流体通过分段常值势相互作用的函数近似
Rational-function approximation for fluids interacting via piece-wise constant potentials
摘要:
流体的结构特性,其分子通过潜在的硬核心加上n分段恒定的部分不同的宽度和高度的相互作用,使用(半解析)的有理函数近似方法。结果示出的情况下,一个方肩加方势阱和移位方势阱和模拟数据和那些遵循的(数值)解决方案的打击-Yevick积分方程进行比较。
英文摘要:
The structural properties of fluids whose molecules interact via potentials with a hard-core plus n piece-wise constant sections of different widths and heights are derived using a (semi-analytical) rational-function approximation method. The results are illustrated for the cases of a square-shoulder plus square-well potential and a shifted square-well potential and compared both with simulation data and with those that follow from the (numerical) solutions of the Percus-Yevick integral equation.
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