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Molecular dynamics simulations on formation of CO2 hydrate in the presence of metal particles

Ni Liu, Hanqi Zhu, Jiali Zhou, Liang Yang, Daoping Liu

2021Journal of Molecular Liquids35 citationsDOI

Topics & Concepts

HydrateMetalMass fractionNanoclustersMolecular dynamicsKineticsChemistryClathrate hydrateChemical engineeringMaterials scienceOrganic chemistryComputational chemistryQuantum mechanicsEngineeringPhysicsMethane Hydrates and Related PhenomenaSpacecraft and Cryogenic TechnologiesCO2 Sequestration and Geologic Interactions
Molecular dynamics simulations on formation of CO2 hydrate in the presence of metal particles | Litcius