Ab initio computational investigation of physisorption of molecular hydrogen on achiral single-walled carbon nanotubes

2005 ◽  
Vol 122 (21) ◽  
pp. 214724 ◽  
Author(s):  
A. Ferre-Vilaplana
Keyword(s):  
Carbon Nanotubes ◽  
Ab Initio ◽  
Molecular Hydrogen ◽  
Single Walled Carbon Nanotubes ◽  
Computational Investigation ◽  
Single Walled Carbon ◽  
Walled Carbon Nanotubes

Functionalization of silicon-doped single walled carbon nanotubes at the doping site: An ab initio study

2006 ◽  
Vol 358 (2) ◽  
pp. 166-170 ◽  
Author(s):  
Chen Song ◽  
Yueyuan Xia ◽  
Mingwen Zhao ◽  
Xiangdong Liu ◽  
Feng Li ◽  
...  
Keyword(s):  
Carbon Nanotubes ◽  
Ab Initio ◽  
Single Walled Carbon Nanotubes ◽  
Ab Initio Study ◽  
Single Walled Carbon ◽  
Silicon Doped ◽  
Walled Carbon Nanotubes
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