between structural and electronic effects of finite size zigzag or armchair carbon nanotubes of various diameters and lengths, starting from a molecular template of varying shape and diameter.

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