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Kinetic Study of Product Distribution Using Various Data-Driven and Statistical Models for Fischer–Tropsch Synthesis

[Image: see text] Three modeling techniques, namely, a radial basis function neural network (RBFNN), a comprehensive kinetic with genetic algorithm (CKGA), and a response surface methodology (RSM), were used to study the kinetics of Fischer–Tropsch (FT) synthesis. Using a 29 × 37 (4 independent proc...

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Autores principales: Wang, Yixiao, Hu, Jing, Zhang, Xiyue, Yusuf, Abubakar, Qi, Binbin, Jin, Huan, Liu, Yiyang, He, Jun, Wang, Yunshan, Yang, Gang, Sun, Yong
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8529696/
https://www.ncbi.nlm.nih.gov/pubmed/34693138
http://dx.doi.org/10.1021/acsomega.1c03851
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author Wang, Yixiao
Hu, Jing
Zhang, Xiyue
Yusuf, Abubakar
Qi, Binbin
Jin, Huan
Liu, Yiyang
He, Jun
Wang, Yunshan
Yang, Gang
Sun, Yong
author_facet Wang, Yixiao
Hu, Jing
Zhang, Xiyue
Yusuf, Abubakar
Qi, Binbin
Jin, Huan
Liu, Yiyang
He, Jun
Wang, Yunshan
Yang, Gang
Sun, Yong
author_sort Wang, Yixiao
collection PubMed
description [Image: see text] Three modeling techniques, namely, a radial basis function neural network (RBFNN), a comprehensive kinetic with genetic algorithm (CKGA), and a response surface methodology (RSM), were used to study the kinetics of Fischer–Tropsch (FT) synthesis. Using a 29 × 37 (4 independent process parameters as inputs and corresponding 36 responses as outputs) matrix with total 1073 data sets for data training through RBFNN, the established model is capable of predicting hydrocarbon product distribution i.e., the paraffin formation rate (C(2)–C(15)) and the olefin to paraffin ratio (OPR) within acceptable uncertainties. With additional validation data sets (15 × 36 matrix with total 540 data sets), the uncertainties of using three different models were compared and the outcomes were: RBFNN (±5% uncertainties), RSM (±10% uncertainties), and CKGA (±30% uncertainties), respectively. A new effective strategy for kinetic study of the complex FT synthesis is proposed: RBFNN is used for data matrix generation with a limited number of experimental data sets (due to its fast converge and less computation time), CKGA is used for mechanism selections by the Langmuir–Hinshelwood–Hougen–Watson (LHHW) approach using a genetic algorithm to find out potential reaction pathways, and RSM is used for statistical analysis of the investigated data matrix (generated from RBFNN through central composite design) upon responses and subsequent singular/multiple optimizations. The proposed strategy is a very useful and practical tool in process engineering design and practice for the product distribution during FT synthesis.
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spelling pubmed-85296962021-10-22 Kinetic Study of Product Distribution Using Various Data-Driven and Statistical Models for Fischer–Tropsch Synthesis Wang, Yixiao Hu, Jing Zhang, Xiyue Yusuf, Abubakar Qi, Binbin Jin, Huan Liu, Yiyang He, Jun Wang, Yunshan Yang, Gang Sun, Yong ACS Omega [Image: see text] Three modeling techniques, namely, a radial basis function neural network (RBFNN), a comprehensive kinetic with genetic algorithm (CKGA), and a response surface methodology (RSM), were used to study the kinetics of Fischer–Tropsch (FT) synthesis. Using a 29 × 37 (4 independent process parameters as inputs and corresponding 36 responses as outputs) matrix with total 1073 data sets for data training through RBFNN, the established model is capable of predicting hydrocarbon product distribution i.e., the paraffin formation rate (C(2)–C(15)) and the olefin to paraffin ratio (OPR) within acceptable uncertainties. With additional validation data sets (15 × 36 matrix with total 540 data sets), the uncertainties of using three different models were compared and the outcomes were: RBFNN (±5% uncertainties), RSM (±10% uncertainties), and CKGA (±30% uncertainties), respectively. A new effective strategy for kinetic study of the complex FT synthesis is proposed: RBFNN is used for data matrix generation with a limited number of experimental data sets (due to its fast converge and less computation time), CKGA is used for mechanism selections by the Langmuir–Hinshelwood–Hougen–Watson (LHHW) approach using a genetic algorithm to find out potential reaction pathways, and RSM is used for statistical analysis of the investigated data matrix (generated from RBFNN through central composite design) upon responses and subsequent singular/multiple optimizations. The proposed strategy is a very useful and practical tool in process engineering design and practice for the product distribution during FT synthesis. American Chemical Society 2021-10-04 /pmc/articles/PMC8529696/ /pubmed/34693138 http://dx.doi.org/10.1021/acsomega.1c03851 Text en © 2021 The Authors. Published by American Chemical Society https://creativecommons.org/licenses/by-nc-nd/4.0/Permits non-commercial access and re-use, provided that author attribution and integrity are maintained; but does not permit creation of adaptations or other derivative works (https://creativecommons.org/licenses/by-nc-nd/4.0/).
spellingShingle Wang, Yixiao
Hu, Jing
Zhang, Xiyue
Yusuf, Abubakar
Qi, Binbin
Jin, Huan
Liu, Yiyang
He, Jun
Wang, Yunshan
Yang, Gang
Sun, Yong
Kinetic Study of Product Distribution Using Various Data-Driven and Statistical Models for Fischer–Tropsch Synthesis
title Kinetic Study of Product Distribution Using Various Data-Driven and Statistical Models for Fischer–Tropsch Synthesis
title_full Kinetic Study of Product Distribution Using Various Data-Driven and Statistical Models for Fischer–Tropsch Synthesis
title_fullStr Kinetic Study of Product Distribution Using Various Data-Driven and Statistical Models for Fischer–Tropsch Synthesis
title_full_unstemmed Kinetic Study of Product Distribution Using Various Data-Driven and Statistical Models for Fischer–Tropsch Synthesis
title_short Kinetic Study of Product Distribution Using Various Data-Driven and Statistical Models for Fischer–Tropsch Synthesis
title_sort kinetic study of product distribution using various data-driven and statistical models for fischer–tropsch synthesis
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8529696/
https://www.ncbi.nlm.nih.gov/pubmed/34693138
http://dx.doi.org/10.1021/acsomega.1c03851
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