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Numerical simulation of voltammetry focusing on the effect of initial concentration of products in reversible systems with complex stoichiometry _1

机译:伏安法数值模拟的重点是复杂化学计量比的可逆系统中产物初始浓度的影响_1

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The effect of initial concentration of products in a general reaction of reversible process with complex stoichiometry expressed as mO + ne - →qR was evaluated using numerical simulations with various complex stoichiometric coefficients m and q of oxidized (O) and reduced (R) species, respectively, and with various initial concentrations. In the simulations, the transform of voltammograms according to changes in the initial concentrations were characterized by the parameter γφ (= C~* O (DO)~(1/2)/C~* R (DR)~(1/2)) for any stoichi- ometric system. Based on the simulation results, empirical relations were obtained for (1) peak potential involving parameters for stoichiometry (m and q) and for the initial conditions (γφs), and (2) peak current.
机译:使用具有多种复杂化学计量系数m和q的氧化(O)和还原(R)物种的数值模拟,评估了在具有化学计量比的mO + ne-→qR的可逆过程的一般反应中产物初始浓度的影响,分别具有各种初始浓度。在模拟中,伏安图根据初始浓度变化的变换用参数γφ(= C〜* O(DO)〜(1/2)/ C〜* R(DR)〜(1/2)来表征。 )用于任何化学计量系统。基于仿真结果,获得了以下经验关系:(1)涉及化学计量参数(m和q)和初始条件(γφs)的峰值电势,以及(2)峰值电流。

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