Enormous progress has been made in high-pressure research over the last decades in both,
experiments and computer simulations, many challenges still remain. This is evidenced by …

One of the several possibilities offered by the interesting clathrate hydrates is the opportunity
to encapsulate several atoms or molecules, in such a way that more efficient storage …

The dynamics of the formation of a specific clathrate hydrate as well as its thermodynamic
transitions depend on the interactions between the trapped molecules and the host water …

Classical Monte Carlo simulations in the isothermal–isobaric ensemble have been
performed for the Hg13 cluster with the main emphasis paid to structural changes in this …

Abstract Parallel-tempering Monte Carlo calculations have been performed for the Hg 8
cluster in an isothermal-isobaric ensemble. Temperature and pressure dependent cluster …