Size dependence of the dissociation process of spherical hydrate particles <i>via</i> microsecond molecular dynamics simulations
نویسندگان
چکیده
The dissociation process of spherical sII mixed methane–propane hydrate particles in liquid hydrocarbon was investigated via microsecond-long molecular dynamics simulations.
منابع مشابه
Molecular-dynamics simulations of methane hydrate dissociation.
Nonequilibrium molecular-dynamics simulations have been carried out at 276.65 K and 68 bar for the dissolution of spherical methane hydrate crystallites surrounded by a liquid phase. The liquid was composed of pure water or a water-methane mixture ranging in methane composition from 50% to 100% of the corresponding theoretical maximum for the hydrate and ranged in size from about 1600 to 2200 w...
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ژورنال
عنوان ژورنال: Physical Chemistry Chemical Physics
سال: 2021
ISSN: ['1463-9076', '1463-9084']
DOI: https://doi.org/10.1039/d1cp01223a