Macromolecules · 2001 · 30 citations · 15 references
Natural SciencesChemistryMaterials SciencePolymer ChemistrySurface ChemistrySurface ScienceAdsorption At InterfacesIntermolecular ForcesProtein AdsorptionSurface AdsorptionSurface ChargeSurface PhysicsAdsorbed Polymer ConformationConformation Of PolyelectrolytesElectrostatic InteractionsMean-field ApproximationMean-field ModelsSurface Adsorption SimulationSurface Charge DensitySurface Charge Effects
The adsorption of flexible polyampholytes to charged surfaces has been investigated. The electrostatic interactions are included in a mean-field manner, while the chain connectivity is treated by Metropolis Monte Carlo (MC) simulations. For large enough surface charge densities, adsorption is found both for neutral polyampholytes and for polyampholytes carrying the same net charge as the surfaces. The simulation results are used to check the reliability of previously proposed analytical theories. The exponents predicted in those scaling relations are not reproduced by MC simulations. The simulations show that the size of the adsorbed polyampholyte initially grows with increasing surface charge density, but for sufficiently charged surfaces it reaches a maximum and starts to decrease. This general behavior is qualitatively captured by scaling arguments. The MC simulations do not bear any evidence for the existence of three disparate regimes where the polyampholyte adsorbs in different conformations.
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Equation of State Calculations by Fast Computing Machines
N. Metropolis, Arianna W. Rosenbluth, M. N. Rosenbluth et al. · The Journal of Chemical Physics · 1953 · 37.1K citations
Computer Simulation of Liquids
S. P, K. J · Journal of Molecular Liquids · 1988 · 15.9K citations
Random and Alternating Polyampholytes
Joachim Wittmer, A. Johner, J.-F. Joanny · Europhysics Letters (EPL) · 1993 · 129 citations