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Classical molecular dynamics for the formation process of a fullerene molecule

✍ Scribed by Satoshi Makino; Tatsuki Oda; Yasuaki Hiwatari


Book ID
108357555
Publisher
Elsevier Science
Year
1997
Tongue
English
Weight
448 KB
Volume
58
Category
Article
ISSN
0022-3697

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A molecular dynamics study of ring forma
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In this exploratory study, the methods of molecular dynamics and Brownian dynamics have been used to investigate the dynamics of ring formation in a simple, idealised, flexible molecule. Particular attention has been paid to the formation and persistence of the bond responsible for ring closure. The