Instituto de Física, Universidade Federal do Rio Grande do Sul, Caixa Postal 15051, CEP 91501-970 Porto Alegre, RS, Brazil.
J Chem Phys. 2010 Mar 14;132(10):104105. doi: 10.1063/1.3354120.
A theory is proposed which allows us to self-consistently calculate the effective colloidal charge and the counterion and coion density profiles in suspensions containing both multivalent and monovalent electrolytes. The formation of counterion-coion clusters is explicitly taken into account. The theory predicts that sufficiently strongly charged colloidal particles will become overcharged. The addition of monovalent electrolyte decreases the counterion condensation and diminishes the amount of charge reversal. Predictions of the theory are compared with the Monte Carlo simulations and are found to be in excellent agreement without any adjustable parameters.
提出了一个理论,该理论允许我们自洽地计算含有多价和单价电解质的悬浮液中的有效胶体电荷和抗衡离子及共离子密度分布。明确考虑了抗衡离子-共离子簇的形成。该理论预测,带足够强电荷的胶体颗粒将变得过荷。单价电解质的加入会减少抗衡离子的凝聚,并减少电荷反转的量。理论预测与蒙特卡罗模拟进行了比较,结果发现无需可调参数就能极好地吻合。