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Structural theory of liquid-vapour critical point with application to hard-core Yukawa fluids

机译:蒸汽临界点的结构理论及其在硬核汤河流体中的应用

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摘要

March, Perrot and Tosi [Mol. Phys. 93, 355 (1998)] proposed three structural integrals I 0, I 1 and I 2 to account for the liquid-vapour critical point (LVCP) based on the virial expression for the pressure. The interrelations between these integrals are obtained from the universality of LVCP. We extend the work of March et al. and suggest another structural integral I 3. We also provide analytical expressions for In (n = 0, 1, 2, 3) for hard-core Yukawa fluids based on the series mean spherical approximation. The location of LVCP parameters versus the intermolecular potential range parameter is accurately calculated for three different equations of states. We find good agreement when compared with computer simulation results only for the compressibility equation of state within the mean density approximation. The universality of the critical compressibility ratio at the LVCP is discussed in detail.View full textDownload full textKeywordscritical point parameters, hard-core Yukawa fluids, liquid-vapour equilibrium, structural theory of critical pointRelated var addthis_config = { ui_cobrand: "Taylor & Francis Online", services_compact: "citeulike,netvibes,twitter,technorati,delicious,linkedin,facebook,stumbleupon,digg,google,more", pubid: "ra-4dff56cd6bb1830b" }; Add to shortlist Link Permalink http://dx.doi.org/10.1080/00319104.2011.620250
机译:3月,Perrot和Tosi [Mol。物理93,355(1998)]提出了三个结构积分I 0 ,I 1 和I 2 来解释液蒸气临界点( LVCP)基于病毒表达的压力。这些积分之间的相互关系是从LVCP的普遍性获得的。我们扩展了March等人的工作。并提出另一个结构积分I 3 。我们还提供基于该系列的硬核汤河流体的I n (n = 0、1、2、3)的解析表达式。平均球面近似。对于三种不同的状态方程,可以精确计算出LVCP参数相对于分子间电位范围参数的位置。与计算机模拟结果相比,仅在平均密度近似范围内的状态可压缩性方程中,我们发现了很好的一致性。详细讨论了LVCP的临界压缩比的普遍性。查看全文下载全文关键字临界点参数,硬核Yukawa流体,液-气平衡,临界点的结构理论相关var addthis_config = {ui_cobrand:“ Taylor&Francis Online ”,services_compact:“ citeulike,网络振动,微博,technorati,美味,linkedin,facebook,stumbleupon,digg,google,更多”,发布号:“ ra-4dff56cd6bb1830b”};添加到候选列表链接永久链接http://dx.doi.org/10.1080/00319104.2011.620250

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