Data di Pubblicazione:
2007
Abstract:
We have performed extensive computer simulations of the thermodynamic
and structural properties of the krypton rare gas modeled by the modified Buckingham
exponential-6 interatomic potential. Using a new set of potential parameters, we have
found a good agreement with the room temperature equation of state at very high pressure
obtained by diamond anvil cell experiments. Moreover, the melting line of the model has
been estimated through the Lindemann criterion; the agreement with the low-pressure experiments
is excellent, whereas at higher pressure, the model poorly reproduces the typical
softening of the experimental melting curve.
Tipologia CRIS:
01.01 Articolo in rivista
Elenco autori:
Saija, Franz
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