Structural stability and growth mechanism of neutral and anionic small carbon clusters: Density functional study

2017 ◽  
Vol 1102 ◽  
pp. 105-113 ◽  
Author(s):  
A.C. Ngandjong ◽  
J.Z. Mezei ◽  
J. Mougenot ◽  
A. Michau ◽  
K. Hassouni ◽  
...  
Keyword(s):  
Structural Stability ◽  
Growth Mechanism ◽  
Density Functional ◽  
Functional Study ◽  
Carbon Clusters ◽  
Density Functional Study

Thermal behavior of Si-doped fullerenes vs their structural stability at T=0K: A density functional study

2011 ◽  
Vol 510 (1-3) ◽  
pp. 14-17 ◽  
Author(s):  
Roberto Scipioni ◽  
Masahiko Matsubara ◽  
Eliseo Ruiz ◽  
Carlo Massobrio ◽  
Mauro Boero
Keyword(s):  
Thermal Behavior ◽  
Structural Stability ◽  
Density Functional ◽  
Functional Study ◽  
Density Functional Study ◽  
Doped Fullerenes ◽  
Si Doped

A density functional study on nitrogen-doped carbon clusters CnN3− (n=1–8)

2004 ◽  
Vol 121 (23) ◽  
pp. 11661-11667 ◽  
Author(s):  
Mingdan Chen ◽  
Jianwen Liu ◽  
Li Dang ◽  
Qianer Zhang ◽  
C. T. Au
Keyword(s):  
Density Functional ◽  
Functional Study ◽  
Carbon Clusters ◽  
Density Functional Study ◽  
Nitrogen Doped ◽  
Nitrogen Doped Carbon
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