Controlling hydrogen release from remaining-intact Clathrate hydrates by electromagnetic fields: molecular engineering <i>via</i> microsecond non-equilibrium molecular dynamics

Krishnan, Yogeshwaran; Rosingana, Patricia Gomez; Ghaani, Mohammad Reza; English, Niall J.

doi:10.1039/d1ra07471g

RSC Adv.

2022

DOI: 10.1039/d1ra07471g

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Controlling hydrogen release from remaining-intact Clathrate hydrates by electromagnetic fields: molecular engineering via microsecond non-equilibrium molecular dynamics

Yogeshwaran Krishnan

Patricia Gomez Rosingana

Mohammad Reza Ghaani

et al.

Abstract: Microsecond-long non-equilibrium molecular-dynamics simulation reveals that externally-applied electric fields (both static and alternating) manipulate and accelerate the H2-escape process from gas hydrates.

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Cited by 6 publications

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Controlling hydrogen release from remaining-intact Clathrate hydrates by electromagnetic fields: molecular engineering via microsecond non-equilibrium molecular dynamics

Abstract: Microsecond-long non-equilibrium molecular-dynamics simulation reveals that externally-applied electric fields (both static and alternating) manipulate and accelerate the H2-escape process from gas hydrates.

Cited by 6 publications

References 35 publications

Electric field induced release of guest molecules from clathrate hydrates and its consequences for electrochemical CO2 conversion

Electric field induced release of guest molecules from clathrate hydrates and its consequences for electrochemical CO2 conversion

Molecular dynamics simulation study of the cosine oscillation electric field's effect on methane hydrate growth

Three phase equilibria of the methane hydrate in NaCl solutions: A simulation study

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