离子液体中CO2吸收的人工神经网络建模

Mohd Aizad Ahmad, M. Fariz, Noorhaliza Aziz, N. Ajib
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摘要

在这项工作中,研究了人工神经网络(ANN)在广泛操作条件下预测离子液体(IL)溶液中二氧化碳(CO2)吸收的潜在应用。选取温度、CO2分压、分子量、非中心值、临界温度和临界压力等物理性质作为输入数据,从文献中收集184个数据点的CO2溶解度实验数据(用于训练、验证和测试阶段),获得网络。为了得到发展最好的人工神经网络模型,对由传递函数、训练函数、神经元数和隐藏层组成的训练网络进行了操作。最优网络(MSE=2.9336×10−5,MRE=0.007297, R=0.99977, R2=0.9994)采用Levenberg-Marquardt反向传播算法进行训练,其中Tan-sigmoid传递函数具有两层隐含层,第一层和第二层分别为6和12个神经元。并将每一个预测数据与各自的实验数据进行对比,最高百分比偏差仅小于6%。此外,通过来自三种不同类型IL ([bmim][PF6], [emim][Tf2N]和[C4mim] [DCA])的104个数据集考察了模型的扩展能力。结果表明,所建立的人工神经网络模型能够准确预测不同类型IL的CO2吸收量。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
The modeling of CO2 absorption in ionic liquids using Artificial Neural Network
In this work, the potential application of Artificial Neural Network (ANN) was studied to predict the absorption of Carbon Dioxide (CO2) in Ionic Liquid (IL) solutions over wide-ranging operating conditions. A few physical properties had been chosen as input data which were temperature, partial pressure of CO2, molecular weight, acentric value, critical temperature and critical pressure of IL. A sample of 184 experimental data points of the solubility of CO2 is collected from literatures (for training, validation and testing stages) to acquire the network. In order to obtain the best developed ANN model, the trained network comprising of transfer function, training function, number of neurons and hidden layers had been manipulated. The best network (MSE=2.9336×10−5, MRE=0.007297, R=0.99977 and R2=0.9994) was trained by Levenberg-Marquardt backpropagation algorithm with Tan-sigmoid transfer function having two hidden layers, 6 and 12 neurons for first and second layer respectively. Besides, every single predicted data was compared to its respective experimental data and recorded the highest percentage deviation only less than 6%. Moreover, the extension capability of the model was investigated by additional data 104 data sets from three different types of IL ([bmim][PF6], [emim][Tf2N] and [C4mim] [DCA]). The results indicate that the acquired ANN model has power to forecast precisely the CO2 absorption in different types of IL.
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