Title of article
Density-functional tight-binding molecular dynamics simulations of SWCNT growth by surface carbon diffusion on an iron cluster Original Research Article
Author/Authors
Yasuhito Ohta، نويسنده , , Yoshiko Okamoto، نويسنده , , Stephan Irle، نويسنده , , Keiji Morokuma، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2009
Pages
6
From page
1270
To page
1275
Abstract
Iron-catalyzed SWCNT growth by carbon diffusion starting from a carbon cap has been demonstrated in density-functional tight-binding molecular dynamics simulations. A C40 (5,5) SWCNT cap attached to an Fe38 cluster was employed as initial model system. Af
Journal title
Carbon
Serial Year
2009
Journal title
Carbon
Record number
1126046
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