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Determination of density and conductivity of the binary mixtures of the ionic liquid l,2-dimethyl-3-hexylimidazolium bis(trifluoromethylsulfonyl)imide and dimethyl carbonate via mole fraction and temperature

机译:通过摩尔分数和温度测定离子液体l,2-二甲基-3-己咪唑双(三氟甲基磺酰基)酰亚胺和碳酸二甲酯的二元混合物的密度和电导率

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摘要

Modeling of both conductivity, σ, and density, p, as a function of mole fraction, x, and temperature, T, is a crucial method to determine the physical properties of ionic liquids. The first objective of this work was to find out an applicable method of using x and T to predict the p of the binary mixtures of l,2-dimethyl-3-hexylimidazolium bis(trifluoromethylsul-fonyl)imide ([DMHIM][Tf2N]) and dimethyl carbonate (DMC). Predicated on non-linear curve fitting, a typical numerical method is used to quantitatively analyze the × together with T-dependent p. The simulations agree very well with the observed spectra (p versus both x and 7). The second objective of this work was to find out the mathematical relationships between the × as well as T and the σ of [DMHIM][Tf2N] (1)+DMC(2). Based on the calculated results from the nonlinear curve fitting method, the x and T-dependent a is theoretically explained successfully via one function. The minimum correlation coefficient between the actual and calculated data is 0.971. The average relative errors between the measured and modeled quantities do not exceed 7.72 % in all considered cases. To my knowledge, the effects of the × and T on the change of both the σ and the p of ionic liquids are quantitatively discussed for the first time.
机译:电导率σ和密度p随摩尔分数x和温度T的变化模型,是确定离子液体物理性质的关键方法。这项工作的首要目标是找到一种使用x和T来预测l,2-二甲基-3-己基咪唑双(三氟甲基硫代甲酰基)酰亚胺的二元混合物的p的适用方法([DMHIM] [Tf2N] )和碳酸二甲酯(DMC)。以非线性曲线拟合为基础,使用典型的数值方法定量分析x和与T有关的p。模拟与观察到的光谱非常吻合(p相对于x和7)。这项工作的第二个目标是找出[DMHIM] [Tf2N](1)+ DMC(2)的×和T与σ之间的数学关系。基于非线性曲线拟合方法的计算结果,可以通过一个函数在理论上成功解释x和T依赖的a。实际数据与计算数据之间的最小相关系数为0.971。在所有考虑的情况下,测量数量与建模数量之间的平均相对误差均不超过7.72%。据我所知,首次定量讨论了×和T对离子液体σ和p的变化的影响。

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