{"title":"利用包含催化剂失活的离散包络动力学数学模型模拟工业加氢裂化装置","authors":"Zhenming Li, Kang Qin, Mingfeng Li, Dong Guan","doi":"10.1007/s11144-024-02729-4","DOIUrl":null,"url":null,"abstract":"<div><p>The purpose of this work was to establish a process model of a vacuum gas oil industrial hydrocracking. In this model, we divide the lumps by 10 K as the interval, the reaction kinetics model is established based on discrete lumping method. Besides, a relevant catalyst deactivation function for catalyst activity calculation was proposed, which includes the flow and properties of the feed for a long period. The simulated hydrocracking unit is the process with hydrotreating and hydrocracking reactors in series. Therefore, it is necessary to build a hydrotreating model to represent the feed oil properties at the inlet of the hydrocracking reactor. Owing to absence industrial hydrotreating reactor monitor data, the hydrotreating model is established by using the data of the pilot plant loaded with the same catalyst. The hydrocracking reactor model is established through the material balance, heat balance, and momentum balance equations. Multiple sets of data are used to verify the established hydrocracking reactor model, the errors between the calculated value and the actual value of hydrocracking products are basically less than 10 %, and the relative errors of the predicted temperature and pressure are less than 0.5 %. Based on the catalyst deactivation function, the average relative errors of the model can be reduced by 50%. The variation of the reactor along the height is analyzed, and the result shows that the model accuracy simulated the target hydrocracking unit.</p><h3>Graphical abstract</h3>\n<div><figure><div><div><picture><source><img></source></picture></div></div></figure></div></div>","PeriodicalId":750,"journal":{"name":"Reaction Kinetics, Mechanisms and Catalysis","volume":"137 6","pages":"3297 - 3320"},"PeriodicalIF":1.7000,"publicationDate":"2024-09-25","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Simulation of an industrial hydrocracking unit by discrete lumping kinetics mathematical model incorporating catalyst deactivation\",\"authors\":\"Zhenming Li, Kang Qin, Mingfeng Li, Dong Guan\",\"doi\":\"10.1007/s11144-024-02729-4\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>The purpose of this work was to establish a process model of a vacuum gas oil industrial hydrocracking. In this model, we divide the lumps by 10 K as the interval, the reaction kinetics model is established based on discrete lumping method. Besides, a relevant catalyst deactivation function for catalyst activity calculation was proposed, which includes the flow and properties of the feed for a long period. The simulated hydrocracking unit is the process with hydrotreating and hydrocracking reactors in series. Therefore, it is necessary to build a hydrotreating model to represent the feed oil properties at the inlet of the hydrocracking reactor. Owing to absence industrial hydrotreating reactor monitor data, the hydrotreating model is established by using the data of the pilot plant loaded with the same catalyst. The hydrocracking reactor model is established through the material balance, heat balance, and momentum balance equations. Multiple sets of data are used to verify the established hydrocracking reactor model, the errors between the calculated value and the actual value of hydrocracking products are basically less than 10 %, and the relative errors of the predicted temperature and pressure are less than 0.5 %. Based on the catalyst deactivation function, the average relative errors of the model can be reduced by 50%. The variation of the reactor along the height is analyzed, and the result shows that the model accuracy simulated the target hydrocracking unit.</p><h3>Graphical abstract</h3>\\n<div><figure><div><div><picture><source><img></source></picture></div></div></figure></div></div>\",\"PeriodicalId\":750,\"journal\":{\"name\":\"Reaction Kinetics, Mechanisms and Catalysis\",\"volume\":\"137 6\",\"pages\":\"3297 - 3320\"},\"PeriodicalIF\":1.7000,\"publicationDate\":\"2024-09-25\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Reaction Kinetics, Mechanisms and Catalysis\",\"FirstCategoryId\":\"92\",\"ListUrlMain\":\"https://link.springer.com/article/10.1007/s11144-024-02729-4\",\"RegionNum\":4,\"RegionCategory\":\"化学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q4\",\"JCRName\":\"CHEMISTRY, PHYSICAL\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Reaction Kinetics, Mechanisms and Catalysis","FirstCategoryId":"92","ListUrlMain":"https://link.springer.com/article/10.1007/s11144-024-02729-4","RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q4","JCRName":"CHEMISTRY, PHYSICAL","Score":null,"Total":0}
引用次数: 0
摘要
这项工作的目的是建立一个真空气油工业加氢裂化过程模型。在该模型中,我们以 10 K 为区间划分块体,基于离散块体法建立了反应动力学模型。此外,还提出了用于计算催化剂活性的相关催化剂失活函数,其中包括长期进料的流量和性质。模拟加氢裂化装置是将加氢处理和加氢裂化反应器串联在一起的工艺。因此,有必要建立一个加氢处理模型,以表示加氢裂化反应器入口处的原料油特性。由于缺乏工业加氢处理反应器的监测数据,加氢处理模型是通过使用装载相同催化剂的试验工厂的数据建立的。加氢裂化反应器模型是通过物料平衡、热平衡和动量平衡方程建立的。利用多组数据验证了所建立的加氢裂化反应器模型,加氢裂化产物的计算值与实际值之间的误差基本小于 10%,预测温度和压力的相对误差小于 0.5%。基于催化剂失活功能,模型的平均相对误差可减少 50%。分析了反应器沿高度方向的变化,结果表明模型准确模拟了目标加氢裂化装置。
Simulation of an industrial hydrocracking unit by discrete lumping kinetics mathematical model incorporating catalyst deactivation
The purpose of this work was to establish a process model of a vacuum gas oil industrial hydrocracking. In this model, we divide the lumps by 10 K as the interval, the reaction kinetics model is established based on discrete lumping method. Besides, a relevant catalyst deactivation function for catalyst activity calculation was proposed, which includes the flow and properties of the feed for a long period. The simulated hydrocracking unit is the process with hydrotreating and hydrocracking reactors in series. Therefore, it is necessary to build a hydrotreating model to represent the feed oil properties at the inlet of the hydrocracking reactor. Owing to absence industrial hydrotreating reactor monitor data, the hydrotreating model is established by using the data of the pilot plant loaded with the same catalyst. The hydrocracking reactor model is established through the material balance, heat balance, and momentum balance equations. Multiple sets of data are used to verify the established hydrocracking reactor model, the errors between the calculated value and the actual value of hydrocracking products are basically less than 10 %, and the relative errors of the predicted temperature and pressure are less than 0.5 %. Based on the catalyst deactivation function, the average relative errors of the model can be reduced by 50%. The variation of the reactor along the height is analyzed, and the result shows that the model accuracy simulated the target hydrocracking unit.
期刊介绍:
Reaction Kinetics, Mechanisms and Catalysis is a medium for original contributions in the following fields:
-kinetics of homogeneous reactions in gas, liquid and solid phase;
-Homogeneous catalysis;
-Heterogeneous catalysis;
-Adsorption in heterogeneous catalysis;
-Transport processes related to reaction kinetics and catalysis;
-Preparation and study of catalysts;
-Reactors and apparatus.
Reaction Kinetics, Mechanisms and Catalysis was formerly published under the title Reaction Kinetics and Catalysis Letters.