In this review, the intriguing properties of clathrate hydrates shall be discussed, as well as
their environmental impact and prospects for energy exploitation in industry. In particular, the …

Thermodynamic conditions suggest that clathrates might exist on Mars. Despite
observations which show that the dominant condensed phases on the surface of Mars are …

In addressing the global demand for clean and renewable energy, hydrogen stands out as
the most suitable candidate for many fuel applications that require practical and efficient …

We report the three-phase (hydrate–liquid water–vapor) equilibrium conditions of the
hydrogen–water binary system calculated with molecular dynamics simulations via the direct …

Methane hydrates with the three clathrate structures I, II, and H are studied by quantum-
chemical methods. Hybrid density-functional theory B3LYP computations using periodic …

In this contribution, a method based on a solid solution theory of clathrate hydrate for
multiple cage occupancy, host lattice relaxation, and guest-guest interactions is presented to …

Classical equilibrium molecular dynamics simulations have been performed to investigate
the diffusive properties of inter-cage hydrogen migration in both pure hydrogen and mixed …

The role of guest–guest and guest–host interactions has been studied in the case of butane-
based hydrates. It has been shown that these interactions are different for n-butane and iso …

Ozone storage capacity in clathrate hydrates formed from gas mixtures of O3+ O2+ N2+ CO2
was studied. It was found that in such system the amount of ozone included in the hydrate …

The thermodynamic properties of the hydrogen clathrate hydrate with cubic structure II and
hexagonal ice I h have been investigated using both lattice dynamics and molecular …