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The existence of a plastic phase and a solid–liquid dynamical bistability region in small fullerene cluster (C 60 ) 7 : molecular dynamics simulation

✍ Scribed by Piatek, A; Dawid, A; Gburski, Z


Book ID
120458884
Publisher
Institute of Physics
Year
2006
Tongue
English
Weight
483 KB
Volume
18
Category
Article
ISSN
0953-8984

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Molecular dynamics (MD) simulation study
✍ A. Piątek; A. Dawid; Z. Dendzik; Z. Gburski 📂 Article 📅 2006 🏛 Elsevier Science 🌐 English ⚖ 334 KB

We have simulated (MD method) the dynamics of fullerenes (C 60 ) in extremely small cluster composed of only seven C 60 molecules. The interaction is taken to be the full 60-site pairwise additive Lennard-Jones (LJ) potential, which generates both translational and anisotropic rotational motions of