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Comparison of Single- And Multiobjective Design of Experiment in Combinatorial Chemistry for the Selective Dehydrogenation of Propane

机译:丙烷选择性脱氢组合化学实验的单目标和多目标设计比较

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摘要

Two genetic algorithms for the single- and multiobjective design of combinatorial experiments were applied to the optimization of a solid catalyst system active in the selective catalytic oxidation of propane to propylene. The two different optimization strategies, namely, the single objective optimization of the yield and the multiobjective optimization of the conversion and selectivity were implemented and compared. It was observed that the multiobjective approach optimized the yield in a similar way compared to the single objective approach. With respect to the selectivity, however, the multiobjective outperformed the single objective approach. It was also found that by applying the multiobjective optimization more interesting possible combinations were discovered.
机译:将用于组合实验的单目标和多目标设计的两种遗传算法用于优化对丙烷选择性催化氧化为丙烯的固体催化剂体系的优化。并比较了两种不同的优化策略,即产量的单目标优化和转化率和选择性的多目标优化。据观察,与单目标方法相比,多目标方法以相似的方式优化了产量。但是,就选择性而言,多目标优于单目标方法。还发现通过应用多目标优化,发现了更多有趣的可能组合。

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