Phase behavior of ionic microgels.

نویسندگان

  • D Gottwald
  • C N Likos
  • G Kahl
  • H Löwen
چکیده

We employ effective interaction potentials between spherical polyelectrolyte microgels in order to investigate theoretically the structure, thermodynamics, and phase behavior of ionic microgel solutions. Combining a genetic algorithm with accurate free energy calculations we are able to perform an unrestricted search of candidate crystal structures. Hexagonal, body-centered orthogonal, and trigonal crystals are found to be stable at high concentrations and charges of the microgels, accompanied by reentrant melting behavior and fluid-fcc-bcc transitions below the overlap concentration.

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عنوان ژورنال:
  • Physical review letters

دوره 92 6  شماره 

صفحات  -

تاریخ انتشار 2004