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Artificial neural network methods for the estimation of zeolite molar compositions that form from different reaction mixtures

机译:人工神经网络方法估算由不同反应混合物形成的沸石摩尔组成

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The possibility of using artificial neural network(ANNs)methods for the estimation of the zeolite molar composition and hence the zeolite phase that may be obtained from a certain initial reaction mixture composition was investigated.Three different artificial neural network methods,namely feed forward back propagation(FFBP),radial basis function-based neural networks(RBF)and generalized regression neural networks(GRNN),were tested for this purpose.A data set obtained from the literature was used in the training of the neural networks.The results obtained for a second data set were compared to experimental findings as well as to estimations made by using multilinear and non-linear regression.It was determined that the neural networks learn quite efficiently from experimental zeolite synthesis data.The predictions made by using artificial neural network methods were,in general,more reliable than those performed by regression.The best prediction of the Si contents of the zeolites investigated were made by the GRNN and FFBP methods while the H_2O content was predicted better by the RBF method.The results indicate that using artificial neural network methods may decrease significantly the number of experiments that have to be performed to discover new synthesis compositions.
机译:研究了使用人工神经网络(ANNs)方法估算沸石摩尔组成以及由此可能从某一初始反应混合物组成获得的沸石相的可能性。三种不同的人工神经网络方法,即前馈回传为此,对基于径向基函数的神经网络(RBF)和广义回归神经网络(GRNN)(FFBP)进行了测试。从文献中获得的数据集用于神经网络的训练。将第二个数据集与实验结果以及使用多线性和非线性回归进行的估计进行比较。确定了神经网络从实验沸石合成数据中学习得非常有效。使用人工神经网络方法进行的预测是,通常比回归分析更可靠。预测沸石分子筛中硅含量的最佳方法GRNN和FFBP方法进行了门控,而RBF方法预测了H_2O含量更好。结果表明,使用人工神经网络方法可以显着减少为发现新的合成成分而必须进行的实验数量。

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