NanoCap: A framework for generating capped carbon nanotubes and fullerenes
NanoCap provides both libraries and a standalone application for the construction of capped nanotubes of arbitrary chirality and fullerenes of any radius. Structures are generated by constructing a set of optimal dual graph topologies which are subsequently optimised using a carbon interatomic poten...
| Main Authors: | , |
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| Format: | Journal Article |
| Published: |
Elsevier BV
2014
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| Subjects: | |
| Online Access: | http://hdl.handle.net/20.500.11937/39633 |
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