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- W80255050 abstract "A Monte Carlo simulation of an isolated polyelectrolyte chain in the presence of its counter ions without added salt is reported. Configurational properties such as the mean square end‐to‐end distance 〈R2N〉, the mean square radius of gyration 〈S2N〉, and the mean reduced electrostatic energy 〈UNI/NIkT〉, were studied as a function of the ionic strength of the solution, C; and the % charge of the chain. System behavior is classified into three regions: I: κ−1≪〈S2N〉1/2; II: κ−1∼1/2<S2N〉1/2; III: κ−1≫〈S2N 〉1/2, where κ−1 is the Debye–Hückel radius describing the scale of order of interionic interactions. In region I, the polyelectrolyte behaves configurationally as a random coil and the system is describable electrically as a simple electrolyte. In region II, the polyelectrolyte undergoes a conformational transition and the system electrically deviates notably from simple electrolyte behavior. In region III, the polyelectrolyte behaves configurationally as a rod and the system is characterized electrically by 〈UNI/NIkT〉≳0." @default.
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- W80255050 date "1984-01-15" @default.
- W80255050 modified "2023-10-18" @default.
- W80255050 title "Monte Carlo study of polyelectrolyte behavior. II." @default.
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