首页> 外文期刊>The Journal of Chemical Physics >SOLUTION OF THE ASSOCIATIVE MEAN SPHERICAL APPROXIMATION FOR THE SHIELDED STICKY POINT ELECTROLYTE MODEL
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SOLUTION OF THE ASSOCIATIVE MEAN SPHERICAL APPROXIMATION FOR THE SHIELDED STICKY POINT ELECTROLYTE MODEL

机译:盾构粘性点电解质模型的平均均值逼近解

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摘要

An analytical solution of the two-density Omsteia-Zernike (OZ) equation with the associative mean spherical approximation (AMSA) closure is obtained for the shielded sticky point (SSP) electrolyte model. The model is presented by the dimerizing version of the restricted primitive electrolyte model with dimerization which occurs due to the site-site sticky interaction at distances less than the ionic hard-core diameter. The present version of the AMSA is an extension of the associative MSA proposed recently [M. Holovko and Yu. Kalyuzhnyi, Mol. Phys. 73, 1145 (1991)]. It is demonstrated that, in the limit of complete association, the present two-density OZ equation reduces to the Chandler-Silbey-Ladanyi equation. Predictions from the AMSA in this limit are compared with those obtained by Monte Carlo simulations. (C) 1996 American Institute of Physics. [References: 22]
机译:对于屏蔽粘点(SSP)电解质模型,获得了具有关联平均球面近似(AMSA)闭式的两密度Omsteia-Zernike(OZ)方程的解析解。该模型由受限制的原始电解质模型的二聚化形式表示,该模型具有二聚化作用,这是由于在小于离子硬核直径的距离处发生了位点与位点之间的粘性相互作用。 AMSA的当前版本是最近提出的关联MSA的扩展[M.霍洛夫科和于。卡柳日尼,莫尔。物理73,1145(1991)]。结果表明,在完全缔合的极限下,当前的两密度OZ方程可简化为Chandler-Silbey-Ladanyi方程。将来自AMSA的此限制的预测与通过蒙特卡洛模拟获得的预测进行比较。 (C)1996年美国物理研究所。 [参考:22]

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