Surface Tension_ Molecular Dynamics?

06 April 2023 0 4K Report

Hi Everyone,

I'm trying to calculate the surface tension tail correction in Molecular Dynamics. Is there a method to integrate the equation suggested by Chapela et. al (Article Computer simulation of a gas-liquid surface. Part 1

) to program it in our own code?

Any suggestions would be greatly appreciated.

Thanks in advance for your time.

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