Critical endpoint and analytical diagram of attractive hard-core Yukawa spheres.

R. Tuinier, G.J. Fleer

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    31 Citations (Scopus)


    We analytically calculate the gas-liquid critical endpoint (cep) for hard spheres with a Yukawa attraction. This cep is a boundary condition for the existence of a liquid. We use an analytical Helmholtz energy expression for the attractive Yukawa (hard) spheres based on the first-order mean spherical approximation to the attractive Yukawa potential by Tang and Lu (J. Chem. Phys. 1993, 99, 9828). This theory and our analytical simplification of it predict the gas-liquid and fluid-solid phase behavior, as found from computer simulations, very accurately as long as the range 1/¿ of attraction is not too short. We find that the cep is situated at ¿¿ ¿ 6 and at a contact potential around 2 kT. It follows that a liquid state is only possible when the attraction range is longer than 1/6 of the particle diameter ¿, and the attraction strength is smaller than 2 kT. The liquid region does not span more than 0.6 kT in strength, and there is also a relatively narrow window for the attraction range
    Original languageEnglish
    Pages (from-to)20540-20545
    JournalThe Journal of Physical Chemistry Part B: Condensed Matter, Materials, Surfaces, Interfaces & Biophysical
    Issue number41
    Publication statusPublished - 2006


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