Abstract
We defined the topological charge and bump number for fullerenes. All even fullerene isomers from C_{20} up to C_{70} were constructed. After optimizing the geometry of the molecules the relation between the topological charge, the bump number and the atomization energy were analysed.
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Disclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.