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A Lexicographic Search Algorithm for Synthesis of Four Reaction Clusters for Water Decomposition

机译:一种用于水分解的四个反应簇合成的词典搜索算法

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摘要

Most of the studies on water decomposition currently deal with clusters composed of three or less reactions,but four of five reaction clusters are also being experimented.A method is proposed in this paper,which expands the previously proposed lexicographic search algorithm so that clusters composed of four reactions can be sought in spite of combinatorial explosion.As a case study,this method is applied to a set of thermodynamically feasible reactions,and shows that it can generate a lot of candidate clusters that are feasible at relatively low temperatures.If the proposed search algorithm is applied to a set of reactions whose operability is confirmed,it is expected to be able to synthesize efficient reaction clusters for water decomposition.
机译:目前大多数关于水分解的研究都是针对由三个或三个以下反应组成的簇,但也正在对五个反应簇中的四个进行实验。本文提出了一种方法,该方法扩展了先前提出的词典搜索算法,使得由尽管有组合爆炸,但仍可找到四个反应。作为案例研究,该方法应用于一组热力学上可行的反应,并表明它可以生成许多在较低温度下可行的候选簇。搜索算法应用于已确认可操作性的一组反应,有望能够合成用于水分解的有效反应簇。

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