首页> 外文期刊>Journal of Chemical and Engineering Data: the ACS Journal for Data >Recommended Activity Coefficients and Equivalent Conductivities of Aqueous Hydrochloric Acid in the Concentration Range 5 x 10(-6)-10(-1) M and Temperature Range 5-55 degrees C Based on the DH-SiS and DHO-SiS Theoretical Treatments
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Recommended Activity Coefficients and Equivalent Conductivities of Aqueous Hydrochloric Acid in the Concentration Range 5 x 10(-6)-10(-1) M and Temperature Range 5-55 degrees C Based on the DH-SiS and DHO-SiS Theoretical Treatments

机译:浓度范围为5×10(-6)-10(-1)M和基于DH-SIS和DHO-SIS理论治疗的推荐范围5×10(-6)-10(-1)M和温度范围5-55摄氏度的推荐活动系数和等效电导率

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Thermodynamic properties of aqueous HCl are of great importance in science, technology, and engineering. Ample experimental data exist on the activity and conductivity of the acid, and empirical expressions are offered as interpolation equations for computing those data at the desired concentration and temperature. The DH-SiS theory (Fraenkel Mot. Phys. 2010, 108, 1435), extending the Debye-Hiickel theory by considering the smaller-ion shell (SiS) around the chosen ion, has afforded successful fit to activity coefficients of aqueous and nonaqueous HCl solutions (Fraenkel J. Phys. Chem. B 2011, 115, 557, 14634). Here, I analyze equivalent conductivities of the acid by the DHO-SiS theory (Fraenkel Phys. Chem. Chem. Phys. 2018, 20, 29896) that incorporates the SiS concept into the Debye-Hiickel-Onsager theory. The interrelation of DHO -SiS and DH-SiS allows computation of activity from conductivity and vice versa. Thus, I propose recommended values of activity coefficients, equivalent conductivities, and pH of HCl(aq) within the concentration and temperature ranges of the paper's title. These theoretical values accurately reproduce the corresponding experimental values, but they stem from analytic mathematical equations with no adjustable parameters, instead of from empirical or semiempirical expressions containing adjustable parameters and/or coefficients of no clear physical meaning.
机译:盐酸水溶液的热力学性质在科学、技术和工程中具有重要意义。关于酸的活性和导电性有大量的实验数据,并提供了经验表达式作为插值方程,用于在所需浓度和温度下计算这些数据。DH-SiS理论(Fraenkel Mot.Phys.20101081435)通过考虑所选离子周围较小的离子壳层(SiS)来扩展德拜-希克尔理论,成功地拟合了水和非水HCl溶液的活度系数(Fraenkel J.Phys.Chem.B 2011,11555714634)。在这里,我通过DHO-SiS理论(Fraenkel Phys.Chem.Chem.Phys.2018,2029896)分析酸的等效电导率,该理论将SiS概念纳入德拜-希克尔-昂萨格理论。DHO-SiS和DH-SiS的相互关系允许从电导率计算活性,反之亦然。因此,我提出了在论文标题的浓度和温度范围内,HCl(aq)的活度系数、等效电导率和pH值的建议值。这些理论值准确地再现了相应的实验值,但它们来自没有可调参数的解析数学方程,而不是来自包含可调参数和/或没有明确物理意义的系数的经验或半经验表达式。

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