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 …

Clathrate hydrates are encountered in a number of important industrial applications.
Therefore, their structural, transport, thermodynamic and kinetic properties are essential for …

Clathrate hydrates are vital in energy research and environmental applications.
Understanding their stability is crucial for harnessing their potential. In this work, we employ …

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 present molecular dynamics simulation evidence of spontaneous formation of quasi-one-
dimensional (Q1D) hydrogen gas hydrates within single-walled carbon nanotubes (SW …

Molecular dynamics simulation is used to study the dissociation behavior of methane
hydrate with different composition in a three-phase coexistence of liquid water+ hydrate+ …

A new ice polymorph, called ice XVI, has recently been discovered experimentally by
extracting the guest molecules from Ne hydrate. The ice and its filled form (clathrate hydrate) …

We present a method that brings prediction of phase behaviors of various clathrate hydrates
with firm statistical mechanical ground adopting a different reference state from the usual …

Recently it was shown that CO 2-filled ice is formed upon compression of CO 2-clathrate
hydrate. Here we show two alternative routes of its formation, namely, by decompression of …

Grandcanonical Monte Carlo simulations are performed in order to examine the cage
occupancies of carbon dioxide clathrate hydrate in both the larger and the smaller cages …