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Steady-state kinetics of the NO-CO reaction on Rh(111): extrapolation from 10~(-10) to 1 bar

机译:NO-CO反应在Rh(111)上的稳态动力学:从10〜(-10)外推至1 bar

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Ultrahigh vacuum studies indicate that the mechanism of the NO-CO reaction on Rh(111) involves reversible adsorption of NO and CO, NO decomposition, nitrogen desorption, and a Langmuir-Hinshelwood reaction between CO and oxygen. Employing available experimental data for the rate constants of these steps, we have calculated the steady-state reaction kinetics in a wide range of pressures and temperatures. At relatively high pressures (P_(NO) ≈ P_(CO) ≈ 0.01 bar), the results of simulations are in marginal agreement with the experimental data. Analyzing the difference between the theory and experiment makes it possible to understand the type of changes which might be introduced into the model in order to improve the agreement with the experiment.
机译:超高真空研究表明,Rh(111)上的NO-CO反应机理涉及NO和CO的可逆吸附,NO分解,氮解吸以及CO和氧之间的Langmuir-Hinshelwood反应。利用这些步骤的速率常数的可用实验数据,我们已经计算出了各种压力和温度下的稳态反应动力学。在相对较高的压力下(P_(NO)≈P_(CO)≈0.01 bar),模拟结果与实验数据略有一致。分析理论与实验之间的差异可以了解可能会引入模型中的更改类型,以提高与实验的一致性。

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