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Calculation of surface tension via area sampling.

The Journal of chemical physics, no. 17 (2007): 174709-174709

Cited by: 109|Views7
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Abstract

We examine the performance of several molecular simulation techniques aimed at evaluation of the surface tension through its thermodynamic definition. For all methods explored, the surface tension is calculated by approximating the change in Helmholtz free energy associated with a change in interfacial area through simulation of a liquid ...More

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