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A mean field analysis of the static dielectric behavior of linear lower alcohols

机译:线性低级醇静态介电行为的平均场分析

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摘要

The static dielectric responses of methanol,ethanol,and 1-propanol up to 1-hexanol are discussed in terms of a stiff-chain lattice model for the alcohol clusters.An analytical expression for the Kirkwood correlation factor g_K is derived in terms of the canonical partition function associated to the configurational statistics of any of the dimers building up a chain.This allows for the estimate of the dipole moment mu_O of an alcohol molecule in the liquid phase from the temperature dependence of the dielectric constant.All alcohol species appear to be characterized by a dipole moment larger than in the vapor phase.The Kirkwood correlation factor is found to be an increasing function of the alkyl tail length.
机译:根据醇团簇的刚性链晶格模型讨论了甲醇,乙醇和1-丙醇直至1-己醇的静态介电响应。根据典范式推导了柯克伍德相关因子g_K的解析表达式。与构成链的任何二聚体的构型统计量相关的分配函数,这允许根据介电常数的温度依赖性估算液相中醇分子的偶极矩mu_O。所有醇类似乎都是其特征是偶极矩大于汽相。柯克伍德相关因子被发现是烷基尾长的增加函数。

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