Resonance-Induced Reduction of Interfacial Tension of Water-Methane and Improvement of Methane Solubility in Water.

Langmuir : the ACS journal of surfaces and colloids(2022)

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摘要
Molecular dynamics simulations were performed to study the effect of the periodic oscillating electric field on the interface between water and methane. We propose a new strategy that utilizes oscillating electric fields to reduce the interfacial tension (IFT) between water and methane and increase the solubility of methane in water simultaneously. These are attributed to the hydrogen bond resonance induced by an electric field with a frequency close to the natural frequency of the hydrogen bond. The resonance breaks the hydrogen bond network among water molecules to the maximum, which destroys the hydration shell and reduces the cohesive action of water, thus resulting in the decrease of IFT and the increase of methane solubility. As the frequency of the electric field is close to the optimum resonant frequency of hydrogen bonds, IFT decreases from 56.43 to 5.66 mN/m; water and methane are miscible because the solubility parameter of water reduces from 47.63 to 2.85 MPa, which is close to that of methane (3.43 MPa). Our results provide a new idea for reducing the water-gas IFT and improving the solubility of insoluble gas in water and theoretical guidance in the fields of natural gas exploitation, hydrate generation, and nanobubble nucleation.
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