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Liquid–vapor interface of water–methanol mixture. I. Computer simulation (1993)

Matsumoto, Mitsuhiro ; Takaoka, Yuji ; Kataoka, Yosuke

College Park, Md. : American Institute of Physics (AIP)

The Journal of Chemical Physics 98 (1993), S. 1464-1472

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ISSN: 1089-7690

Source: AIP Digital Archive

Topics: Physics , Chemistry and Pharmacology

Notes: Results of molecular dynamics computer simulation are presented for liquid–vapor interface of water–methanol mixture of various compositions at room temperature. The composition dependence of calculated surface tension is typical of aqueous solutions of organic compounds. The outermost surface layer is saturated with methanol even at low bulk concentrations of methanol. The density profile of each component seems oscillatory at some compositions.

Type of Medium: Electronic Resource

URL: http://dx.doi.org/10.1063/1.464310

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