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Trace Amounts of Aqueous Copper(II) Chloride Complexes in Hypersaline Solutions: Spectrophotometric and Thermodynamic Studies

机译:高盐溶液中的痕量氯化铜(II)水溶液络合物:分光光度法和热力学研究

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Knowledge of the thermodynamic properties of aqueous copper(II) chloride complexes is important for understanding and quantitatively modeling trace copper behavior in hydrometallurgical extraction processing. In this paper, UV–Vis spectra data of Cu(II) chloride solutions with various salinities (NaCl, 0–5.57 mol?kg~(-1)) are collected at 25 ℃. The concentration distribution of Cu–Cl species is in good agreement with those calculated by a reaction model (RM). The simple hydrated ion, Cu~(2+), is dominant at low concentration, whereas [CuCl]+, [CuCl_2]~0 and [CuCl_3]~- become increasingly important as the chloride concentration rises. Moreover, the RM calculation suggests the present of a small amount of [CuCl_4]~(2-). The de-convoluted molar spectrum of each species is in excellent agreement with our previous theoretical results predicted by time-dependent density functional theory treatment of aqueous Cu-containing systems. The formation constants for these copper chloride complexes have been reported and are to be preferred, except log_(10) K_2 ([CuCl_2]~0).
机译:了解含水氯化铜(II)配合物的热力学性质对于了解和定量建模湿法冶金萃取过程中的痕量铜行为非常重要。本文在25℃下收集了各种盐度(NaCl,0–5.57 mol?kg〜(-1))的氯化铜(II)溶液的UV-Vis光谱数据。 Cu–Cl物种的浓度分布与通过反应模型(RM)计算的浓度分布非常吻合。简单的水合离子Cu〜(2+)在低浓度下占主导地位,而[CuCl] +,[CuCl_2]〜0和[CuCl_3]〜-随着氯化物浓度的升高而变得越来越重要。此外,RM计算表明存在少量[CuCl_4]〜(2-)。每种物质的去卷积摩尔谱与我们以前的理论结果吻合得很好,之前的理论结果是由时变密度泛函理论处理含铜水体系预测的。这些氯化铜配合物的形成常数已有报道,并且是优选的,除了log_(10)K_2([CuCl_2]〜0)。

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