A theoretical study of functionalized single-wall carbon nanotubes: ONIOM calculations

2004 ◽  
Vol 392 (1-3) ◽  
pp. 176-180 ◽  
Author(s):  
Tapas Kar ◽  
Brahim Akdim ◽  
Xiaofeng Duan ◽  
Ruth Pachter
Keyword(s):  
Carbon Nanotubes ◽  
Theoretical Study ◽  
Single Wall Carbon Nanotubes ◽  
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Solubility of functionalized single-wall carbon nanotubes in water: a theoretical study

2017 ◽  
Vol 136 (11) ◽  
Author(s):  
Erik Díaz-Cervantes ◽  
Marco A. García-Revilla ◽  
Juvencio Robles ◽  
Faustino Aguilera-Granja
Keyword(s):  
Carbon Nanotubes ◽  
Theoretical Study ◽  
Single Wall Carbon Nanotubes ◽  
Single Wall Carbon

Hydrogenation of Single-Wall Carbon Nanotubes Using Polyamine Reagents:  Combined Experimental and Theoretical Study

2008 ◽  
Vol 130 (7) ◽  
pp. 2296-2303 ◽  
Author(s):  
Glen P. Miller ◽  
Jeremy Kintigh ◽  
Eunja Kim ◽  
Philippe F. Weck ◽  
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...  
Keyword(s):  
Carbon Nanotubes ◽  
Theoretical Study ◽  
Single Wall Carbon Nanotubes ◽  
Single Wall Carbon
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