Many-body effects on the melting and dynamics of small clusters

Citation
E. Yurtsever et F. Calvo, Many-body effects on the melting and dynamics of small clusters, PHYS REV B, 62(15), 2000, pp. 9977-9980
Citations number
34
Categorie Soggetti
Apllied Physucs/Condensed Matter/Materiales Science
Journal title
PHYSICAL REVIEW B
ISSN journal
01631829 → ACNP
Volume
62
Issue
15
Year of publication
2000
Pages
9977 - 9980
Database
ISI
SICI code
0163-1829(20001015)62:15<9977:MEOTMA>2.0.ZU;2-6
Abstract
Using a potential recently proposed by Baskes [Phys. Rev. Lett. 83, 2592 (1 999)], we study the influence of the many-body interactions on the thermody namics and chaotic dynamics of small atomic clusters. With standard molecul ar dynamics simulations as well as parallel tempering Monte Carlo, we calcu late the complete heat capacity curves and the variations of the largest Ly apunov exponent with total energy. We observe that increasing the magnitude or decreasing the range of the many-body forces leads to an increase of ch aos and a decrease in the melting temperature. Decreasing the range of the many-body interactions also results in a significantly lower latent heat of melting.